*HEADER    TRANSPORT PROTEIN                       30-JUN-10   2L08              
*TITLE     SOLUTION NMR STRUCTURE OF NONSENSE MRNA REDUCING FACTOR 3A FROM H.    
*TITLE    2 SAPIENS, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET HR4714B     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: REGULATOR OF NONSENSE TRANSCRIPTS 3A;                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SEQUENCE DATABASE RESIDUES 70-155;                         
*COMPND   5 SYNONYM: NONSENSE MRNA REDUCING FACTOR 3A, UP-FRAMESHIFT SUPPRESSOR 3
*COMPND   6 HOMOLOG A, HUPF3;                                                    
*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: UPF3A, RENT3A, UPF3;                                           
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)+ MAGIC;                          
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET 15-15C                                 
*KEYWDS    NESG, NONSENSE REGULATOR, STRUCTURAL GENOMICS, PSI-2, PROTEIN         
*KEYWDS   2 STRUCTURE INITIATIVE, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM,      
*KEYWDS   3 TRANSPORT PROTEIN                                                    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    R.MANI, L.MAO, C.CICCOSANTI, R.SHASTRY, T.B.ACTON, R.XIAO,            
*AUTHOR   2 G.V.T.SWAPNA, J.K.EVERETT, G.T.MONTELIONE, NORTHEAST STRUCTURAL      
*AUTHOR   3 GENOMICS CONSORTIUM (NESG)                                           
*REVDAT   1   11-AUG-10 2L08    0                                                


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 assign (( resid  27 and name HA   )) (( resid  29 and name HN   ))  4.56  2.76  0.91
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 assign (( resid  30 and name HN   )) (( resid  31 and name HN   ))  2.99  1.19  0.60
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 assign (( resid  30 and name HN   )) (( resid  30 and name HG   ))  3.48  1.68  0.70
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 assign (( resid  31 and name HN   )) (( resid  32 and name HD1  ))  5.42  3.62  1.08
 assign (( resid  32 and name HD2  )) (( resid  33 and name HN   ))  4.83  3.03  0.97
 assign (( resid  32 and name HG1  )) (( resid  33 and name HN   ))  5.08  3.28  1.02
 assign (( resid  33 and name HN   )) (( resid  33 and name HB2  ))  3.74  1.94  0.75
 assign (( resid  34 and name HB1  )) (( resid  35 and name HN   ))  4.61  2.81  0.92
 assign (( resid  21 and name HB2  )) (( resid  29 and name HE22 ))  5.38  3.58  1.08
 assign (( resid  36 and name HA   )) (( resid  37 and name HN   ))  3.48  1.68  0.70
 assign (( resid  36 and name HB1  )) (( resid  37 and name HN   ))  3.90  2.10  0.78
 assign (( resid  37 and name HN   )) (( resid  38 and name HN   ))  4.75  2.95  0.95
 assign (( resid  37 and name HN   )) (( resid  61 and name HN   ))  4.62  2.82  0.92
 assign (( resid  36 and name HB2  )) (( resid  37 and name HN   ))  3.90  2.10  0.78
 assign (( resid  37 and name HN   )) (( resid  37 and name HB2  ))  4.14  2.34  0.83
 assign (( resid  37 and name HN   )) (( resid  37 and name HB1  ))  4.14  2.34  0.83
 assign (( resid  38 and name HN   )) (( resid  39 and name HN   ))  4.68  2.88  0.94
 assign (( resid  38 and name HA   )) (( resid  39 and name HN   ))  3.43  1.63  0.69
 assign (( resid  38 and name HB1  )) (( resid  39 and name HN   ))  4.79  2.99  0.96
 assign (( resid  38 and name HB2  )) (( resid  39 and name HN   ))  4.60  2.80  0.92
 assign (( resid  39 and name HN   )) (( resid  41 and name HE1  ))  4.47  2.67  0.89
 assign (( resid  39 and name HA   )) (( resid  40 and name HN   ))  3.18  1.38  0.64
 assign (( resid  39 and name HB1  )) (( resid  40 and name HN   ))  3.83  2.03  0.77
 assign (( resid  39 and name HD2  )) (( resid  59 and name HN   ))  5.08  3.28  1.02
 assign (( resid  41 and name HD1  )) (( resid  57 and name HN   ))  4.46  2.66  0.89
 assign (( resid  39 and name HN   )) (( resid  40 and name HN   ))  4.64  2.84  0.93
 assign (( resid  40 and name HA   )) (( resid  41 and name HN   ))  3.16  1.36  0.63
 assign (( resid  40 and name HN   )) (( resid  40 and name HB1  ))  4.08  2.28  0.82
 assign (( resid  40 and name HB1  )) (( resid  41 and name HN   ))  4.46  2.66  0.89
 assign (( resid  40 and name HB2  )) (( resid  41 and name HN   ))  3.76  1.96  0.75
 assign (( resid  40 and name HN   )) (( resid  40 and name HG1  ))  4.43  2.63  0.89
 assign (( resid  40 and name HG1  )) (( resid  41 and name HN   ))  4.20  2.40  0.84
 assign (( resid  40 and name HG2  )) (( resid  57 and name HN   ))  4.96  3.16  0.99
 assign (( resid  41 and name HA   )) (( resid  42 and name HN   ))  3.26  1.46  0.65
 assign (( resid  41 and name HN   )) (( resid  41 and name HB2  ))  3.70  1.90  0.74
 assign (( resid  41 and name HN   )) (( resid  41 and name HB1  ))  3.89  2.09  0.78
 assign (( resid  41 and name HB1  )) (( resid  42 and name HN   ))  4.36  2.56  0.87
 assign (( resid  42 and name HN   )) (( resid  43 and name HN   ))  4.66  2.86  0.93
 assign (( resid  42 and name HA   )) (( resid  43 and name HN   ))  3.12  1.32  0.62
 assign (( resid  42 and name HB1  )) (( resid  56 and name HN   ))  5.83  4.03  1.17
 assign (( resid  42 and name HD1  )) (( resid  43 and name HN   ))  4.18  2.38  0.84
 assign (( resid  42 and name HD1  )) (( resid  44 and name HN   ))  4.70  2.90  0.94
 assign (( resid  42 and name HD2  )) (( resid  55 and name HN   ))  4.31  2.51  0.86
 assign (( resid  43 and name HN   )) (( resid  44 and name HN   ))  4.59  2.79  0.92
 assign (( resid  43 and name HA   )) (( resid  44 and name HN   ))  3.32  1.52  0.66
 assign (( resid  21 and name HN   )) (( resid  46 and name HB1  ))  3.90  2.10  0.78
 assign (( resid  53 and name HA   )) (( resid  54 and name HN   ))  3.56  1.76  0.71
 assign (( resid  53 and name HB2  )) (( resid  54 and name HN   ))  4.10  2.30  0.82
 assign (( resid  53 and name HB1  )) (( resid  54 and name HN   ))  4.10  2.30  0.82
 assign (( resid  55 and name HA   )) (( resid  56 and name HN   ))  3.50  1.70  0.70
 assign (( resid  55 and name HN   )) (( resid  56 and name HN   ))  6.50  4.70  1.30
 assign (( resid  56 and name HA   )) (( resid  57 and name HN   ))  3.33  1.53  0.67
 assign (( resid  14 and name HN   )) (( resid  56 and name HB*  ))  5.29  3.49  1.06
 assign (( resid  14 and name HN   )) (( resid  57 and name HA   ))  4.31  2.51  0.86
 assign (( resid  57 and name HB2  )) (( resid  58 and name HN   ))  4.53  2.73  0.91
 assign (( resid  58 and name HN   )) (( resid  59 and name HN   ))  4.50  2.70  0.90
 assign (( resid  39 and name HN   )) (( resid  58 and name HA   ))  3.67  1.87  0.73
 assign (( resid  13 and name HG1* )) (( resid  58 and name HN   ))  4.15  2.35  0.83
 assign (( resid  14 and name HG2* )) (( resid  58 and name HN   ))  4.59  2.79  0.92
 assign (( resid  58 and name HN   )) (( resid  58 and name HG12 ))  4.88  3.08  0.98
 assign (( resid  14 and name HN   )) (( resid  58 and name HG11 ))  6.50  4.70  1.30
 assign (( resid  39 and name HN   )) (( resid  58 and name HG2* ))  4.86  3.06  0.97
 assign (( resid  37 and name HN   )) (( resid  58 and name HG2* ))  5.40  3.60  1.08
 assign (( resid  58 and name HN   )) (( resid  59 and name HA   ))  4.82  3.02  0.96
 assign (( resid  59 and name HB2  )) (( resid  60 and name HN   ))  5.21  3.41  1.04
 assign (( resid  59 and name HN   )) (( resid  60 and name HN   ))  4.75  2.95  0.95
 assign (( resid  61 and name HN   )) (( resid  62 and name HN   ))  3.99  2.19  0.80
 assign (( resid  37 and name HN   )) (( resid  61 and name HA   ))  5.14  3.34  1.03
 assign (( resid  61 and name HB1  )) (( resid  62 and name HN   ))  4.20  2.40  0.84
 assign (( resid  61 and name HN   )) (( resid  61 and name HB2  ))  3.92  2.12  0.78
 assign (( resid  61 and name HB2  )) (( resid  62 and name HN   ))  3.86  2.06  0.77
 assign (( resid  62 and name HA   )) (( resid  62 and name HD22 ))  4.90  3.10  0.98
 assign (( resid  62 and name HA   )) (( resid  64 and name HN   ))  4.34  2.54  0.87
 assign (( resid  62 and name HN   )) (( resid  62 and name HB1  ))  3.61  1.81  0.72
 assign (( resid  70 and name HD1  )) (( resid  71 and name HN   ))  5.11  3.31  1.02
 assign (( resid  62 and name HB1  )) (( resid  65 and name HN   ))  4.17  2.37  0.83
 assign (( resid  61 and name HN   )) (( resid  62 and name HB2  ))  5.09  3.29  1.02
 assign (( resid  60 and name HB1  )) (( resid  62 and name HN   ))  3.86  2.06  0.77
 assign (( resid  62 and name HN   )) (( resid  62 and name HD21 ))  5.19  3.39  1.04
 assign (( resid  62 and name HD21 )) (( resid  64 and name HN   ))  4.16  2.36  0.83
 assign (( resid  63 and name HA   )) (( resid  65 and name HN   ))  4.18  2.38  0.84
 assign (( resid  63 and name HA   )) (( resid  66 and name HN   ))  4.27  2.47  0.85
 assign (( resid  62 and name HN   )) (( resid  63 and name HA   ))  5.48  3.68  1.10
 assign (( resid  62 and name HN   )) (( resid  63 and name HD1  ))  5.77  3.97  1.15
 assign (( resid  62 and name HN   )) (( resid  63 and name HD2  ))  5.06  3.26  1.01
 assign (( resid  63 and name HD2  )) (( resid  64 and name HN   ))  4.08  2.28  0.82
 assign (( resid  63 and name HD2  )) (( resid  65 and name HN   ))  4.73  2.93  0.95
 assign (( resid  63 and name HG1  )) (( resid  64 and name HN   ))  4.20  2.40  0.84
 assign (( resid  64 and name HA   )) (( resid  66 and name HN   ))  4.20  2.40  0.84
 assign (( resid  64 and name HA   )) (( resid  67 and name HN   ))  4.43  2.63  0.89
 assign (( resid  64 and name HA   )) (( resid  68 and name HN   ))  5.08  3.28  1.02
 assign (( resid  64 and name HN   )) (( resid  64 and name HB2  ))  3.51  1.71  0.70
 assign (( resid  64 and name HB2  )) (( resid  65 and name HN   ))  3.76  1.96  0.75
 assign (( resid  60 and name HB1  )) (( resid  66 and name HN   ))  5.88  4.08  1.18
 assign (( resid  64 and name HB1  )) (( resid  65 and name HN   ))  3.76  1.96  0.75
 assign (( resid  64 and name HN   )) (( resid  65 and name HN   ))  3.32  1.52  0.66
 assign (( resid  65 and name HN   )) (( resid  67 and name HN   ))  5.05  3.25  1.01
 assign (( resid  65 and name HN   )) (( resid  68 and name HN   ))  5.00  3.20  1.00
 assign (( resid  65 and name HA   )) (( resid  67 and name HN   ))  5.13  3.33  1.03
 assign (( resid  65 and name HA   )) (( resid  68 and name HN   ))  3.71  1.91  0.74
 assign (( resid  65 and name HA   )) (( resid  69 and name HN   ))  4.17  2.37  0.83
 assign (( resid  65 and name HN   )) (( resid  65 and name HB2  ))  3.65  1.85  0.73
 assign (( resid  65 and name HB2  )) (( resid  66 and name HN   ))  4.45  2.65  0.89
 assign (( resid  65 and name HN   )) (( resid  65 and name HB1  ))  3.65  1.85  0.73
 assign (( resid  65 and name HB1  )) (( resid  66 and name HN   ))  4.45  2.65  0.89
 assign (( resid  60 and name HD1  )) (( resid  62 and name HN   ))  4.57  2.77  0.91
 assign (( resid  64 and name HN   )) (( resid  66 and name HN   ))  4.19  2.39  0.84
 assign (( resid  65 and name HN   )) (( resid  66 and name HN   ))  3.41  1.61  0.68
 assign (( resid  66 and name HN   )) (( resid  67 and name HN   ))  3.54  1.74  0.71
 assign (( resid  66 and name HN   )) (( resid  68 and name HN   ))  4.10  2.30  0.82
 assign (( resid  65 and name HN   )) (( resid  66 and name HA   ))  5.01  3.21  1.00
 assign (( resid  66 and name HN   )) (( resid  66 and name HB   ))  3.37  1.57  0.67
 assign (( resid  65 and name HN   )) (( resid  66 and name HG11 ))  4.39  2.59  0.88
 assign (( resid  66 and name HN   )) (( resid  66 and name HG11 ))  3.51  1.71  0.70
 assign (( resid  64 and name HN   )) (( resid  66 and name HD1* ))  5.06  3.26  1.01
 assign (( resid  66 and name HN   )) (( resid  66 and name HG12 ))  4.01  2.21  0.80
 assign (( resid  66 and name HN   )) (( resid  66 and name HD1* ))  4.29  2.49  0.86
 assign (( resid  66 and name HN   )) (( resid  66 and name HG2* ))  3.86  2.06  0.77
 assign (( resid  66 and name HG2* )) (( resid  67 and name HN   ))  3.90  2.10  0.78
 assign (( resid  66 and name HG2* )) (( resid  68 and name HN   ))  4.74  2.94  0.95
 assign (( resid  66 and name HG2* )) (( resid  70 and name HN   ))  4.93  3.13  0.99
 assign (( resid  67 and name HN   )) (( resid  68 and name HN   ))  3.24  1.44  0.65
 assign (( resid  67 and name HN   )) (( resid  67 and name HG   ))  3.02  1.22  0.60
 assign (( resid  68 and name HN   )) (( resid  71 and name HN   ))  4.61  2.81  0.92
 assign (( resid  68 and name HA   )) (( resid  71 and name HN   ))  4.30  2.50  0.86
 assign (( resid  68 and name HD1* )) (( resid  69 and name HN   ))  4.47  2.67  0.89
 assign (( resid  68 and name HG   )) (( resid  69 and name HN   ))  3.36  1.56  0.67
 assign (( resid  65 and name HN   )) (( resid  66 and name HD1* ))  5.26  3.46  1.05
 assign (( resid  65 and name HN   )) (( resid  68 and name HD2* ))  5.64  3.84  1.13
 assign (( resid  68 and name HN   )) (( resid  69 and name HN   ))  3.35  1.55  0.67
 assign (( resid  69 and name HN   )) (( resid  71 and name HN   ))  4.35  2.55  0.87
 assign (( resid  69 and name HA   )) (( resid  72 and name HN   ))  3.87  2.07  0.77
 assign (( resid  69 and name HA   )) (( resid  73 and name HN   ))  4.30  2.50  0.86
 assign (( resid  68 and name HN   )) (( resid  69 and name HB2  ))  4.82  3.02  0.96
 assign (( resid  69 and name HN   )) (( resid  69 and name HB2  ))  3.26  1.46  0.65
 assign (( resid  69 and name HB2  )) (( resid  70 and name HN   ))  3.63  1.83  0.73
 assign (( resid  70 and name HD2  )) (( resid  71 and name HN   ))  5.11  3.31  1.02
 assign (( resid  69 and name HN   )) (( resid  69 and name HB1  ))  3.31  1.51  0.66
 assign (( resid  68 and name HN   )) (( resid  70 and name HN   ))  4.47  2.67  0.89
 assign (( resid  69 and name HN   )) (( resid  70 and name HN   ))  3.52  1.72  0.70
 assign (( resid  70 and name HN   )) (( resid  71 and name HN   ))  3.54  1.74  0.71
 assign (( resid  70 and name HA   )) (( resid  74 and name HN   ))  4.31  2.51  0.86
 assign (( resid  70 and name HN   )) (( resid  70 and name HB2  ))  3.55  1.75  0.71
 assign (( resid  70 and name HB2  )) (( resid  71 and name HN   ))  4.42  2.62  0.88
 assign (( resid  70 and name HN   )) (( resid  70 and name HB1  ))  3.55  1.75  0.71
 assign (( resid  71 and name HN   )) (( resid  72 and name HN   ))  3.40  1.60  0.68
 assign (( resid  71 and name HN   )) (( resid  73 and name HN   ))  4.43  2.63  0.89
 assign (( resid  71 and name HA   )) (( resid  74 and name HN   ))  4.43  2.63  0.89
 assign (( resid  70 and name HN   )) (( resid  71 and name HB2  ))  5.26  3.46  1.05
 assign (( resid  71 and name HN   )) (( resid  71 and name HB2  ))  3.15  1.35  0.63
 assign (( resid  71 and name HB2  )) (( resid  72 and name HN   ))  3.94  2.14  0.79
 assign (( resid  71 and name HN   )) (( resid  71 and name HB1  ))  3.30  1.50  0.66
 assign (( resid  71 and name HB1  )) (( resid  72 and name HN   ))  3.60  1.80  0.72
 assign (( resid  70 and name HN   )) (( resid  72 and name HN   ))  4.52  2.72  0.90
 assign (( resid  72 and name HN   )) (( resid  72 and name HB1  ))  3.19  1.39  0.64
 assign (( resid  72 and name HN   )) (( resid  72 and name HG2  ))  3.59  1.79  0.72
 assign (( resid  72 and name HG2  )) (( resid  73 and name HN   ))  4.16  2.36  0.83
 assign (( resid  72 and name HG1  )) (( resid  73 and name HN   ))  4.46  2.66  0.89
 assign (( resid  72 and name HN   )) (( resid  73 and name HN   ))  3.23  1.43  0.65
 assign (( resid  73 and name HN   )) (( resid  73 and name HB1  ))  3.56  1.76  0.71
 assign (( resid  73 and name HB1  )) (( resid  75 and name HN   ))  4.92  3.12  0.98
 assign (( resid  73 and name HB1  )) (( resid  76 and name HN   ))  4.57  2.77  0.91
 assign (( resid  72 and name HN   )) (( resid  73 and name HB2  ))  4.64  2.84  0.93
 assign (( resid  73 and name HN   )) (( resid  73 and name HB2  ))  3.33  1.53  0.67
 assign (( resid  73 and name HB2  )) (( resid  74 and name HN   ))  3.60  1.80  0.72
 assign (( resid  73 and name HD1  )) (( resid  76 and name HN   ))  4.23  2.43  0.85
 assign (( resid  72 and name HN   )) (( resid  73 and name HD2  ))  5.06  3.26  1.01
 assign (( resid  73 and name HN   )) (( resid  73 and name HD2  ))  3.68  1.88  0.74
 assign (( resid  72 and name HN   )) (( resid  74 and name HN   ))  4.99  3.19  1.00
 assign (( resid  73 and name HN   )) (( resid  74 and name HN   ))  3.29  1.49  0.66
 assign (( resid  74 and name HA   )) (( resid  75 and name HN   ))  3.28  1.48  0.66
 assign (( resid  74 and name HN   )) (( resid  75 and name HN   ))  4.45  2.65  0.89
 assign (( resid  75 and name HN   )) (( resid  76 and name HN   ))  3.49  1.69  0.70
 assign (( resid  75 and name HA1  )) (( resid  88 and name HN   ))  5.27  3.47  1.05
 assign (( resid  75 and name HA2  )) (( resid  88 and name HN   ))  4.34  2.54  0.87
 assign (( resid  76 and name HN   )) (( resid  77 and name HN   ))  4.72  2.92  0.94
 assign (( resid  76 and name HB2  )) (( resid  77 and name HN   ))  4.00  2.20  0.80
 assign (( resid  75 and name HN   )) (( resid  76 and name HB1  ))  4.97  3.17  0.99
 assign (( resid  76 and name HB1  )) (( resid  88 and name HN   ))  4.69  2.89  0.94
 assign (( resid  76 and name HN   )) (( resid  76 and name HD1  ))  3.58  1.78  0.72
 assign (( resid  78 and name HN   )) (( resid  78 and name HD1  ))  5.30  3.50  1.06
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 assign (( resid  77 and name HA   )) (( resid  88 and name HN   ))  3.88  2.08  0.78
 assign (( resid  76 and name HN   )) (( resid  77 and name HG12 ))  5.55  3.75  1.11
 assign (( resid  77 and name HG12 )) (( resid  88 and name HN   ))  4.92  3.12  0.98
 assign (( resid  77 and name HN   )) (( resid  77 and name HG11 ))  3.78  1.98  0.76
 assign (( resid  77 and name HG2* )) (( resid  78 and name HN   ))  3.30  1.50  0.66
 assign (( resid  77 and name HN   )) (( resid  78 and name HN   ))  4.80  3.00  0.96
 assign (( resid  78 and name HA   )) (( resid  79 and name HN   ))  2.79  0.99  0.56
 assign (( resid  78 and name HB1  )) (( resid  79 and name HN   ))  4.58  2.78  0.92
 assign (( resid  78 and name HD1  )) (( resid  79 and name HN   ))  3.79  1.99  0.76
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 assign (( resid  79 and name HA   )) (( resid  83 and name HN   ))  4.69  2.89  0.94
 assign (( resid  79 and name HA   )) (( resid  84 and name HN   ))  4.37  2.57  0.87
 assign (( resid  79 and name HA   )) (( resid  86 and name HN   ))  4.22  2.42  0.84
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 assign (( resid  79 and name HB2  )) (( resid  80 and name HN   ))  4.19  2.39  0.84
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 assign (( resid  79 and name HB1  )) (( resid  83 and name HN   ))  4.21  2.41  0.84
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 assign (( resid  79 and name HG   )) (( resid  86 and name HN   ))  4.04  2.24  0.81
 assign (( resid  79 and name HD2* )) (( resid  83 and name HN   ))  4.19  2.39  0.84
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 assign (( resid  80 and name HN   )) (( resid  82 and name HB2  ))  4.79  2.99  0.96
 assign (( resid  82 and name HB2  )) (( resid  83 and name HN   ))  3.30  1.50  0.66
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 assign (( resid  80 and name HN   )) (( resid  84 and name HN   ))  3.61  1.81  0.72
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 assign (( resid  79 and name HN   )) (( resid  86 and name HN   ))  4.71  2.91  0.94
 assign (( resid  85 and name HN   )) (( resid  86 and name HN   ))  4.57  2.77  0.91
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 assign (( resid  88 and name HN   )) (( resid  89 and name HN   ))  4.66  2.86  0.93
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 assign (( resid  88 and name HB*  )) (( resid  89 and name HN   ))  3.41  1.61  0.68
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 assign (( resid  89 and name HA   )) (( resid  90 and name HN   ))  3.00  1.20  0.60
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 assign (( resid  89 and name HN   )) (( resid  89 and name HB   ))  3.64  1.84  0.73
 assign (( resid  89 and name HN   )) (( resid  90 and name HN   ))  4.62  2.82  0.92
 assign (( resid  90 and name HN   )) (( resid  91 and name HN   ))  4.43  2.63  0.89
 assign (( resid  90 and name HA   )) (( resid  91 and name HN   ))  3.20  1.40  0.64
 assign (( resid  90 and name HN   )) (( resid  90 and name HB   ))  3.56  1.76  0.71
 assign (( resid  91 and name HN   )) (( resid  92 and name HN   ))  4.66  2.86  0.93
 assign (( resid  92 and name HB2  )) (( resid  93 and name HN   ))  4.43  2.63  0.89
 assign (( resid  92 and name HB1  )) (( resid  93 and name HN   ))  4.43  2.63  0.89
 assign (( resid  92 and name HD1  )) (( resid  93 and name HN   ))  4.63  2.83  0.93
 assign (( resid  92 and name HD2  )) (( resid  93 and name HN   ))  5.11  3.31  1.02
 assign (( resid  13 and name HN   )) (( resid  93 and name HN   ))  4.04  2.24  0.81
 assign (( resid  92 and name HN   )) (( resid  93 and name HN   ))  4.66  2.86  0.93
 assign (( resid  13 and name HN   )) (( resid  93 and name HB*  ))  4.36  2.56  0.87
 assign (( resid  93 and name HN   )) (( resid  93 and name HB*  ))  3.64  1.84  0.73
 assign (( resid  95 and name HN   )) (( resid  96 and name HN   ))  4.91  3.11  0.98
 assign (( resid  96 and name HN   )) (( resid  97 and name HN   ))  4.65  2.85  0.93
 assign (( resid  96 and name HB2  )) (( resid  97 and name HN   ))  4.34  2.54  0.87
 assign (( resid  97 and name HN   )) (( resid  97 and name HB1  ))  3.62  1.82  0.72
 assign (( resid  23 and name HN   )) (( resid  23 and name HB1  ))  4.05  2.25  0.81
 assign (( resid  25 and name HE22 )) (( resid  26 and name HN   ))  5.94  4.14  1.19
 assign (( resid  42 and name HB2  )) (( resid  43 and name HN   ))  4.86  3.06  0.97
 assign (( resid  12 and name HB   )) (( resid  60 and name HN   ))  5.01  3.21  1.00
 assign (( resid  59 and name HB1  )) (( resid  60 and name HN   ))  5.21  3.41  1.04
 assign (( resid  55 and name HD2  )) (( resid  56 and name HN   ))  5.37  3.57  1.07
 assign (( resid  55 and name HD1  )) (( resid  56 and name HN   ))  5.37  3.57  1.07
 assign (( resid  41 and name HD1  )) (( resid  56 and name HN   ))  5.53  3.73  1.11
 assign (( resid  55 and name HN   )) (( resid  55 and name HD2  ))  6.50  4.70  1.30
 assign (( resid  55 and name HN   )) (( resid  55 and name HD1  ))  6.50  4.70  1.30
 assign (( resid  30 and name HD1* )) (( resid  42 and name HN   ))  4.80  3.00  0.96
 assign (( resid  92 and name HN   )) (( resid  92 and name HD1  ))  5.35  3.55  1.07
 assign (( resid  92 and name HN   )) (( resid  92 and name HD2  ))  5.58  3.78  1.12
 assign (( resid  21 and name HG   )) (( resid  25 and name HE22 ))  5.59  3.79  1.12
 assign (( resid  21 and name HD1* )) (( resid  25 and name HE22 ))  4.99  3.19  1.00
 assign (( resid  62 and name HD22 )) (( resid  65 and name HN   ))  4.22  2.42  0.84
 assign (( resid  13 and name HA   )) (( resid  58 and name HG11 ))  4.28  2.48  0.86
 assign (( resid  14 and name HA   )) (( resid  91 and name HN   ))  6.50  4.70  1.30
 assign (( resid  14 and name HB   )) (( resid  14 and name HD1* ))  3.11  1.31  0.62
 assign (( resid  14 and name HD1* )) (( resid  17 and name HD2* ))  3.66  1.86  0.73
 assign (( resid  14 and name HD1* )) (( resid  88 and name HB*  ))  3.20  1.40  0.64
 assign (( resid  14 and name HG11 )) (( resid  17 and name HD2* ))  4.34  2.54  0.87
 assign (( resid  23 and name HA   )) (( resid  26 and name HD2* ))  4.56  2.76  0.91
 assign (( resid  23 and name HG2  )) (( resid  41 and name HB2  ))  4.90  3.10  0.98
 assign (( resid  23 and name HG2  )) (( resid  24 and name HG1  ))  5.37  3.57  1.07
 assign (( resid  23 and name HG1  )) (( resid  24 and name HG1  ))  5.37  3.57  1.07
 assign (( resid  23 and name HB2  )) (( resid  27 and name HB1  ))  5.51  3.71  1.10
 assign (( resid  25 and name HA   )) (( resid  27 and name HG2  ))  4.45  2.65  0.89
 assign (( resid  21 and name HB1  )) (( resid  25 and name HG1  ))  6.50  4.70  1.30
 assign (( resid  26 and name HG   )) (( resid  27 and name HB1  ))  4.44  2.64  0.89
 assign (( resid  26 and name HB2  )) (( resid  26 and name HD1* ))  3.68  1.88  0.74
 assign (( resid  26 and name HB2  )) (( resid  26 and name HD2* ))  4.20  2.40  0.84
 assign (( resid  26 and name HB1  )) (( resid  26 and name HD2* ))  3.42  1.62  0.68
 assign (( resid  29 and name HB2  )) (( resid  30 and name HG   ))  5.66  3.86  1.13
 assign (( resid  29 and name HB1  )) (( resid  30 and name HG   ))  6.50  4.70  1.30
 assign (( resid  31 and name HG2  )) (( resid  32 and name HD1  ))  5.97  4.17  1.19
 assign (( resid  32 and name HD1  )) (( resid  33 and name HG   ))  6.50  4.70  1.30
 assign (( resid  33 and name HB2  )) (( resid  60 and name HE1  ))  6.45  4.65  1.29
 assign (( resid  33 and name HB2  )) (( resid  69 and name HE1  ))  6.50  4.70  1.30
 assign (( resid  33 and name HB1  )) (( resid  60 and name HE1  ))  6.01  4.21  1.20
 assign (( resid  33 and name HB1  )) (( resid  69 and name HE1  ))  6.40  4.60  1.28
 assign (( resid  34 and name HG1  )) (( resid  68 and name HD1* ))  6.46  4.66  1.29
 assign (( resid  39 and name HB2  )) (( resid  58 and name HA   ))  5.05  3.25  1.01
 assign (( resid  42 and name HB2  )) (( resid  54 and name HA   ))  5.75  3.95  1.15
 assign (( resid  42 and name HB1  )) (( resid  54 and name HA   ))  6.08  4.28  1.22
 assign (( resid  19 and name HB2  )) (( resid  46 and name HA   ))  4.71  2.91  0.94
 assign (( resid  37 and name HN   )) (( resid  60 and name HA   ))  4.59  2.79  0.92
 assign (( resid  66 and name HB   )) (( resid  66 and name HD1* ))  3.29  1.49  0.66
 assign (( resid  60 and name HD1  )) (( resid  66 and name HG12 ))  5.19  3.39  1.04
 assign (( resid  60 and name HD2  )) (( resid  66 and name HG12 ))  5.82  4.02  1.16
 assign (( resid  21 and name HB1  )) (( resid  21 and name HD1* ))  2.85  1.05  0.57
 assign (( resid  70 and name HN   )) (( resid  70 and name HG2  ))  6.50  4.70  1.30
 assign (( resid  70 and name HN   )) (( resid  70 and name HG1  ))  6.50  4.70  1.30
 assign (( resid  78 and name HN   )) (( resid  86 and name HB2  ))  5.04  3.24  1.01
 assign (( resid  93 and name HA   )) (( resid  94 and name HD2  ))  3.80  2.00  0.76
 assign (( resid  21 and name HD1* )) (( resid  25 and name HG1  ))  4.20  2.40  0.84
 assign (( resid  14 and name HN   )) (( resid  14 and name HG12 ))  4.88  3.08  0.98
 assign (( resid  17 and name HA   )) (( resid  17 and name HD1* ))  3.45  1.65  0.69
 assign (( resid  17 and name HA   )) (( resid  17 and name HD2* ))  3.98  2.18  0.80
 assign (( resid  14 and name HG12 )) (( resid  17 and name HD2* ))  3.97  2.17  0.79
 assign (( resid  14 and name HG2* )) (( resid  17 and name HD2* ))  3.16  1.36  0.63
 assign (( resid  17 and name HD1* )) (( resid  56 and name HB*  ))  4.00  2.20  0.80
 assign (( resid  17 and name HD2* )) (( resid  56 and name HB*  ))  4.19  2.39  0.84
 assign (( resid  17 and name HD1* )) (( resid  26 and name HD1* ))  3.11  1.31  0.62
 assign (( resid  17 and name HD1* )) (( resid  29 and name HG1  ))  5.32  3.52  1.06
 assign (( resid  17 and name HD2* )) (( resid  29 and name HG1  ))  5.83  4.03  1.17
 assign (( resid  26 and name HA   )) (( resid  26 and name HG   ))  3.63  1.83  0.73
 assign (( resid  22 and name HA   )) (( resid  26 and name HD2* ))  4.32  2.52  0.86
 assign (( resid  26 and name HN   )) (( resid  26 and name HD2* ))  3.80  2.00  0.76
 assign (( resid  17 and name HD1* )) (( resid  29 and name HG2  ))  5.62  3.82  1.12
 assign (( resid  17 and name HD2* )) (( resid  29 and name HG2  ))  6.22  4.42  1.24
 assign (( resid  29 and name HG2  )) (( resid  32 and name HB1  ))  6.50  4.70  1.30
 assign (( resid  38 and name HA   )) (( resid  38 and name HD2  ))  4.08  2.28  0.82
 assign (( resid  33 and name HN   )) (( resid  38 and name HB1  ))  6.50  4.70  1.30
 assign (( resid  40 and name HA   )) (( resid  56 and name HB*  ))  5.51  3.71  1.10
 assign (( resid  39 and name HE1  )) (( resid  40 and name HB1  ))  5.41  3.61  1.08
 assign (( resid  40 and name HB2  )) (( resid  41 and name HD2  ))  5.61  3.81  1.12
 assign (( resid  40 and name HG1  )) (( resid  41 and name HB2  ))  6.37  4.57  1.27
 assign (( resid  40 and name HG1  )) (( resid  41 and name HB1  ))  6.50  4.70  1.30
 assign (( resid  40 and name HA   )) (( resid  56 and name HA   ))  6.50  4.70  1.30
 assign (( resid  41 and name HN   )) (( resid  56 and name HA   ))  6.07  4.27  1.21
 assign (( resid  38 and name HA   )) (( resid  58 and name HG11 ))  6.50  4.70  1.30
 assign (( resid  38 and name HA   )) (( resid  58 and name HG12 ))  5.94  4.14  1.19
 assign (( resid  41 and name HE1  )) (( resid  58 and name HG12 ))  4.94  3.14  0.99
 assign (( resid  59 and name HA   )) (( resid  59 and name HD22 ))  5.28  3.48  1.06
 assign (( resid  60 and name HE1  )) (( resid  62 and name HB1  ))  5.70  3.90  1.14
 assign (( resid  60 and name HE1  )) (( resid  62 and name HB2  ))  6.50  4.70  1.30
 assign (( resid  63 and name HA   )) (( resid  66 and name HB   ))  4.59  2.79  0.92
 assign (( resid  25 and name HB2  )) (( resid  26 and name HA   ))  4.41  2.61  0.88
 assign (( resid  67 and name HA   )) (( resid  70 and name HB2  ))  4.69  2.89  0.94
 assign (( resid  67 and name HA   )) (( resid  70 and name HB1  ))  4.69  2.89  0.94
 assign (( resid  64 and name HA   )) (( resid  67 and name HB1  ))  6.14  4.34  1.23
 assign (( resid  70 and name HD2  )) (( resid  71 and name HA   ))  4.91  3.11  0.98
 assign (( resid  70 and name HD1  )) (( resid  71 and name HA   ))  4.91  3.11  0.98
 assign (( resid  72 and name HD1  )) (( resid  73 and name HE2  ))  4.65  2.85  0.93
 assign (( resid  72 and name HG2  )) (( resid  73 and name HD2  ))  4.77  2.97  0.95
 assign (( resid  72 and name HG1  )) (( resid  73 and name HD2  ))  4.68  2.88  0.94
 assign (( resid  72 and name HG1  )) (( resid  73 and name HE2  ))  4.48  2.68  0.90
 assign (( resid  84 and name HN   )) (( resid  84 and name HG   ))  3.43  1.63  0.69
 assign (( resid  85 and name HB2  )) (( resid  87 and name HD2  ))  6.07  4.27  1.21
 assign (( resid  85 and name HB2  )) (( resid  87 and name HD1  ))  6.07  4.27  1.21
 assign (( resid  91 and name HA   )) (( resid  91 and name HG2  ))  3.94  2.14  0.79
 assign (( resid  91 and name HA   )) (( resid  91 and name HG1  ))  3.94  2.14  0.79
 assign (( resid  79 and name HD2* )) (( resid  84 and name HA   ))  3.64  1.84  0.73
 assign (( resid  22 and name HA   )) (( resid  43 and name HB*  ))  4.25  2.45  0.85
 assign (( resid  21 and name HD2* )) (( resid  22 and name HA   ))  4.32  2.52  0.86
 assign (( resid  23 and name HB2  )) (( resid  24 and name HA   ))  4.36  2.56  0.87
 assign (( resid  25 and name HA   )) (( resid  27 and name HN   ))  4.60  2.80  0.92
 assign (( resid  26 and name HA   )) (( resid  29 and name HE22 ))  3.48  1.68  0.70
 assign (( resid  25 and name HA   )) (( resid  28 and name HB1  ))  3.34  1.54  0.67
 assign (( resid  27 and name HA   )) (( resid  27 and name HB2  ))  3.00  1.20  0.60
 assign (( resid  26 and name HD1* )) (( resid  27 and name HA   ))  4.31  2.51  0.86
 assign (( resid  27 and name HG1  )) (( resid  28 and name HA   ))  3.74  1.94  0.75
 assign (( resid  17 and name HG   )) (( resid  55 and name HA   ))  3.88  2.08  0.78
 assign (( resid  64 and name HA   )) (( resid  67 and name HG   ))  3.77  1.97  0.75
 assign (( resid  66 and name HA   )) (( resid  66 and name HG12 ))  3.98  2.18  0.80
 assign (( resid  67 and name HA   )) (( resid  67 and name HB2  ))  2.96  1.16  0.59
 assign (( resid  97 and name HA   )) (( resid  97 and name HG2  ))  3.84  2.04  0.77
 assign (( resid  97 and name HA   )) (( resid  97 and name HG1  ))  3.84  2.04  0.77
 assign (( resid  70 and name HA   )) (( resid  70 and name HD2  ))  5.10  3.30  1.02
 assign (( resid  70 and name HA   )) (( resid  70 and name HD1  ))  5.10  3.30  1.02
 assign (( resid  69 and name HA   )) (( resid  72 and name HA   ))  5.41  3.61  1.08
 assign (( resid  76 and name HA   )) (( resid  77 and name HG12 ))  4.05  2.25  0.81
 assign (( resid  77 and name HA   )) (( resid  86 and name HN   ))  4.28  2.48  0.86
 assign (( resid  75 and name HA1  )) (( resid  89 and name HG1* ))  5.74  3.94  1.15
 assign (( resid  79 and name HD1* )) (( resid  83 and name HA2  ))  4.12  2.32  0.82
 assign (( resid  12 and name HB   )) (( resid  60 and name HE2  ))  4.41  2.61  0.88
 assign (( resid  12 and name HB   )) (( resid  13 and name HA   ))  5.43  3.63  1.09
 assign (( resid  12 and name HB   )) (( resid  92 and name HA   ))  5.60  3.80  1.12
 assign (( resid  13 and name HB   )) (( resid  14 and name HN   ))  3.97  2.17  0.79
 assign (( resid  13 and name HB   )) (( resid  93 and name HB*  ))  5.31  3.51  1.06
 assign (( resid  34 and name HA   )) (( resid  35 and name HB*  ))  4.49  2.69  0.90
 assign (( resid  41 and name HD1  )) (( resid  56 and name HB*  ))  3.07  1.27  0.61
 assign (( resid  17 and name HG   )) (( resid  56 and name HB*  ))  3.50  1.70  0.70
 assign (( resid  91 and name HB2  )) (( resid  92 and name HN   ))  4.47  2.67  0.89
 assign (( resid  21 and name HD1* )) (( resid  25 and name HB1  ))  3.76  1.96  0.75
 assign (( resid  21 and name HB1  )) (( resid  25 and name HB2  ))  4.49  2.69  0.90
 assign (( resid  21 and name HG   )) (( resid  26 and name HB2  ))  4.64  2.84  0.93
 assign (( resid  27 and name HB2  )) (( resid  41 and name HD2  ))  4.28  2.48  0.86
 assign (( resid  27 and name HB1  )) (( resid  41 and name HD2  ))  4.53  2.73  0.91
 assign (( resid  27 and name HN   )) (( resid  28 and name HB1  ))  4.57  2.77  0.91
 assign (( resid  26 and name HD1* )) (( resid  30 and name HB2  ))  4.49  2.69  0.90
 assign (( resid  77 and name HA   )) (( resid  87 and name HB1  ))  3.92  2.12  0.78
 assign (( resid  33 and name HB2  )) (( resid  34 and name HG2  ))  5.32  3.52  1.06
 assign (( resid  23 and name HB2  )) (( resid  41 and name HB2  ))  4.44  2.64  0.89
 assign (( resid  23 and name HB1  )) (( resid  41 and name HB2  ))  4.66  2.86  0.93
 assign (( resid  67 and name HB2  )) (( resid  71 and name HB1  ))  6.17  4.37  1.23
 assign (( resid  67 and name HD1* )) (( resid  71 and name HB1  ))  5.29  3.49  1.06
 assign (( resid  68 and name HD1* )) (( resid  71 and name HB1  ))  5.56  3.76  1.11
 assign (( resid  61 and name HB1  )) (( resid  62 and name HB1  ))  6.01  4.21  1.20
 assign (( resid  62 and name HB1  )) (( resid  63 and name HG2  ))  6.50  4.70  1.30
 assign (( resid  67 and name HB2  )) (( resid  71 and name HB2  ))  4.17  2.37  0.83
 assign (( resid  68 and name HB1  )) (( resid  69 and name HB2  ))  4.85  3.05  0.97
 assign (( resid  68 and name HG   )) (( resid  72 and name HB1  ))  5.24  3.44  1.05
 assign (( resid  82 and name HB1  )) (( resid  82 and name HE2  ))  5.49  3.69  1.10
 assign (( resid  82 and name HB1  )) (( resid  82 and name HE1  ))  5.49  3.69  1.10
 assign (( resid  46 and name HB2  )) (( resid  82 and name HB2  ))  4.81  3.01  0.96
 assign (( resid  80 and name HN   )) (( resid  84 and name HB2  ))  4.35  2.55  0.87
 assign (( resid  68 and name HB2  )) (( resid  69 and name HN   ))  4.34  2.54  0.87
 assign (( resid  65 and name HA   )) (( resid  68 and name HB2  ))  3.70  1.90  0.74
 assign (( resid  67 and name HD1* )) (( resid  68 and name HB2  ))  2.94  1.14  0.59
 assign (( resid  77 and name HD1* )) (( resid  85 and name HB2  ))  4.34  2.54  0.87
 assign (( resid  77 and name HD1* )) (( resid  87 and name HB2  ))  3.92  2.12  0.78
 assign (( resid  97 and name HB2  )) (( resid  97 and name HE2  ))  5.74  3.94  1.15
 assign (( resid  97 and name HB2  )) (( resid  97 and name HE1  ))  5.74  3.94  1.15
 assign (( resid  27 and name HB1  )) (( resid  27 and name HG2  ))  3.00  1.20  0.60
 assign (( resid  26 and name HD1* )) (( resid  30 and name HB1  ))  4.86  3.06  0.97
 assign (( resid  29 and name HA   )) (( resid  32 and name HB2  ))  4.68  2.88  0.94
 assign (( resid  36 and name HB1  )) (( resid  60 and name HA   ))  4.88  3.08  0.98
 assign (( resid  23 and name HB2  )) (( resid  41 and name HB1  ))  4.78  2.98  0.96
 assign (( resid  23 and name HB1  )) (( resid  41 and name HB1  ))  4.93  3.13  0.99
 assign (( resid  60 and name HA   )) (( resid  61 and name HB2  ))  4.88  3.08  0.98
 assign (( resid  24 and name HB2  )) (( resid  24 and name HG1  ))  2.87  1.07  0.57
 assign (( resid  25 and name HA   )) (( resid  25 and name HG1  ))  3.94  2.14  0.79
 assign (( resid  24 and name HB2  )) (( resid  25 and name HG1  ))  3.78  1.98  0.76
 assign (( resid  25 and name HG1  )) (( resid  26 and name HB1  ))  5.28  3.48  1.06
 assign (( resid  26 and name HN   )) (( resid  27 and name HG2  ))  5.03  3.23  1.01
 assign (( resid  24 and name HA   )) (( resid  27 and name HG2  ))  3.98  2.18  0.80
 assign (( resid  26 and name HD1* )) (( resid  29 and name HG1  ))  4.55  2.75  0.91
 assign (( resid  30 and name HN   )) (( resid  31 and name HG1  ))  4.43  2.63  0.89
 assign (( resid  27 and name HG2  )) (( resid  31 and name HG1  ))  4.70  2.90  0.94
 assign (( resid  34 and name HG1  )) (( resid  69 and name HD1  ))  4.89  3.09  0.98
 assign (( resid  33 and name HA   )) (( resid  34 and name HG2  ))  5.02  3.22  1.00
 assign (( resid  33 and name HA   )) (( resid  34 and name HG1  ))  5.38  3.58  1.08
 assign (( resid  85 and name HB1  )) (( resid  87 and name HG1  ))  4.95  3.15  0.99
 assign (( resid  13 and name HN   )) (( resid  13 and name HG2* ))  3.54  1.74  0.71
 assign (( resid  90 and name HA   )) (( resid  90 and name HG1* ))  3.83  2.03  0.77
 assign (( resid  90 and name HA   )) (( resid  90 and name HG2* ))  3.83  2.03  0.77
 assign (( resid  12 and name HG2* )) (( resid  60 and name HE2  ))  4.46  2.66  0.89
 assign (( resid  12 and name HG2* )) (( resid  92 and name HA   ))  4.65  2.85  0.93
 assign (( resid  58 and name HG2* )) (( resid  60 and name HD2  ))  3.86  2.06  0.77
 assign (( resid  41 and name HE1  )) (( resid  58 and name HG2* ))  4.57  2.77  0.91
 assign (( resid  58 and name HG2* )) (( resid  60 and name HE2  ))  4.05  2.25  0.81
 assign (( resid  33 and name HD2* )) (( resid  58 and name HG2* ))  4.25  2.45  0.85
 assign (( resid  33 and name HD1* )) (( resid  58 and name HG2* ))  4.42  2.62  0.88
 assign (( resid  60 and name HD2  )) (( resid  66 and name HG2* ))  4.44  2.64  0.89
 assign (( resid  66 and name HA   )) (( resid  66 and name HG2* ))  3.78  1.98  0.76
 assign (( resid  66 and name HG2* )) (( resid  66 and name HG12 ))  3.51  1.71  0.70
 assign (( resid  66 and name HG2* )) (( resid  66 and name HD1* ))  3.67  1.87  0.73
 assign (( resid  77 and name HG11 )) (( resid  87 and name HB1  ))  4.25  2.45  0.85
 assign (( resid  21 and name HG   )) (( resid  29 and name HE22 ))  4.28  2.48  0.86
 assign (( resid  21 and name HN   )) (( resid  21 and name HG   ))  3.87  2.07  0.77
 assign (( resid  21 and name HG   )) (( resid  22 and name HA   ))  4.41  2.61  0.88
 assign (( resid  21 and name HG   )) (( resid  26 and name HB1  ))  3.59  1.79  0.72
 assign (( resid  23 and name HB2  )) (( resid  26 and name HG   ))  4.57  2.77  0.91
 assign (( resid  23 and name HB1  )) (( resid  26 and name HG   ))  4.83  3.03  0.97
 assign (( resid  26 and name HG   )) (( resid  30 and name HG   ))  3.82  2.02  0.76
 assign (( resid  33 and name HD1* )) (( resid  60 and name HE2  ))  4.30  2.50  0.86
 assign (( resid  78 and name HN   )) (( resid  79 and name HG   ))  4.93  3.13  0.99
 assign (( resid  79 and name HG   )) (( resid  80 and name HN   ))  5.59  3.79  1.12
 assign (( resid  80 and name HN   )) (( resid  84 and name HG   ))  5.64  3.84  1.13
 assign (( resid  31 and name HA   )) (( resid  33 and name HG   ))  4.38  2.58  0.88
 assign (( resid  68 and name HG   )) (( resid  69 and name HB2  ))  3.51  1.71  0.70
 assign (( resid  32 and name HG2  )) (( resid  33 and name HG   ))  4.00  2.20  0.80
 assign (( resid  82 and name HB2  )) (( resid  84 and name HG   ))  3.04  1.24  0.61
 assign (( resid  68 and name HA   )) (( resid  68 and name HG   ))  3.74  1.94  0.75
 assign (( resid  68 and name HG   )) (( resid  72 and name HD2  ))  5.10  3.30  1.02
 assign (( resid  14 and name HD1* )) (( resid  73 and name HD1  ))  4.43  2.63  0.89
 assign (( resid  26 and name HD1* )) (( resid  29 and name HE21 ))  3.45  1.65  0.69
 assign (( resid  26 and name HD2* )) (( resid  43 and name HA   ))  3.73  1.93  0.75
 assign (( resid  30 and name HN   )) (( resid  30 and name HD2* ))  3.46  1.66  0.69
 assign (( resid  27 and name HA   )) (( resid  30 and name HD1* ))  4.57  2.77  0.91
 assign (( resid  27 and name HA   )) (( resid  30 and name HD2* ))  5.26  3.46  1.05
 assign (( resid  30 and name HB2  )) (( resid  30 and name HD1* ))  3.61  1.81  0.72
 assign (( resid  30 and name HB2  )) (( resid  30 and name HD2* ))  4.05  2.25  0.81
 assign (( resid  30 and name HB1  )) (( resid  30 and name HD1* ))  3.51  1.71  0.70
 assign (( resid  14 and name HG2* )) (( resid  30 and name HD1* ))  3.84  2.04  0.77
 assign (( resid  14 and name HD1* )) (( resid  30 and name HD2* ))  3.15  1.35  0.63
 assign (( resid  26 and name HD1* )) (( resid  30 and name HD1* ))  3.40  1.60  0.68
 assign (( resid  33 and name HD2* )) (( resid  60 and name HE1  ))  3.84  2.04  0.77
 assign (( resid  33 and name HD2* )) (( resid  60 and name HA   ))  3.68  1.88  0.74
 assign (( resid  31 and name HA   )) (( resid  33 and name HD1* ))  3.61  1.81  0.72
 assign (( resid  33 and name HB1  )) (( resid  33 and name HD2* ))  3.44  1.64  0.69
 assign (( resid  58 and name HD1* )) (( resid  60 and name HE2  ))  4.30  2.50  0.86
 assign (( resid  10 and name HB2  )) (( resid  66 and name HD1* ))  4.77  2.97  0.95
 assign (( resid  10 and name HB1  )) (( resid  66 and name HD1* ))  4.77  2.97  0.95
 assign (( resid  21 and name HB2  )) (( resid  21 and name HD1* ))  3.54  1.74  0.71
 assign (( resid  79 and name HD2* )) (( resid  80 and name HN   ))  3.78  1.98  0.76
 assign (( resid  79 and name HD2* )) (( resid  83 and name HA1  ))  3.77  1.97  0.75
 assign (( resid  68 and name HB1  )) (( resid  68 and name HD2* ))  2.99  1.19  0.60
 assign (( resid  68 and name HB2  )) (( resid  68 and name HD2* ))  2.97  1.17  0.59
 assign (( resid  77 and name HN   )) (( resid  77 and name HD1* ))  4.06  2.26  0.81
 assign (( resid  77 and name HD1* )) (( resid  87 and name HB1  ))  3.17  1.37  0.63
 assign (( resid  21 and name HD1* )) (( resid  25 and name HB2  ))  3.60  1.80  0.72
 assign (( resid  82 and name HG1  )) (( resid  82 and name HE2  ))  3.52  1.72  0.70
 assign (( resid  82 and name HG1  )) (( resid  82 and name HE1  ))  3.52  1.72  0.70
 assign (( resid  33 and name HB1  )) (( resid  34 and name HD2  ))  3.82  2.02  0.76
 assign (( resid  69 and name HE1  )) (( resid  72 and name HD1  ))  4.62  2.82  0.92
 assign (( resid  69 and name HE2  )) (( resid  72 and name HD1  ))  4.81  3.01  0.96
 assign (( resid  31 and name HN   )) (( resid  31 and name HD2  ))  5.64  3.84  1.13
 assign (( resid  31 and name HN   )) (( resid  31 and name HD1  ))  5.64  3.84  1.13
 assign (( resid  93 and name HA   )) (( resid  94 and name HD1  ))  3.80  2.00  0.76
 assign (( resid  16 and name HA   )) (( resid  16 and name HD2  ))  5.48  3.68  1.10
 assign (( resid  16 and name HA   )) (( resid  16 and name HD1  ))  5.48  3.68  1.10
 assign (( resid  16 and name HA   )) (( resid  17 and name HB2  ))  4.80  3.00  0.96
 assign (( resid  13 and name HN   )) (( resid  91 and name HG1  ))  4.85  3.05  0.97
 assign (( resid  72 and name HB2  )) (( resid  72 and name HD2  ))  3.64  1.84  0.73
 assign (( resid  69 and name HB2  )) (( resid  72 and name HD1  ))  4.45  2.65  0.89
 assign (( resid  69 and name HA   )) (( resid  69 and name HE1  ))  5.42  3.62  1.08
 assign (( resid  69 and name HA   )) (( resid  69 and name HE2  ))  5.77  3.97  1.15
 assign (( resid  23 and name HB2  )) (( resid  24 and name HG2  ))  5.06  3.26  1.01
 assign (( resid  28 and name HN   )) (( resid  28 and name HB2  ))  3.52  1.72  0.70
 assign (( resid  26 and name HD1* )) (( resid  29 and name HG2  ))  4.50  2.70  0.90
 assign (( resid  29 and name HG1  )) (( resid  29 and name HE22 ))  3.70  1.90  0.74
 assign (( resid  26 and name HD1* )) (( resid  30 and name HG   ))  2.85  1.05  0.57
 assign (( resid  14 and name HG2* )) (( resid  17 and name HG   ))  3.63  1.83  0.73
 assign (( resid  28 and name HA   )) (( resid  31 and name HG1  ))  3.77  1.97  0.75
 assign (( resid  30 and name HN   )) (( resid  31 and name HG2  ))  4.84  3.04  0.97
 assign (( resid  37 and name HB2  )) (( resid  61 and name HG2  ))  5.27  3.47  1.05
 assign (( resid  37 and name HB2  )) (( resid  61 and name HG1  ))  5.27  3.47  1.05
 assign (( resid  40 and name HG2  )) (( resid  41 and name HN   ))  5.13  3.33  1.03
 assign (( resid  39 and name HD1  )) (( resid  40 and name HG2  ))  3.85  2.05  0.77
 assign (( resid  40 and name HG2  )) (( resid  41 and name HA   ))  5.34  3.54  1.07
 assign (( resid  40 and name HA   )) (( resid  40 and name HG2  ))  3.95  2.15  0.79
 assign (( resid  26 and name HD2* )) (( resid  41 and name HB1  ))  4.94  3.14  0.99
 assign (( resid  26 and name HG   )) (( resid  41 and name HB1  ))  4.88  3.08  0.98
 assign (( resid  23 and name HG1  )) (( resid  41 and name HB2  ))  4.90  3.10  0.98
 assign (( resid  65 and name HA   )) (( resid  67 and name HD1* ))  4.37  2.57  0.87
 assign (( resid  69 and name HN   )) (( resid  71 and name HB2  ))  6.50  4.70  1.30
 assign (( resid  10 and name HN   )) (( resid  66 and name HD1* ))  4.32  2.52  0.86
 assign (( resid  10 and name HA   )) (( resid  66 and name HD1* ))  4.80  3.00  0.96
 assign (( resid  12 and name HA   )) (( resid  12 and name HG2* ))  3.47  1.67  0.69
 assign (( resid  12 and name HA   )) (( resid  13 and name HG2* ))  4.57  2.77  0.91
 assign (( resid  12 and name HA   )) (( resid  13 and name HG1* ))  4.05  2.25  0.81
 assign (( resid  12 and name HA   )) (( resid  92 and name HA   ))  4.13  2.33  0.83
 assign (( resid  12 and name HB   )) (( resid  58 and name HB   ))  5.54  3.74  1.11
 assign (( resid  12 and name HA   )) (( resid  12 and name HG1* ))  3.47  1.67  0.69
 assign (( resid  12 and name HG2* )) (( resid  66 and name HG2* ))  3.54  1.74  0.71
 assign (( resid  12 and name HG1* )) (( resid  66 and name HG2* ))  3.54  1.74  0.71
 assign (( resid  14 and name HG11 )) (( resid  90 and name HA   ))  4.45  2.65  0.89
 assign (( resid  12 and name HB   )) (( resid  13 and name HN   ))  4.33  2.53  0.87
 assign (( resid  13 and name HN   )) (( resid  13 and name HG1* ))  3.03  1.23  0.61
 assign (( resid  13 and name HA   )) (( resid  13 and name HG2* ))  3.58  1.78  0.72
 assign (( resid  13 and name HA   )) (( resid  13 and name HG1* ))  3.54  1.74  0.71
 assign (( resid  13 and name HA   )) (( resid  14 and name HG2* ))  4.14  2.34  0.83
 assign (( resid  13 and name HA   )) (( resid  57 and name HA   ))  4.27  2.47  0.85
 assign (( resid  13 and name HA   )) (( resid  58 and name HG12 ))  6.50  4.70  1.30
 assign (( resid  13 and name HB   )) (( resid  14 and name HG2* ))  4.04  2.24  0.81
 assign (( resid  13 and name HG1* )) (( resid  57 and name HA   ))  4.80  3.00  0.96
 assign (( resid  13 and name HG1* )) (( resid  93 and name HB*  ))  4.03  2.23  0.81
 assign (( resid  12 and name HB   )) (( resid  66 and name HG12 ))  5.71  3.91  1.14
 assign (( resid  12 and name HB   )) (( resid  66 and name HD1* ))  5.97  4.17  1.19
 assign (( resid  14 and name HN   )) (( resid  14 and name HD1* ))  4.72  2.92  0.94
 assign (( resid  14 and name HD1* )) (( resid  90 and name HA   ))  4.54  2.74  0.91
 assign (( resid  14 and name HA   )) (( resid  14 and name HG2* ))  3.50  1.70  0.70
 assign (( resid  14 and name HA   )) (( resid  88 and name HB*  ))  5.87  4.07  1.17
 assign (( resid  88 and name HB*  )) (( resid  90 and name HA   ))  6.36  4.56  1.27
 assign (( resid  14 and name HG2* )) (( resid  14 and name HG12 ))  3.54  1.74  0.71
 assign (( resid  14 and name HB   )) (( resid  30 and name HA   ))  4.72  2.92  0.94
 assign (( resid  14 and name HB   )) (( resid  30 and name HB1  ))  5.15  3.35  1.03
 assign (( resid  30 and name HB1  )) (( resid  31 and name HG2  ))  5.57  3.77  1.11
 assign (( resid  14 and name HB   )) (( resid  58 and name HD1* ))  4.20  2.40  0.84
 assign (( resid  14 and name HB   )) (( resid  58 and name HG12 ))  5.25  3.45  1.05
 assign (( resid  14 and name HB   )) (( resid  58 and name HG11 ))  5.64  3.84  1.13
 assign (( resid  14 and name HG12 )) (( resid  88 and name HB*  ))  3.64  1.84  0.73
 assign (( resid  14 and name HG11 )) (( resid  88 and name HB*  ))  4.03  2.23  0.81
 assign (( resid  14 and name HA   )) (( resid  14 and name HD1* ))  3.92  2.12  0.78
 assign (( resid  14 and name HG2* )) (( resid  14 and name HD1* ))  3.06  1.26  0.61
 assign (( resid  14 and name HD1* )) (( resid  30 and name HA   ))  3.68  1.88  0.74
 assign (( resid  14 and name HD1* )) (( resid  88 and name HA   ))  3.86  2.06  0.77
 assign (( resid  13 and name HG2* )) (( resid  14 and name HG2* ))  5.19  3.39  1.04
 assign (( resid  26 and name HG   )) (( resid  30 and name HB2  ))  5.76  3.96  1.15
 assign (( resid  14 and name HG2* )) (( resid  57 and name HA   ))  4.54  2.74  0.91
 assign (( resid  14 and name HG2* )) (( resid  15 and name HN   ))  3.78  1.98  0.76
 assign (( resid  16 and name HA   )) (( resid  17 and name HA   ))  4.59  2.79  0.92
 assign (( resid  19 and name HA   )) (( resid  20 and name HA2  ))  4.81  3.01  0.96
 assign (( resid  19 and name HA   )) (( resid  20 and name HA1  ))  4.53  2.73  0.91
 assign (( resid  19 and name HB2  )) (( resid  20 and name HA1  ))  4.72  2.92  0.94
 assign (( resid  20 and name HA1  )) (( resid  21 and name HB1  ))  4.88  3.08  0.98
 assign (( resid  20 and name HA1  )) (( resid  21 and name HB2  ))  5.82  4.02  1.16
 assign (( resid  21 and name HN   )) (( resid  21 and name HD2* ))  3.63  1.83  0.73
 assign (( resid  26 and name HD1* )) (( resid  41 and name HD1  ))  3.75  1.95  0.75
 assign (( resid  21 and name HA   )) (( resid  21 and name HG   ))  3.85  2.05  0.77
 assign (( resid  21 and name HA   )) (( resid  22 and name HA   ))  4.60  2.80  0.92
 assign (( resid  21 and name HB2  )) (( resid  22 and name HA   ))  4.82  3.02  0.96
 assign (( resid  21 and name HB2  )) (( resid  25 and name HB2  ))  4.50  2.70  0.90
 assign (( resid  21 and name HB2  )) (( resid  26 and name HA   ))  4.92  3.12  0.98
 assign (( resid  21 and name HB2  )) (( resid  26 and name HB2  ))  4.84  3.04  0.97
 assign (( resid  21 and name HB2  )) (( resid  26 and name HB1  ))  4.34  2.54  0.87
 assign (( resid  21 and name HG   )) (( resid  25 and name HB1  ))  5.16  3.36  1.03
 assign (( resid  22 and name HB   )) (( resid  23 and name HN   ))  3.66  1.86  0.73
 assign (( resid  23 and name HA   )) (( resid  26 and name HB2  ))  4.84  3.04  0.97
 assign (( resid  23 and name HA   )) (( resid  26 and name HB1  ))  5.41  3.61  1.08
 assign (( resid  21 and name HB2  )) (( resid  22 and name HB   ))  5.62  3.82  1.12
 assign (( resid  22 and name HB   )) (( resid  43 and name HB*  ))  5.92  4.12  1.18
 assign (( resid  23 and name HB1  )) (( resid  26 and name HD2* ))  3.20  1.40  0.64
 assign (( resid  27 and name HA   )) (( resid  30 and name HB1  ))  4.12  2.32  0.82
 assign (( resid  23 and name HA   )) (( resid  27 and name HB1  ))  4.10  2.30  0.82
 assign (( resid  23 and name HG2  )) (( resid  23 and name HE1  ))  4.11  2.31  0.82
 assign (( resid  23 and name HA   )) (( resid  23 and name HG2  ))  4.08  2.28  0.82
 assign (( resid  23 and name HG2  )) (( resid  23 and name HE2  ))  4.11  2.31  0.82
 assign (( resid  23 and name HA   )) (( resid  23 and name HG1  ))  4.08  2.28  0.82
 assign (( resid  23 and name HG1  )) (( resid  23 and name HE2  ))  4.11  2.31  0.82
 assign (( resid  23 and name HG1  )) (( resid  23 and name HE1  ))  4.11  2.31  0.82
 assign (( resid  22 and name HA   )) (( resid  24 and name HN   ))  4.67  2.87  0.93
 assign (( resid  23 and name HB1  )) (( resid  24 and name HN   ))  4.78  2.98  0.96
 assign (( resid  23 and name HG2  )) (( resid  24 and name HN   ))  4.74  2.94  0.95
 assign (( resid  24 and name HN   )) (( resid  25 and name HG1  ))  4.89  3.09  0.98
 assign (( resid  24 and name HA   )) (( resid  24 and name HG2  ))  3.10  1.30  0.62
 assign (( resid  22 and name HB   )) (( resid  24 and name HG1  ))  4.44  2.64  0.89
 assign (( resid  24 and name HA   )) (( resid  24 and name HG1  ))  3.58  1.78  0.72
 assign (( resid  24 and name HB1  )) (( resid  25 and name HN   ))  3.91  2.11  0.78
 assign (( resid  24 and name HG1  )) (( resid  25 and name HN   ))  4.15  2.35  0.83
 assign (( resid  24 and name HG2  )) (( resid  25 and name HN   ))  4.86  3.06  0.97
 assign (( resid  25 and name HA   )) (( resid  28 and name HB2  ))  4.21  2.41  0.84
 assign (( resid  21 and name HB1  )) (( resid  25 and name HE21 ))  5.87  4.07  1.17
 assign (( resid  21 and name HD1* )) (( resid  25 and name HE21 ))  3.71  1.91  0.74
 assign (( resid  21 and name HG   )) (( resid  25 and name HE21 ))  4.60  2.80  0.92
 assign (( resid  22 and name HB   )) (( resid  25 and name HE21 ))  4.62  2.82  0.92
 assign (( resid  24 and name HB2  )) (( resid  25 and name HE21 ))  6.15  4.35  1.23
 assign (( resid  24 and name HB1  )) (( resid  25 and name HE21 ))  6.50  4.70  1.30
 assign (( resid  25 and name HA   )) (( resid  25 and name HG2  ))  3.06  1.26  0.61
 assign (( resid  24 and name HB2  )) (( resid  26 and name HN   ))  4.90  3.10  0.98
 assign (( resid  25 and name HB1  )) (( resid  26 and name HN   ))  5.12  3.32  1.02
 assign (( resid  26 and name HA   )) (( resid  26 and name HD1* ))  3.07  1.27  0.61
 assign (( resid  26 and name HA   )) (( resid  27 and name HA   ))  4.77  2.97  0.95
 assign (( resid  26 and name HA   )) (( resid  29 and name HG1  ))  4.24  2.44  0.85
 assign (( resid  26 and name HA   )) (( resid  29 and name HG2  ))  4.20  2.40  0.84
 assign (( resid  21 and name HB1  )) (( resid  26 and name HB2  ))  4.96  3.16  0.99
 assign (( resid  21 and name HB2  )) (( resid  25 and name HB1  ))  5.09  3.29  1.02
 assign (( resid  21 and name HB1  )) (( resid  26 and name HB1  ))  5.45  3.65  1.09
 assign (( resid  22 and name HA   )) (( resid  26 and name HB1  ))  3.98  2.18  0.80
 assign (( resid  23 and name HA   )) (( resid  26 and name HG   ))  4.30  2.50  0.86
 assign (( resid  26 and name HG   )) (( resid  27 and name HA   ))  4.47  2.67  0.89
 assign (( resid  21 and name HG   )) (( resid  26 and name HA   ))  3.33  1.53  0.67
 assign (( resid  21 and name HG   )) (( resid  25 and name HB2  ))  4.33  2.53  0.87
 assign (( resid  24 and name HA   )) (( resid  27 and name HN   ))  4.68  2.88  0.94
 assign (( resid  26 and name HB2  )) (( resid  27 and name HN   ))  4.37  2.57  0.87
 assign (( resid  26 and name HG   )) (( resid  27 and name HN   ))  3.90  2.10  0.78
 assign (( resid  27 and name HN   )) (( resid  27 and name HG1  ))  4.00  2.20  0.80
 assign (( resid  27 and name HA   )) (( resid  27 and name HG1  ))  3.98  2.18  0.80
 assign (( resid  32 and name HD2  )) (( resid  33 and name HD1* ))  4.76  2.96  0.95
 assign (( resid  27 and name HA   )) (( resid  27 and name HG2  ))  3.63  1.83  0.73
 assign (( resid  32 and name HB1  )) (( resid  33 and name HD1* ))  5.56  3.76  1.11
 assign (( resid  27 and name HG1  )) (( resid  28 and name HN   ))  3.95  2.15  0.79
 assign (( resid  27 and name HG2  )) (( resid  28 and name HA   ))  3.73  1.93  0.75
 assign (( resid  29 and name HN   )) (( resid  29 and name HG2  ))  3.30  1.50  0.66
 assign (( resid  29 and name HN   )) (( resid  30 and name HG   ))  4.22  2.42  0.84
 assign (( resid  28 and name HG2  )) (( resid  29 and name HA   ))  4.67  2.87  0.93
 assign (( resid  28 and name HG1  )) (( resid  29 and name HA   ))  4.67  2.87  0.93
 assign (( resid  29 and name HA   )) (( resid  32 and name HB1  ))  4.14  2.34  0.83
 assign (( resid  26 and name HD1* )) (( resid  29 and name HB2  ))  6.50  4.70  1.30
 assign (( resid  25 and name HB2  )) (( resid  26 and name HD2* ))  6.50  4.70  1.30
 assign (( resid  26 and name HD1* )) (( resid  29 and name HB1  ))  6.50  4.70  1.30
 assign (( resid  29 and name HB2  )) (( resid  30 and name HA   ))  4.55  2.75  0.91
 assign (( resid  29 and name HG2  )) (( resid  30 and name HN   ))  3.42  1.62  0.68
 assign (( resid  29 and name HB1  )) (( resid  29 and name HE21 ))  4.76  2.96  0.95
 assign (( resid  27 and name HB2  )) (( resid  31 and name HN   ))  5.14  3.34  1.03
 assign (( resid  29 and name HA   )) (( resid  29 and name HG2  ))  3.59  1.79  0.72
 assign (( resid  14 and name HD1* )) (( resid  30 and name HN   ))  5.32  3.52  1.06
 assign (( resid  30 and name HN   )) (( resid  31 and name HA   ))  5.03  3.23  1.01
 assign (( resid  30 and name HA   )) (( resid  30 and name HD2* ))  3.07  1.27  0.61
 assign (( resid  14 and name HD1* )) (( resid  30 and name HB2  ))  5.34  3.54  1.07
 assign (( resid  14 and name HD1* )) (( resid  89 and name HB   ))  5.91  4.11  1.18
 assign (( resid  14 and name HG2* )) (( resid  30 and name HB2  ))  4.85  3.05  0.97
 assign (( resid  27 and name HA   )) (( resid  30 and name HB2  ))  3.82  2.02  0.76
 assign (( resid  14 and name HD1* )) (( resid  30 and name HB1  ))  4.32  2.52  0.86
 assign (( resid  30 and name HB1  )) (( resid  31 and name HA   ))  4.88  3.08  0.98
 assign (( resid  27 and name HA   )) (( resid  30 and name HG   ))  3.57  1.77  0.71
 assign (( resid  27 and name HB2  )) (( resid  30 and name HG   ))  5.28  3.48  1.06
 assign (( resid  27 and name HB1  )) (( resid  30 and name HG   ))  5.73  3.93  1.15
 assign (( resid  30 and name HA   )) (( resid  30 and name HG   ))  3.85  2.05  0.77
 assign (( resid  27 and name HA   )) (( resid  31 and name HN   ))  4.60  2.80  0.92
 assign (( resid  27 and name HG2  )) (( resid  31 and name HN   ))  5.53  3.73  1.11
 assign (( resid  28 and name HA   )) (( resid  31 and name HN   ))  4.05  2.25  0.81
 assign (( resid  96 and name HA   )) (( resid  96 and name HE22 ))  4.11  2.31  0.82
 assign (( resid  31 and name HN   )) (( resid  31 and name HG1  ))  3.59  1.79  0.72
 assign (( resid  29 and name HA   )) (( resid  32 and name HD1  ))  4.89  3.09  0.98
 assign (( resid  31 and name HB1  )) (( resid  38 and name HB1  ))  3.52  1.72  0.70
 assign (( resid  31 and name HG1  )) (( resid  32 and name HB1  ))  5.65  3.85  1.13
 assign (( resid  27 and name HG2  )) (( resid  31 and name HG2  ))  4.59  2.79  0.92
 assign (( resid  28 and name HA   )) (( resid  31 and name HG2  ))  4.89  3.09  0.98
 assign (( resid  14 and name HB   )) (( resid  30 and name HD1* ))  4.23  2.43  0.85
 assign (( resid  14 and name HB   )) (( resid  30 and name HD2* ))  4.40  2.60  0.88
 assign (( resid  33 and name HB2  )) (( resid  33 and name HD1* ))  3.49  1.69  0.70
 assign (( resid  77 and name HG12 )) (( resid  87 and name HB1  ))  3.81  2.01  0.76
 assign (( resid  31 and name HG1  )) (( resid  32 and name HA   ))  4.46  2.66  0.89
 assign (( resid  31 and name HB2  )) (( resid  33 and name HN   ))  4.41  2.61  0.88
 assign (( resid  32 and name HB1  )) (( resid  33 and name HN   ))  4.44  2.64  0.89
 assign (( resid  33 and name HN   )) (( resid  33 and name HD1* ))  3.88  2.08  0.78
 assign (( resid  32 and name HB2  )) (( resid  33 and name HA   ))  4.58  2.78  0.92
 assign (( resid  33 and name HA   )) (( resid  33 and name HG   ))  3.76  1.96  0.75
 assign (( resid  33 and name HA   )) (( resid  34 and name HB1  ))  5.11  3.31  1.02
 assign (( resid  79 and name HB1  )) (( resid  79 and name HD2* ))  3.20  1.40  0.64
 assign (( resid  33 and name HB1  )) (( resid  34 and name HD1  ))  3.82  2.02  0.76
 assign (( resid  32 and name HA   )) (( resid  33 and name HD1* ))  4.91  3.11  0.98
 assign (( resid  33 and name HD1* )) (( resid  58 and name HD1* ))  3.70  1.90  0.74
 assign (( resid  34 and name HA   )) (( resid  35 and name HA   ))  4.71  2.91  0.94
 assign (( resid  31 and name HA   )) (( resid  33 and name HB2  ))  5.05  3.25  1.01
 assign (( resid  32 and name HB2  )) (( resid  33 and name HD1* ))  5.61  3.81  1.12
 assign (( resid  32 and name HG1  )) (( resid  33 and name HD1* ))  6.12  4.32  1.22
 assign (( resid  33 and name HD2* )) (( resid  34 and name HG2  ))  6.49  4.69  1.30
 assign (( resid  35 and name HN   )) (( resid  35 and name HB*  ))  3.02  1.22  0.60
 assign (( resid  34 and name HB1  )) (( resid  35 and name HB*  ))  5.10  3.30  1.02
 assign (( resid  62 and name HA   )) (( resid  66 and name HG11 ))  5.72  3.92  1.14
 assign (( resid  36 and name HA   )) (( resid  61 and name HD2  ))  4.93  3.13  0.99
 assign (( resid  36 and name HA   )) (( resid  61 and name HD1  ))  4.93  3.13  0.99
 assign (( resid  31 and name HB1  )) (( resid  38 and name HA   ))  3.88  2.08  0.78
 assign (( resid  29 and name HG2  )) (( resid  32 and name HD1  ))  5.41  3.61  1.08
 assign (( resid  29 and name HG2  )) (( resid  32 and name HG1  ))  6.50  4.70  1.30
 assign (( resid  39 and name HB2  )) (( resid  58 and name HG2* ))  4.49  2.69  0.90
 assign (( resid  39 and name HB1  )) (( resid  40 and name HB1  ))  5.28  3.48  1.06
 assign (( resid  39 and name HD1  )) (( resid  40 and name HB1  ))  4.17  2.37  0.83
 assign (( resid  39 and name HD1  )) (( resid  40 and name HB2  ))  5.55  3.75  1.11
 assign (( resid  39 and name HD1  )) (( resid  40 and name HG1  ))  3.94  2.14  0.79
 assign (( resid  39 and name HD2  )) (( resid  58 and name HG2* ))  5.15  3.35  1.03
 assign (( resid  39 and name HE1  )) (( resid  57 and name HB2  ))  5.34  3.54  1.07
 assign (( resid  39 and name HE2  )) (( resid  57 and name HB2  ))  6.08  4.28  1.22
 assign (( resid  39 and name HE2  )) (( resid  57 and name HB1  ))  5.18  3.38  1.04
 assign (( resid  40 and name HN   )) (( resid  40 and name HB2  ))  4.04  2.24  0.81
 assign (( resid  40 and name HA   )) (( resid  40 and name HG1  ))  3.91  2.11  0.78
 assign (( resid  40 and name HA   )) (( resid  41 and name HA   ))  4.46  2.66  0.89
 assign (( resid  40 and name HG1  )) (( resid  41 and name HA   ))  4.47  2.67  0.89
 assign (( resid  41 and name HA   )) (( resid  56 and name HA   ))  3.90  2.10  0.78
 assign (( resid  41 and name HA   )) (( resid  56 and name HB*  ))  3.52  1.72  0.70
 assign (( resid  23 and name HE2  )) (( resid  41 and name HB2  ))  4.52  2.72  0.90
 assign (( resid  23 and name HE1  )) (( resid  41 and name HB2  ))  4.52  2.72  0.90
 assign (( resid  40 and name HA   )) (( resid  41 and name HB2  ))  4.94  3.14  0.99
 assign (( resid  41 and name HB2  )) (( resid  56 and name HB*  ))  4.26  2.46  0.85
 assign (( resid  41 and name HB1  )) (( resid  56 and name HB*  ))  4.49  2.69  0.90
 assign (( resid  27 and name HA   )) (( resid  41 and name HD1  ))  4.32  2.52  0.86
 assign (( resid  23 and name HE2  )) (( resid  41 and name HD2  ))  4.28  2.48  0.86
 assign (( resid  23 and name HE1  )) (( resid  41 and name HD2  ))  4.28  2.48  0.86
 assign (( resid  41 and name HB2  )) (( resid  42 and name HN   ))  4.62  2.82  0.92
 assign (( resid  42 and name HN   )) (( resid  56 and name HB*  ))  3.62  1.82  0.72
 assign (( resid  42 and name HB1  )) (( resid  55 and name HA   ))  5.24  3.44  1.05
 assign (( resid  42 and name HD2  )) (( resid  55 and name HA   ))  4.67  2.87  0.93
 assign (( resid  14 and name HG2* )) (( resid  57 and name HD1  ))  4.75  2.95  0.95
 assign (( resid  42 and name HD2  )) (( resid  56 and name HB*  ))  3.57  1.77  0.71
 assign (( resid  43 and name HN   )) (( resid  43 and name HB*  ))  2.98  1.18  0.60
 assign (( resid  42 and name HA   )) (( resid  43 and name HB*  ))  4.01  2.21  0.80
 assign (( resid  43 and name HB*  )) (( resid  44 and name HN   ))  3.31  1.51  0.66
 assign (( resid  31 and name HA   )) (( resid  31 and name HG1  ))  3.68  1.88  0.74
 assign (( resid  21 and name HA   )) (( resid  21 and name HD2* ))  3.74  1.94  0.75
 assign (( resid  56 and name HN   )) (( resid  56 and name HB*  ))  3.52  1.72  0.70
 assign (( resid  39 and name HB1  )) (( resid  56 and name HB*  ))  5.59  3.79  1.12
 assign (( resid  40 and name HG1  )) (( resid  56 and name HB*  ))  5.63  3.83  1.13
 assign (( resid  17 and name HB2  )) (( resid  56 and name HB*  ))  5.32  3.52  1.06
 assign (( resid  17 and name HB1  )) (( resid  56 and name HB*  ))  5.32  3.52  1.06
 assign (( resid  14 and name HG2* )) (( resid  56 and name HB*  ))  3.24  1.44  0.65
 assign (( resid  42 and name HA   )) (( resid  56 and name HB*  ))  5.39  3.59  1.08
 assign (( resid  55 and name HA   )) (( resid  56 and name HB*  ))  3.94  2.14  0.79
 assign (( resid  56 and name HB*  )) (( resid  58 and name HD1* ))  4.71  2.91  0.94
 assign (( resid  14 and name HG2* )) (( resid  57 and name HN   ))  4.44  2.64  0.89
 assign (( resid  56 and name HB*  )) (( resid  57 and name HN   ))  3.33  1.53  0.67
 assign (( resid  13 and name HB   )) (( resid  57 and name HA   ))  5.01  3.21  1.00
 assign (( resid  13 and name HG2* )) (( resid  57 and name HA   ))  4.51  2.71  0.90
 assign (( resid  56 and name HB*  )) (( resid  57 and name HA   ))  4.70  2.90  0.94
 assign (( resid  56 and name HA   )) (( resid  57 and name HB2  ))  4.54  2.74  0.91
 assign (( resid  13 and name HG2* )) (( resid  57 and name HB1  ))  5.37  3.57  1.07
 assign (( resid  13 and name HA   )) (( resid  57 and name HD2  ))  4.84  3.04  0.97
 assign (( resid  13 and name HG2* )) (( resid  57 and name HD2  ))  4.37  2.57  0.87
 assign (( resid  13 and name HG1* )) (( resid  57 and name HD2  ))  3.85  2.05  0.77
 assign (( resid  56 and name HA   )) (( resid  57 and name HD1  ))  4.19  2.39  0.84
 assign (( resid  13 and name HG2* )) (( resid  93 and name HN   ))  5.39  3.59  1.08
 assign (( resid  57 and name HB1  )) (( resid  58 and name HN   ))  4.12  2.32  0.82
 assign (( resid  58 and name HN   )) (( resid  58 and name HG11 ))  5.34  3.54  1.07
 assign (( resid  58 and name HN   )) (( resid  58 and name HG2* ))  4.17  2.37  0.83
 assign (( resid  57 and name HB1  )) (( resid  58 and name HA   ))  4.20  2.40  0.84
 assign (( resid  58 and name HA   )) (( resid  58 and name HD1* ))  3.98  2.18  0.80
 assign (( resid  58 and name HA   )) (( resid  58 and name HG2* ))  3.37  1.57  0.67
 assign (( resid  58 and name HA   )) (( resid  59 and name HA   ))  4.88  3.08  0.98
 assign (( resid  59 and name HA   )) (( resid  60 and name HA   ))  5.24  3.44  1.05
 assign (( resid  14 and name HD1* )) (( resid  58 and name HD1* ))  3.36  1.56  0.67
 assign (( resid  58 and name HB   )) (( resid  58 and name HD1* ))  3.64  1.84  0.73
 assign (( resid  58 and name HG2* )) (( resid  58 and name HG12 ))  3.47  1.67  0.69
 assign (( resid  14 and name HG2* )) (( resid  58 and name HG11 ))  4.11  2.31  0.82
 assign (( resid  58 and name HG2* )) (( resid  58 and name HG11 ))  3.60  1.80  0.72
 assign (( resid  36 and name HB2  )) (( resid  58 and name HG2* ))  5.68  3.88  1.14
 assign (( resid  36 and name HB1  )) (( resid  58 and name HG2* ))  5.68  3.88  1.14
 assign (( resid  58 and name HD1* )) (( resid  59 and name HN   ))  4.95  3.15  0.99
 assign (( resid  58 and name HG2* )) (( resid  59 and name HN   ))  3.59  1.79  0.72
 assign (( resid  58 and name HG2* )) (( resid  59 and name HA   ))  3.94  2.14  0.79
 assign (( resid  58 and name HG2* )) (( resid  60 and name HN   ))  4.47  2.67  0.89
 assign (( resid  36 and name HA   )) (( resid  37 and name HA   ))  4.60  2.80  0.92
 assign (( resid  36 and name HA   )) (( resid  61 and name HN   ))  4.82  3.02  0.96
 assign (( resid  61 and name HN   )) (( resid  61 and name HB1  ))  4.10  2.30  0.82
 assign (( resid  61 and name HN   )) (( resid  62 and name HA   ))  5.13  3.33  1.03
 assign (( resid  61 and name HA   )) (( resid  61 and name HD2  ))  4.06  2.26  0.81
 assign (( resid  61 and name HA   )) (( resid  61 and name HD1  ))  4.06  2.26  0.81
 assign (( resid  61 and name HB2  )) (( resid  62 and name HB1  ))  5.60  3.80  1.12
 assign (( resid  62 and name HN   )) (( resid  62 and name HB2  ))  3.73  1.93  0.75
 assign (( resid  61 and name HA   )) (( resid  62 and name HA   ))  4.58  2.78  0.92
 assign (( resid  62 and name HA   )) (( resid  63 and name HG1  ))  4.43  2.63  0.89
 assign (( resid  62 and name HA   )) (( resid  62 and name HD21 ))  4.53  2.73  0.91
 assign (( resid  62 and name HB2  )) (( resid  62 and name HD22 ))  4.08  2.28  0.82
 assign (( resid  63 and name HA   )) (( resid  66 and name HD1* ))  3.70  1.90  0.74
 assign (( resid  63 and name HA   )) (( resid  66 and name HG12 ))  5.56  3.76  1.11
 assign (( resid  62 and name HA   )) (( resid  63 and name HD1  ))  3.37  1.57  0.67
 assign (( resid  62 and name HB1  )) (( resid  63 and name HA   ))  5.66  3.86  1.13
 assign (( resid  62 and name HB1  )) (( resid  63 and name HD1  ))  5.96  4.16  1.19
 assign (( resid  62 and name HB2  )) (( resid  63 and name HD1  ))  5.06  3.26  1.01
 assign (( resid  62 and name HA   )) (( resid  63 and name HD2  ))  3.47  1.67  0.69
 assign (( resid  62 and name HB1  )) (( resid  63 and name HD2  ))  4.50  2.70  0.90
 assign (( resid  62 and name HB2  )) (( resid  63 and name HD2  ))  4.09  2.29  0.82
 assign (( resid  63 and name HD2  )) (( resid  66 and name HD1* ))  5.51  3.71  1.10
 assign (( resid  61 and name HB1  )) (( resid  62 and name HB2  ))  4.58  2.78  0.92
 assign (( resid  62 and name HB1  )) (( resid  64 and name HN   ))  4.46  2.66  0.89
 assign (( resid  62 and name HB2  )) (( resid  64 and name HN   ))  5.28  3.48  1.06
 assign (( resid  63 and name HD1  )) (( resid  64 and name HN   ))  4.23  2.43  0.85
 assign (( resid  64 and name HN   )) (( resid  64 and name HB1  ))  3.51  1.71  0.70
 assign (( resid  62 and name HB2  )) (( resid  65 and name HN   ))  4.49  2.69  0.90
 assign (( resid  63 and name HD1  )) (( resid  65 and name HN   ))  5.45  3.65  1.09
 assign (( resid  63 and name HG2  )) (( resid  65 and name HN   ))  5.04  3.24  1.01
 assign (( resid  65 and name HN   )) (( resid  68 and name HB1  ))  4.85  3.05  0.97
 assign (( resid  65 and name HA   )) (( resid  68 and name HG   ))  3.92  2.12  0.78
 assign (( resid  60 and name HD1  )) (( resid  66 and name HD1* ))  4.13  2.33  0.83
 assign (( resid   9 and name HA   )) (( resid  66 and name HD1* ))  5.16  3.36  1.03
 assign (( resid  63 and name HA   )) (( resid  66 and name HG11 ))  4.37  2.57  0.87
 assign (( resid  66 and name HG2* )) (( resid  66 and name HG11 ))  4.11  2.31  0.82
 assign (( resid  63 and name HG2  )) (( resid  66 and name HD1* ))  5.20  3.40  1.04
 assign (( resid  62 and name HD22 )) (( resid  64 and name HA   ))  4.69  2.89  0.94
 assign (( resid  67 and name HN   )) (( resid  67 and name HB1  ))  3.76  1.96  0.75
 assign (( resid  67 and name HN   )) (( resid  67 and name HB2  ))  3.85  2.05  0.77
 assign (( resid  21 and name HD1* )) (( resid  29 and name HE21 ))  3.12  1.32  0.62
 assign (( resid  67 and name HN   )) (( resid  67 and name HD1* ))  3.57  1.77  0.71
 assign (( resid  67 and name HN   )) (( resid  67 and name HD2* ))  3.49  1.69  0.70
 assign (( resid  66 and name HG2* )) (( resid  67 and name HA   ))  4.40  2.60  0.88
 assign (( resid  21 and name HD1* )) (( resid  26 and name HA   ))  3.42  1.62  0.68
 assign (( resid  64 and name HA   )) (( resid  67 and name HD1* ))  3.58  1.78  0.72
 assign (( resid  67 and name HB1  )) (( resid  67 and name HD1* ))  3.28  1.48  0.66
 assign (( resid  67 and name HD1* )) (( resid  68 and name HB1  ))  3.44  1.64  0.69
 assign (( resid  67 and name HB1  )) (( resid  68 and name HN   ))  4.33  2.53  0.87
 assign (( resid  67 and name HB2  )) (( resid  68 and name HN   ))  4.17  2.37  0.83
 assign (( resid  67 and name HD1* )) (( resid  68 and name HN   ))  3.00  1.20  0.60
 assign (( resid  67 and name HG   )) (( resid  68 and name HN   ))  3.22  1.42  0.64
 assign (( resid  68 and name HN   )) (( resid  68 and name HB2  ))  3.43  1.63  0.69
 assign (( resid  68 and name HN   )) (( resid  69 and name HA   ))  5.39  3.59  1.08
 assign (( resid  67 and name HD1* )) (( resid  68 and name HA   ))  3.05  1.25  0.61
 assign (( resid  68 and name HA   )) (( resid  68 and name HD1* ))  2.71  0.91  0.54
 assign (( resid  68 and name HA   )) (( resid  71 and name HB2  ))  4.45  2.65  0.89
 assign (( resid  65 and name HA   )) (( resid  68 and name HB1  ))  3.41  1.61  0.68
 assign (( resid  79 and name HB2  )) (( resid  79 and name HD1* ))  2.50  0.70  0.50
 assign (( resid  67 and name HB1  )) (( resid  67 and name HD2* ))  2.83  1.03  0.57
 assign (( resid  68 and name HG   )) (( resid  72 and name HG2  ))  5.49  3.69  1.10
 assign (( resid  65 and name HA   )) (( resid  68 and name HD2* ))  5.44  3.64  1.09
 assign (( resid  65 and name HA   )) (( resid  68 and name HD1* ))  4.93  3.13  0.99
 assign (( resid  68 and name HB1  )) (( resid  68 and name HD1* ))  3.30  1.50  0.66
 assign (( resid  68 and name HD1* )) (( resid  69 and name HA   ))  4.29  2.49  0.86
 assign (( resid  68 and name HD1* )) (( resid  72 and name HD1  ))  4.46  2.66  0.89
 assign (( resid  68 and name HG   )) (( resid  72 and name HD1  ))  4.28  2.48  0.86
 assign (( resid  68 and name HG   )) (( resid  69 and name HA   ))  4.16  2.36  0.83
 assign (( resid  69 and name HA   )) (( resid  72 and name HB1  ))  4.22  2.42  0.84
 assign (( resid  69 and name HA   )) (( resid  72 and name HB2  ))  4.54  2.74  0.91
 assign (( resid  69 and name HA   )) (( resid  72 and name HD2  ))  4.46  2.66  0.89
 assign (( resid  69 and name HA   )) (( resid  72 and name HG2  ))  4.60  2.80  0.92
 assign (( resid  68 and name HG   )) (( resid  69 and name HB1  ))  4.79  2.99  0.96
 assign (( resid  12 and name HB   )) (( resid  60 and name HD2  ))  4.39  2.59  0.88
 assign (( resid  12 and name HG1* )) (( resid  60 and name HD2  ))  3.78  1.98  0.76
 assign (( resid  12 and name HG2* )) (( resid  60 and name HD2  ))  3.78  1.98  0.76
 assign (( resid  69 and name HD2  )) (( resid  70 and name HA   ))  5.26  3.46  1.05
 assign (( resid  33 and name HG   )) (( resid  69 and name HD2  ))  4.78  2.98  0.96
 assign (( resid  69 and name HA   )) (( resid  69 and name HD1  ))  4.01  2.21  0.80
 assign (( resid  69 and name HA   )) (( resid  69 and name HD2  ))  4.23  2.43  0.85
 assign (( resid  67 and name HA   )) (( resid  70 and name HN   ))  4.28  2.48  0.86
 assign (( resid  69 and name HB1  )) (( resid  70 and name HN   ))  5.85  4.05  1.17
 assign (( resid  69 and name HA   )) (( resid  70 and name HA   ))  4.95  3.15  0.99
 assign (( resid  70 and name HA   )) (( resid  90 and name HB   ))  4.45  2.65  0.89
 assign (( resid  70 and name HA   )) (( resid  73 and name HB2  ))  4.61  2.81  0.92
 assign (( resid  67 and name HA   )) (( resid  71 and name HN   ))  4.18  2.38  0.84
 assign (( resid  70 and name HB1  )) (( resid  71 and name HN   ))  4.42  2.62  0.88
 assign (( resid  71 and name HN   )) (( resid  72 and name HA   ))  5.24  3.44  1.05
 assign (( resid  68 and name HA   )) (( resid  71 and name HB1  ))  4.01  2.21  0.80
 assign (( resid  71 and name HB1  )) (( resid  72 and name HA   ))  4.43  2.63  0.89
 assign (( resid  62 and name HD21 )) (( resid  65 and name HB2  ))  4.07  2.27  0.81
 assign (( resid  72 and name HN   )) (( resid  72 and name HB2  ))  3.60  1.80  0.72
 assign (( resid  72 and name HN   )) (( resid  72 and name HD1  ))  4.62  2.82  0.92
 assign (( resid  72 and name HN   )) (( resid  72 and name HD2  ))  4.60  2.80  0.92
 assign (( resid  72 and name HN   )) (( resid  72 and name HG1  ))  4.04  2.24  0.81
 assign (( resid  72 and name HA   )) (( resid  72 and name HG2  ))  3.91  2.11  0.78
 assign (( resid  68 and name HD1* )) (( resid  72 and name HB1  ))  4.47  2.67  0.89
 assign (( resid  72 and name HB1  )) (( resid  72 and name HD1  ))  3.71  1.91  0.74
 assign (( resid  72 and name HB1  )) (( resid  72 and name HD2  ))  3.79  1.99  0.76
 assign (( resid  72 and name HB2  )) (( resid  72 and name HD1  ))  3.67  1.87  0.73
 assign (( resid  68 and name HD1* )) (( resid  72 and name HD2  ))  3.71  1.91  0.74
 assign (( resid  72 and name HA   )) (( resid  72 and name HD2  ))  4.73  2.93  0.95
 assign (( resid  42 and name HB1  )) (( resid  56 and name HB*  ))  4.67  2.87  0.93
 assign (( resid  72 and name HA   )) (( resid  72 and name HG1  ))  3.58  1.78  0.72
 assign (( resid  72 and name HB1  )) (( resid  73 and name HN   ))  3.87  2.07  0.77
 assign (( resid  72 and name HB2  )) (( resid  73 and name HN   ))  4.44  2.64  0.89
 assign (( resid  72 and name HD2  )) (( resid  73 and name HN   ))  5.61  3.81  1.12
 assign (( resid  73 and name HA   )) (( resid  76 and name HA   ))  5.17  3.37  1.03
 assign (( resid  70 and name HA   )) (( resid  73 and name HB1  ))  4.35  2.55  0.87
 assign (( resid  73 and name HB1  )) (( resid  88 and name HB*  ))  5.50  3.70  1.10
 assign (( resid  69 and name HA   )) (( resid  73 and name HD2  ))  4.55  2.75  0.91
 assign (( resid  72 and name HB1  )) (( resid  73 and name HD2  ))  4.63  2.83  0.93
 assign (( resid  72 and name HB2  )) (( resid  73 and name HD2  ))  4.74  2.94  0.95
 assign (( resid  72 and name HD2  )) (( resid  73 and name HD2  ))  4.52  2.72  0.90
 assign (( resid  73 and name HD1  )) (( resid  88 and name HB*  ))  5.48  3.68  1.10
 assign (( resid  74 and name HA   )) (( resid  89 and name HA   ))  5.00  3.20  1.00
 assign (( resid  75 and name HN   )) (( resid  88 and name HB*  ))  4.83  3.03  0.97
 assign (( resid  75 and name HN   )) (( resid  89 and name HA   ))  3.64  1.84  0.73
 assign (( resid  75 and name HA2  )) (( resid  89 and name HA   ))  3.78  1.98  0.76
 assign (( resid  77 and name HA   )) (( resid  88 and name HB*  ))  5.98  4.18  1.20
 assign (( resid  73 and name HA   )) (( resid  76 and name HB1  ))  3.59  1.79  0.72
 assign (( resid  76 and name HB1  )) (( resid  88 and name HB*  ))  4.18  2.38  0.84
 assign (( resid  76 and name HA   )) (( resid  76 and name HD2  ))  3.86  2.06  0.77
 assign (( resid  76 and name HA   )) (( resid  77 and name HN   ))  3.17  1.37  0.63
 assign (( resid  77 and name HN   )) (( resid  77 and name HG2* ))  3.78  1.98  0.76
 assign (( resid  77 and name HA   )) (( resid  77 and name HD1* ))  3.24  1.44  0.65
 assign (( resid  77 and name HA   )) (( resid  77 and name HG12 ))  4.00  2.20  0.80
 assign (( resid  77 and name HA   )) (( resid  77 and name HG11 ))  4.01  2.21  0.80
 assign (( resid  77 and name HA   )) (( resid  77 and name HG2* ))  3.31  1.51  0.66
 assign (( resid  77 and name HG12 )) (( resid  87 and name HB2  ))  5.41  3.61  1.08
 assign (( resid  77 and name HG2* )) (( resid  77 and name HG11 ))  3.19  1.39  0.64
 assign (( resid  77 and name HD1* )) (( resid  87 and name HG2  ))  4.09  2.29  0.82
 assign (( resid  77 and name HG2* )) (( resid  78 and name HB2  ))  4.79  2.99  0.96
 assign (( resid  77 and name HG2* )) (( resid  78 and name HB1  ))  4.79  2.99  0.96
 assign (( resid  77 and name HD1* )) (( resid  78 and name HN   ))  3.61  1.81  0.72
 assign (( resid  77 and name HG2* )) (( resid  78 and name HA   ))  4.19  2.39  0.84
 assign (( resid  78 and name HA   )) (( resid  79 and name HA   ))  4.70  2.90  0.94
 assign (( resid  78 and name HA   )) (( resid  79 and name HB1  ))  5.91  4.11  1.18
 assign (( resid  78 and name HA   )) (( resid  79 and name HD1* ))  4.20  2.40  0.84
 assign (( resid  78 and name HA   )) (( resid  79 and name HG   ))  4.44  2.64  0.89
 assign (( resid  21 and name HD1* )) (( resid  29 and name HE22 ))  3.64  1.84  0.73
 assign (( resid  78 and name HB2  )) (( resid  79 and name HN   ))  4.58  2.78  0.92
 assign (( resid  79 and name HN   )) (( resid  79 and name HB1  ))  3.99  2.19  0.80
 assign (( resid  79 and name HN   )) (( resid  79 and name HD1* ))  3.25  1.45  0.65
 assign (( resid  77 and name HG2* )) (( resid  79 and name HA   ))  4.41  2.61  0.88
 assign (( resid  79 and name HA   )) (( resid  79 and name HD1* ))  3.87  2.07  0.77
 assign (( resid  79 and name HA   )) (( resid  79 and name HD2* ))  2.88  1.08  0.58
 assign (( resid  79 and name HA   )) (( resid  79 and name HG   ))  3.79  1.99  0.76
 assign (( resid  78 and name HA   )) (( resid  79 and name HB2  ))  4.56  2.76  0.91
 assign (( resid  68 and name HB1  )) (( resid  68 and name HG   ))  2.80  1.00  0.56
 assign (( resid  79 and name HB2  )) (( resid  83 and name HA2  ))  4.49  2.69  0.90
 assign (( resid  79 and name HB1  )) (( resid  83 and name HA1  ))  4.17  2.37  0.83
 assign (( resid  79 and name HB1  )) (( resid  83 and name HA2  ))  4.38  2.58  0.88
 assign (( resid  67 and name HB2  )) (( resid  67 and name HD1* ))  2.72  0.92  0.54
 assign (( resid  77 and name HG2* )) (( resid  79 and name HD1* ))  3.21  1.41  0.64
 assign (( resid  79 and name HB1  )) (( resid  79 and name HD1* ))  3.36  1.56  0.67
 assign (( resid  79 and name HD1* )) (( resid  85 and name HA   ))  4.31  2.51  0.86
 assign (( resid  79 and name HD1* )) (( resid  85 and name HB1  ))  5.11  3.31  1.02
 assign (( resid  79 and name HB2  )) (( resid  79 and name HD2* ))  3.57  1.77  0.71
 assign (( resid  80 and name HN   )) (( resid  81 and name HA   ))  5.52  3.72  1.10
 assign (( resid  80 and name HN   )) (( resid  83 and name HA1  ))  4.59  2.79  0.92
 assign (( resid  82 and name HN   )) (( resid  82 and name HD2  ))  5.26  3.46  1.05
 assign (( resid  82 and name HN   )) (( resid  82 and name HD1  ))  5.26  3.46  1.05
 assign (( resid  81 and name HA   )) (( resid  82 and name HA   ))  4.91  3.11  0.98
 assign (( resid  81 and name HB2  )) (( resid  82 and name HA   ))  5.10  3.30  1.02
 assign (( resid  81 and name HB1  )) (( resid  82 and name HA   ))  5.10  3.30  1.02
 assign (( resid  82 and name HA   )) (( resid  82 and name HD2  ))  3.59  1.79  0.72
 assign (( resid  82 and name HA   )) (( resid  82 and name HD1  ))  3.59  1.79  0.72
 assign (( resid  82 and name HA   )) (( resid  82 and name HG2  ))  3.12  1.32  0.62
 assign (( resid  82 and name HA   )) (( resid  83 and name HA2  ))  5.28  3.48  1.06
 assign (( resid  82 and name HA   )) (( resid  82 and name HB1  ))  3.01  1.21  0.60
 assign (( resid  79 and name HB2  )) (( resid  83 and name HN   ))  5.61  3.81  1.12
 assign (( resid  79 and name HA   )) (( resid  83 and name HA1  ))  5.76  3.96  1.15
 assign (( resid  79 and name HA   )) (( resid  84 and name HA   ))  6.04  4.24  1.21
 assign (( resid  79 and name HD2* )) (( resid  83 and name HA2  ))  3.45  1.65  0.69
 assign (( resid  32 and name HD2  )) (( resid  33 and name HG   ))  4.21  2.41  0.84
 assign (( resid  83 and name HA2  )) (( resid  84 and name HA   ))  4.80  3.00  0.96
 assign (( resid  46 and name HA   )) (( resid  46 and name HG   ))  4.05  2.25  0.81
 assign (( resid  77 and name HG2* )) (( resid  85 and name HN   ))  4.55  2.75  0.91
 assign (( resid  79 and name HG   )) (( resid  85 and name HN   ))  4.97  3.17  0.99
 assign (( resid  77 and name HD1* )) (( resid  85 and name HA   ))  3.98  2.18  0.80
 assign (( resid  77 and name HG2* )) (( resid  85 and name HA   ))  3.40  1.60  0.68
 assign (( resid  79 and name HA   )) (( resid  85 and name HA   ))  4.20  2.40  0.84
 assign (( resid  79 and name HD2* )) (( resid  85 and name HA   ))  2.99  1.19  0.60
 assign (( resid  79 and name HG   )) (( resid  85 and name HA   ))  3.94  2.14  0.79
 assign (( resid  77 and name HD1* )) (( resid  85 and name HB1  ))  3.38  1.58  0.68
 assign (( resid  77 and name HG2* )) (( resid  85 and name HB1  ))  3.23  1.43  0.65
 assign (( resid  79 and name HD2* )) (( resid  85 and name HG2  ))  3.14  1.34  0.63
 assign (( resid  77 and name HB   )) (( resid  87 and name HB1  ))  6.50  4.70  1.30
 assign (( resid  77 and name HG2* )) (( resid  85 and name HB2  ))  4.11  2.31  0.82
 assign (( resid  21 and name HD2* )) (( resid  26 and name HB2  ))  3.75  1.95  0.75
 assign (( resid  79 and name HD2* )) (( resid  85 and name HG1  ))  3.14  1.34  0.63
 assign (( resid  77 and name HD1* )) (( resid  86 and name HN   ))  3.68  1.88  0.74
 assign (( resid  77 and name HG2* )) (( resid  86 and name HN   ))  3.30  1.50  0.66
 assign (( resid  86 and name HN   )) (( resid  87 and name HD2  ))  4.70  2.90  0.94
 assign (( resid  86 and name HN   )) (( resid  87 and name HD1  ))  4.70  2.90  0.94
 assign (( resid  86 and name HA   )) (( resid  87 and name HD2  ))  3.51  1.71  0.70
 assign (( resid  86 and name HA   )) (( resid  87 and name HG1  ))  4.63  2.83  0.93
 assign (( resid  85 and name HA   )) (( resid  86 and name HB2  ))  4.67  2.87  0.93
 assign (( resid  86 and name HA   )) (( resid  87 and name HD1  ))  3.51  1.71  0.70
 assign (( resid  21 and name HD2* )) (( resid  22 and name HN   ))  4.45  2.65  0.89
 assign (( resid  21 and name HD1* )) (( resid  86 and name HD2  ))  4.35  2.55  0.87
 assign (( resid  21 and name HG   )) (( resid  22 and name HN   ))  4.03  2.23  0.81
 assign (( resid  78 and name HB1  )) (( resid  86 and name HD2  ))  5.32  3.52  1.06
 assign (( resid  79 and name HA   )) (( resid  86 and name HD2  ))  4.76  2.96  0.95
 assign (( resid  86 and name HA   )) (( resid  86 and name HD1  ))  4.24  2.44  0.85
 assign (( resid  77 and name HA   )) (( resid  87 and name HA   ))  3.85  2.05  0.77
 assign (( resid  77 and name HD1* )) (( resid  87 and name HA   ))  3.37  1.57  0.67
 assign (( resid  77 and name HG12 )) (( resid  87 and name HA   ))  4.21  2.41  0.84
 assign (( resid  77 and name HG2* )) (( resid  87 and name HA   ))  4.07  2.27  0.81
 assign (( resid  87 and name HA   )) (( resid  88 and name HA   ))  4.49  2.69  0.90
 assign (( resid  87 and name HA   )) (( resid  88 and name HB*  ))  4.00  2.20  0.80
 assign (( resid  75 and name HA1  )) (( resid  87 and name HB2  ))  5.44  3.64  1.09
 assign (( resid  75 and name HA2  )) (( resid  87 and name HB2  ))  4.57  2.77  0.91
 assign (( resid  77 and name HA   )) (( resid  87 and name HB2  ))  4.84  3.04  0.97
 assign (( resid  82 and name HB2  )) (( resid  83 and name HA1  ))  5.53  3.73  1.11
 assign (( resid  82 and name HB1  )) (( resid  83 and name HA1  ))  5.94  4.14  1.19
 assign (( resid  75 and name HA2  )) (( resid  87 and name HB1  ))  5.38  3.58  1.08
 assign (( resid  87 and name HG2  )) (( resid  88 and name HA   ))  5.07  3.27  1.01
 assign (( resid  77 and name HD1* )) (( resid  87 and name HD2  ))  3.99  2.19  0.80
 assign (( resid  77 and name HD1* )) (( resid  87 and name HD1  ))  3.99  2.19  0.80
 assign (( resid  77 and name HD1* )) (( resid  87 and name HG1  ))  3.54  1.74  0.71
 assign (( resid  87 and name HB1  )) (( resid  88 and name HN   ))  4.17  2.37  0.83
 assign (( resid  86 and name HN   )) (( resid  87 and name HG1  ))  6.21  4.41  1.24
 assign (( resid  87 and name HG2  )) (( resid  88 and name HN   ))  5.04  3.24  1.01
 assign (( resid  88 and name HN   )) (( resid  88 and name HB*  ))  3.03  1.23  0.61
 assign (( resid  76 and name HA   )) (( resid  88 and name HB*  ))  5.24  3.44  1.05
 assign (( resid  88 and name HB*  )) (( resid  89 and name HB   ))  5.57  3.77  1.11
 assign (( resid  88 and name HA   )) (( resid  89 and name HN   ))  3.33  1.53  0.67
 assign (( resid  89 and name HN   )) (( resid  89 and name HG1* ))  3.96  2.16  0.79
 assign (( resid  89 and name HN   )) (( resid  89 and name HG2* ))  3.96  2.16  0.79
 assign (( resid  88 and name HA   )) (( resid  89 and name HA   ))  4.62  2.82  0.92
 assign (( resid  88 and name HB*  )) (( resid  89 and name HA   ))  4.46  2.66  0.89
 assign (( resid  89 and name HA   )) (( resid  89 and name HG1* ))  3.23  1.43  0.65
 assign (( resid  89 and name HA   )) (( resid  89 and name HG2* ))  3.23  1.43  0.65
 assign (( resid  89 and name HA   )) (( resid  90 and name HA   ))  4.49  2.69  0.90
 assign (( resid  16 and name HA   )) (( resid  89 and name HB   ))  6.03  4.23  1.21
 assign (( resid  88 and name HA   )) (( resid  89 and name HB   ))  4.81  3.01  0.96
 assign (( resid  14 and name HA   )) (( resid  90 and name HN   ))  5.39  3.59  1.08
 assign (( resid  74 and name HA   )) (( resid  90 and name HN   ))  4.23  2.43  0.85
 assign (( resid  70 and name HA   )) (( resid  90 and name HG1* ))  4.43  2.63  0.89
 assign (( resid  70 and name HA   )) (( resid  90 and name HG2* ))  4.43  2.63  0.89
 assign (( resid  91 and name HB2  )) (( resid  92 and name HA   ))  5.17  3.37  1.03
 assign (( resid  12 and name HG1* )) (( resid  92 and name HA   ))  4.65  2.85  0.93
 assign (( resid  12 and name HA   )) (( resid  93 and name HN   ))  2.91  1.11  0.58
 assign (( resid  12 and name HG1* )) (( resid  93 and name HN   ))  4.64  2.84  0.93
 assign (( resid  13 and name HG2* )) (( resid  93 and name HB*  ))  3.87  2.07  0.77
 assign (( resid  96 and name HA   )) (( resid  97 and name HN   ))  3.00  1.20  0.60
 assign (( resid  96 and name HB1  )) (( resid  97 and name HN   ))  4.34  2.54  0.87
 assign (( resid  97 and name HN   )) (( resid  97 and name HB2  ))  3.62  1.82  0.72
 assign (( resid  96 and name HA   )) (( resid  97 and name HA   ))  4.42  2.62  0.88
 assign (( resid  12 and name HG1* )) (( resid  66 and name HG11 ))  6.50  4.70  1.30
 assign (( resid  12 and name HG2* )) (( resid  66 and name HG11 ))  6.50  4.70  1.30
 assign (( resid  14 and name HG11 )) (( resid  15 and name HN   ))  4.91  3.11  0.98
 assign (( resid  14 and name HG2* )) (( resid  41 and name HD1  ))  5.27  3.47  1.05
 assign (( resid  16 and name HB2  )) (( resid  88 and name HA   ))  6.50  4.70  1.30
 assign (( resid  16 and name HB1  )) (( resid  88 and name HA   ))  6.50  4.70  1.30
 assign (( resid  17 and name HD1* )) (( resid  86 and name HB1  ))  4.93  3.13  0.99
 assign (( resid  17 and name HD2* )) (( resid  88 and name HB*  ))  3.49  1.69  0.70
 assign (( resid  23 and name HB1  )) (( resid  23 and name HE1  ))  5.00  3.20  1.00
 assign (( resid  23 and name HB1  )) (( resid  23 and name HE2  ))  5.00  3.20  1.00
 assign (( resid  22 and name HB   )) (( resid  24 and name HG2  ))  5.24  3.44  1.05
 assign (( resid  23 and name HG2  )) (( resid  27 and name HB1  ))  6.50  4.70  1.30
 assign (( resid  23 and name HG1  )) (( resid  27 and name HB1  ))  6.50  4.70  1.30
 assign (( resid  35 and name HB*  )) (( resid  36 and name HN   ))  3.72  1.92  0.74
 assign (( resid  27 and name HB1  )) (( resid  41 and name HB2  ))  5.79  3.99  1.16
 assign (( resid  27 and name HB1  )) (( resid  41 and name HB1  ))  5.43  3.63  1.09
 assign (( resid  23 and name HN   )) (( resid  43 and name HB*  ))  6.50  4.70  1.30
 assign (( resid  23 and name HE1  )) (( resid  43 and name HB*  ))  6.50  4.70  1.30
 assign (( resid  23 and name HE2  )) (( resid  43 and name HB*  ))  6.50  4.70  1.30
 assign (( resid  69 and name HA   )) (( resid  72 and name HD1  ))  4.65  2.85  0.93
 assign (( resid  69 and name HA   )) (( resid  72 and name HG1  ))  5.44  3.64  1.09
 assign (( resid  60 and name HE1  )) (( resid  69 and name HB2  ))  4.68  2.88  0.94
 assign (( resid  77 and name HG2* )) (( resid  79 and name HG   ))  3.54  1.74  0.71
 assign (( resid  37 and name HB1  )) (( resid  61 and name HG2  ))  5.27  3.47  1.05
 assign (( resid  37 and name HB1  )) (( resid  61 and name HG1  ))  5.27  3.47  1.05
 assign (( resid  62 and name HD22 )) (( resid  64 and name HB1  ))  4.34  2.54  0.87
 assign (( resid  59 and name HA   )) (( resid  60 and name HB2  ))  5.11  3.31  1.02
 assign (( resid  60 and name HB1  )) (( resid  66 and name HG11 ))  5.09  3.29  1.02
 assign (( resid  58 and name HB   )) (( resid  60 and name HE2  ))  5.01  3.21  1.00
 assign (( resid  33 and name HD2* )) (( resid  58 and name HB   ))  5.92  4.12  1.18
 assign (( resid  33 and name HD1* )) (( resid  58 and name HB   ))  6.23  4.43  1.25
 assign (( resid  33 and name HD1* )) (( resid  58 and name HG12 ))  5.64  3.84  1.13
 assign (( resid  58 and name HG11 )) (( resid  59 and name HN   ))  5.20  3.40  1.04
 assign (( resid  41 and name HE1  )) (( resid  58 and name HG11 ))  4.62  2.82  0.92
 assign (( resid  39 and name HB2  )) (( resid  58 and name HG11 ))  5.64  3.84  1.13
 assign (( resid  57 and name HB1  )) (( resid  58 and name HG11 ))  6.16  4.36  1.23
 assign (( resid  57 and name HB1  )) (( resid  57 and name HD2  ))  3.72  1.92  0.74
 assign (( resid  41 and name HB1  )) (( resid  56 and name HA   ))  5.31  3.51  1.06
 assign (( resid  27 and name HB2  )) (( resid  56 and name HB*  ))  6.17  4.37  1.23
 assign (( resid  27 and name HB1  )) (( resid  56 and name HB*  ))  6.50  4.70  1.30
 assign (( resid  13 and name HG2* )) (( resid  91 and name HB2  ))  5.23  3.43  1.05
 assign (( resid  13 and name HG2* )) (( resid  91 and name HB1  ))  5.73  3.93  1.15
 assign (( resid  42 and name HD2  )) (( resid  55 and name HB2  ))  6.50  4.70  1.30
 assign (( resid  42 and name HD2  )) (( resid  55 and name HB1  ))  6.50  4.70  1.30
 assign (( resid  39 and name HA   )) (( resid  39 and name HD2  ))  5.58  3.78  1.12
 assign (( resid  39 and name HA   )) (( resid  40 and name HA   ))  4.71  2.91  0.94
 assign (( resid  97 and name HB1  )) (( resid  97 and name HE2  ))  5.74  3.94  1.15
 assign (( resid  97 and name HB1  )) (( resid  97 and name HE1  ))  5.74  3.94  1.15
 assign (( resid  40 and name HB2  )) (( resid  41 and name HA   ))  4.96  3.16  0.99
 assign (( resid  39 and name HE1  )) (( resid  40 and name HG1  ))  5.27  3.47  1.05
 assign (( resid  39 and name HE1  )) (( resid  40 and name HG2  ))  4.63  2.83  0.93
 assign (( resid  40 and name HG1  )) (( resid  56 and name HA   ))  5.10  3.30  1.02
 assign (( resid  39 and name HA   )) (( resid  40 and name HG2  ))  4.69  2.89  0.94
 assign (( resid  36 and name HB2  )) (( resid  60 and name HA   ))  4.88  3.08  0.98
 assign (( resid  33 and name HA   )) (( resid  34 and name HB2  ))  5.68  3.88  1.14
 assign (( resid  34 and name HB1  )) (( resid  69 and name HE1  ))  4.67  2.87  0.93
 assign (( resid  34 and name HB2  )) (( resid  35 and name HB*  ))  4.35  2.55  0.87
 assign (( resid  34 and name HG2  )) (( resid  35 and name HN   ))  4.97  3.17  0.99
 assign (( resid  34 and name HG1  )) (( resid  69 and name HE1  ))  4.94  3.14  0.99
 assign (( resid  33 and name HB2  )) (( resid  33 and name HD2* ))  3.86  2.06  0.77
 assign (( resid  32 and name HB1  )) (( resid  33 and name HA   ))  5.88  4.08  1.18
 assign (( resid  29 and name HA   )) (( resid  32 and name HG2  ))  5.44  3.64  1.09
 assign (( resid  29 and name HA   )) (( resid  32 and name HG1  ))  4.72  2.92  0.94
 assign (( resid  86 and name HD1  )) (( resid  87 and name HD2  ))  5.42  3.62  1.08
 assign (( resid  86 and name HD1  )) (( resid  87 and name HD1  ))  5.42  3.62  1.08
 assign (( resid  27 and name HA   )) (( resid  31 and name HB1  ))  5.72  3.92  1.14
 assign (( resid  31 and name HB1  )) (( resid  32 and name HD2  ))  5.95  4.15  1.19
 assign (( resid  31 and name HB1  )) (( resid  32 and name HD1  ))  5.00  3.20  1.00
 assign (( resid  30 and name HN   )) (( resid  31 and name HB1  ))  5.44  3.64  1.09
 assign (( resid  17 and name HD1* )) (( resid  55 and name HA   ))  5.40  3.60  1.08
 assign (( resid  17 and name HD2* )) (( resid  55 and name HA   ))  5.74  3.94  1.15
 assign (( resid  17 and name HD2* )) (( resid  56 and name HN   ))  5.02  3.22  1.00
 assign (( resid  21 and name HG   )) (( resid  25 and name HG1  ))  4.98  3.18  1.00
 assign (( resid  26 and name HD2* )) (( resid  41 and name HB2  ))  6.50  4.70  1.30
 assign (( resid  30 and name HB1  )) (( resid  41 and name HE1  ))  6.50  4.70  1.30
 assign (( resid  33 and name HA   )) (( resid  33 and name HD2* ))  6.28  4.48  1.26
 assign (( resid  32 and name HD1  )) (( resid  33 and name HD1* ))  5.04  3.24  1.01
 assign (( resid  33 and name HA   )) (( resid  33 and name HD1* ))  4.33  2.53  0.87
 assign (( resid  36 and name HA   )) (( resid  61 and name HB2  ))  6.21  4.41  1.24
 assign (( resid  39 and name HB1  )) (( resid  57 and name HB2  ))  6.20  4.40  1.24
 assign (( resid  46 and name HA   )) (( resid  46 and name HD1* ))  6.50  4.70  1.30
 assign (( resid  46 and name HA   )) (( resid  46 and name HD2* ))  6.50  4.70  1.30
 assign (( resid  17 and name HB2  )) (( resid  55 and name HA   ))  4.83  3.03  0.97
 assign (( resid  17 and name HB1  )) (( resid  55 and name HA   ))  5.20  3.40  1.04
 assign (( resid  36 and name HA   )) (( resid  61 and name HB1  ))  5.27  3.47  1.05
 assign (( resid  60 and name HB2  )) (( resid  66 and name HG12 ))  6.50  4.70  1.30
 assign (( resid  60 and name HB1  )) (( resid  66 and name HG12 ))  6.50  4.70  1.30
 assign (( resid  68 and name HD2* )) (( resid  69 and name HE1  ))  5.18  3.38  1.04
 assign (( resid  68 and name HD1* )) (( resid  69 and name HE1  ))  4.95  3.15  0.99
 assign (( resid  77 and name HG11 )) (( resid  87 and name HA   ))  6.50  4.70  1.30
 assign (( resid  75 and name HA2  )) (( resid  89 and name HG1* ))  6.19  4.39  1.24
 assign (( resid  75 and name HA1  )) (( resid  89 and name HG2* ))  5.74  3.94  1.15
 assign (( resid  75 and name HA2  )) (( resid  89 and name HG2* ))  6.19  4.39  1.24
 assign (( resid  97 and name HN   )) (( resid  97 and name HG2  ))  5.19  3.39  1.04
 assign (( resid  97 and name HN   )) (( resid  97 and name HG1  ))  5.19  3.39  1.04
 assign (( resid  38 and name HN   )) (( resid  38 and name HD1  ))  5.39  3.59  1.08
 assign (( resid  38 and name HN   )) (( resid  38 and name HD2  ))  5.71  3.91  1.14
 assign (( resid  23 and name HB2  )) (( resid  41 and name HD2  ))  5.31  3.51  1.06
 assign (( resid  41 and name HA   )) (( resid  41 and name HD1  ))  4.07  2.27  0.81
 assign (( resid  27 and name HB2  )) (( resid  41 and name HE2  ))  4.65  2.85  0.93
 assign (( resid  57 and name HA   )) (( resid  57 and name HD1  ))  4.48  2.68  0.90
 assign (( resid  60 and name HE1  )) (( resid  66 and name HA   ))  4.83  3.03  0.97
 assign (( resid  34 and name HD1  )) (( resid  69 and name HD1  ))  4.74  2.94  0.95
 assign (( resid  69 and name HD2  )) (( resid  73 and name HD2  ))  4.92  3.12  0.98
 assign (( resid  68 and name HG   )) (( resid  69 and name HE1  ))  4.82  3.02  0.96
 assign (( resid  20 and name HA2  )) (( resid  86 and name HE1  ))  5.15  3.35  1.03
 assign (( resid  20 and name HA1  )) (( resid  86 and name HE1  ))  4.04  2.24  0.81
 assign (( resid  95 and name HA   )) (( resid  95 and name HD1  ))  4.65  2.85  0.93
 assign (( resid  95 and name HA   )) (( resid  95 and name HD2  ))  5.00  3.20  1.00
 assign (( resid  33 and name HN   )) (( resid  38 and name HD2  ))  6.50  4.70  1.30
 assign (( resid  33 and name HD2* )) (( resid  38 and name HD2  ))  6.50  4.70  1.30
 assign (( resid  33 and name HD1* )) (( resid  38 and name HD2  ))  6.50  4.70  1.30
 assign (( resid  30 and name HB2  )) (( resid  41 and name HD1  ))  4.01  2.21  0.80
 assign (( resid  41 and name HD1  )) (( resid  58 and name HG12 ))  5.54  3.74  1.11
 assign (( resid  30 and name HA   )) (( resid  41 and name HE1  ))  5.24  3.44  1.05
 assign (( resid  60 and name HD1  )) (( resid  65 and name HB2  ))  5.06  3.26  1.01
 assign (( resid  60 and name HD1  )) (( resid  65 and name HB1  ))  5.06  3.26  1.01
 assign (( resid  60 and name HD1  )) (( resid  66 and name HG11 ))  3.99  2.19  0.80
 assign (( resid  60 and name HE1  )) (( resid  62 and name HD21 ))  6.37  4.57  1.27
 assign (( resid  68 and name HD2* )) (( resid  69 and name HD1  ))  4.60  2.80  0.92
 assign (( resid  72 and name HD2  )) (( resid  73 and name HE2  ))  5.16  3.36  1.03
 assign (( resid  72 and name HG2  )) (( resid  73 and name HE2  ))  5.09  3.29  1.02
 assign (( resid  29 and name HG2  )) (( resid  76 and name HE1  ))  4.51  2.71  0.90
 assign (( resid  76 and name HE2  )) (( resid  78 and name HD1  ))  3.93  2.13  0.79
 assign (( resid  57 and name HB2  )) (( resid  57 and name HE1  ))  4.98  3.18  1.00
 assign (( resid  57 and name HA   )) (( resid  57 and name HE1  ))  5.53  3.73  1.11
 assign (( resid  57 and name HA   )) (( resid  57 and name HE2  ))  6.13  4.33  1.23
 assign (( resid  84 and name HB2  )) (( resid  86 and name HE1  ))  4.12  2.32  0.82
 assign (( resid  84 and name HB2  )) (( resid  86 and name HE2  ))  4.67  2.87  0.93
 assign (( resid  84 and name HB1  )) (( resid  86 and name HE1  ))  4.60  2.80  0.92
 assign (( resid  76 and name HB2  )) (( resid  76 and name HD2  ))  3.42  1.62  0.68
 assign (( resid  76 and name HB1  )) (( resid  76 and name HD1  ))  3.73  1.93  0.75
 assign (( resid  73 and name HA   )) (( resid  73 and name HE2  ))  5.24  3.44  1.05
 assign (( resid  73 and name HA   )) (( resid  76 and name HD1  ))  5.95  4.15  1.19
 assign (( resid  76 and name HD2  )) (( resid  78 and name HA   ))  5.80  4.00  1.16
 assign (( resid  14 and name HD1* )) (( resid  73 and name HE1  ))  4.93  3.13  0.99
 assign (( resid  14 and name HD1* )) (( resid  76 and name HD1  ))  5.31  3.51  1.06
 assign (( resid  21 and name HD1* )) (( resid  78 and name HD2  ))  3.61  1.81  0.72
 assign (( resid  38 and name HB1  )) (( resid  38 and name HD2  ))  3.71  1.91  0.74
 assign (( resid  73 and name HA   )) (( resid  73 and name HD2  ))  3.99  2.19  0.80
 assign (( resid  73 and name HD1  )) (( resid  76 and name HD1  ))  3.84  2.04  0.77
 assign (( resid  42 and name HA   )) (( resid  42 and name HD1  ))  4.50  2.70  0.90
 assign (( resid  42 and name HA   )) (( resid  42 and name HD2  ))  4.83  3.03  0.97
 assign (( resid  42 and name HD1  )) (( resid  43 and name HA   ))  4.33  2.53  0.87
 assign (( resid  26 and name HD2* )) (( resid  42 and name HD2  ))  3.41  1.61  0.68
 assign (( resid  17 and name HG   )) (( resid  42 and name HD2  ))  3.99  2.19  0.80
 assign (( resid  33 and name HG   )) (( resid  69 and name HD1  ))  3.83  2.03  0.77
 assign (( resid  60 and name HA   )) (( resid  60 and name HD1  ))  4.00  2.20  0.80
 assign (( resid  60 and name HA   )) (( resid  60 and name HD2  ))  4.47  2.67  0.89
 assign (( resid  59 and name HA   )) (( resid  60 and name HD2  ))  4.78  2.98  0.96
 assign (( resid  33 and name HD2* )) (( resid  60 and name HD1  ))  3.97  2.17  0.79
 assign (( resid  41 and name HE1  )) (( resid  56 and name HB*  ))  3.70  1.90  0.74
 assign (( resid  30 and name HB2  )) (( resid  41 and name HE1  ))  3.89  2.09  0.78
 assign (( resid  41 and name HA   )) (( resid  41 and name HE1  ))  5.66  3.86  1.13
 assign (( resid  41 and name HE1  )) (( resid  58 and name HA   ))  5.93  4.13  1.19
 assign (( resid  40 and name HA   )) (( resid  41 and name HE2  ))  4.66  2.86  0.93
 assign (( resid  69 and name HE2  )) (( resid  73 and name HD2  ))  3.84  2.04  0.77
 assign (( resid  32 and name HG1  )) (( resid  69 and name HD2  ))  4.16  2.36  0.83
 assign (( resid  92 and name HA   )) (( resid  92 and name HD1  ))  4.66  2.86  0.93
 assign (( resid  92 and name HA   )) (( resid  92 and name HD2  ))  5.01  3.21  1.00
 assign (( resid  60 and name HE1  )) (( resid  69 and name HB1  ))  5.17  3.37  1.03
 assign (( resid  60 and name HE2  )) (( resid  69 and name HB1  ))  5.78  3.98  1.16
 assign (( resid  32 and name HB2  )) (( resid  69 and name HE2  ))  4.42  2.62  0.88
 assign (( resid  34 and name HD2  )) (( resid  69 and name HE1  ))  4.50  2.70  0.90
 assign (( resid  34 and name HD1  )) (( resid  69 and name HE1  ))  4.50  2.70  0.90
 assign (( resid  60 and name HB2  )) (( resid  60 and name HE2  ))  5.31  3.51  1.06
 assign (( resid  69 and name HE2  )) (( resid  72 and name HD2  ))  6.10  4.30  1.22
 assign (( resid  39 and name HA   )) (( resid  39 and name HD1  ))  5.13  3.33  1.03
 assign (( resid  30 and name HD2* )) (( resid  76 and name HE1  ))  4.43  2.63  0.89
 assign (( resid  41 and name HD1  )) (( resid  56 and name HA   ))  4.47  2.67  0.89
 assign (( resid  30 and name HG   )) (( resid  41 and name HE1  ))  4.42  2.62  0.88
 assign (( resid  39 and name HE1  )) (( resid  40 and name HN   ))  4.07  2.27  0.81
 assign (( resid  17 and name HD1* )) (( resid  42 and name HD2  ))  4.41  2.61  0.88
 assign (( resid  56 and name HN   )) (( resid  57 and name HD1  ))  4.54  2.74  0.91
 assign (( resid  76 and name HE2  )) (( resid  78 and name HA   ))  4.19  2.39  0.84
 assign (( resid  30 and name HD2* )) (( resid  73 and name HD1  ))  5.51  3.71  1.10
 assign (( resid  41 and name HN   )) (( resid  41 and name HD2  ))  3.91  2.11  0.78
 assign (( resid  41 and name HB2  )) (( resid  41 and name HE2  ))  4.77  2.97  0.95
 assign (( resid  38 and name HB2  )) (( resid  41 and name HE1  ))  4.99  3.19  1.00
 assign (( resid  41 and name HB1  )) (( resid  41 and name HE1  ))  5.39  3.59  1.08
 assign (( resid  30 and name HD1* )) (( resid  42 and name HD2  ))  4.50  2.70  0.90
 assign (( resid  41 and name HA   )) (( resid  42 and name HD2  ))  4.04  2.24  0.81
 assign (( resid  42 and name HD2  )) (( resid  56 and name HA   ))  4.38  2.58  0.88
 assign (( resid  56 and name HN   )) (( resid  57 and name HE1  ))  5.44  3.64  1.09
 assign (( resid  13 and name HB   )) (( resid  57 and name HE2  ))  4.19  2.39  0.84
 assign (( resid  13 and name HG2* )) (( resid  57 and name HE2  ))  3.85  2.05  0.77
 assign (( resid  13 and name HG1* )) (( resid  57 and name HE2  ))  3.94  2.14  0.79
 assign (( resid  57 and name HB1  )) (( resid  57 and name HE2  ))  4.67  2.87  0.93
 assign (( resid  57 and name HE2  )) (( resid  93 and name HB*  ))  4.70  2.90  0.94
 assign (( resid  34 and name HD2  )) (( resid  69 and name HD1  ))  4.74  2.94  0.95
 assign (( resid  73 and name HD1  )) (( resid  76 and name HB1  ))  3.91  2.11  0.78
 assign (( resid  29 and name HB2  )) (( resid  76 and name HE1  ))  4.05  2.25  0.81
 assign (( resid  76 and name HD2  )) (( resid  77 and name HN   ))  3.73  1.93  0.75
 assign (( resid  78 and name HA   )) (( resid  78 and name HD1  ))  3.73  1.93  0.75
 assign (( resid  78 and name HB2  )) (( resid  86 and name HD2  ))  5.32  3.52  1.06
 assign (( resid  80 and name HB2  )) (( resid  86 and name HE2  ))  4.11  2.31  0.82
 assign (( resid  80 and name HB1  )) (( resid  86 and name HE2  ))  4.11  2.31  0.82
 assign (( resid  84 and name HB2  )) (( resid  86 and name HD1  ))  5.37  3.57  1.07
 assign (( resid  84 and name HB2  )) (( resid  86 and name HD2  ))  6.06  4.26  1.21
 assign (( resid  84 and name HB1  )) (( resid  86 and name HD1  ))  6.03  4.23  1.21
 assign (( resid  14 and name HG2* )) (( resid  41 and name HE1  ))  4.47  2.67  0.89
 assign (( resid  26 and name HD1* )) (( resid  41 and name HE1  ))  5.03  3.23  1.01
 assign (( resid  13 and name HB   )) (( resid  57 and name HD2  ))  4.31  2.51  0.86
 assign (( resid  29 and name HB2  )) (( resid  73 and name HE1  ))  5.15  3.35  1.03
 assign (( resid  29 and name HB1  )) (( resid  73 and name HE1  ))  5.03  3.23  1.01
 assign (( resid  76 and name HE1  )) (( resid  88 and name HB*  ))  5.05  3.25  1.01
 assign (( resid  56 and name HB*  )) (( resid  57 and name HD1  ))  4.68  2.88  0.94
 assign (( resid  57 and name HD2  )) (( resid  93 and name HB*  ))  5.16  3.36  1.03
 assign (( resid  41 and name HE1  )) (( resid  58 and name HD1* ))  4.18  2.38  0.84
 assign (( resid  30 and name HD1* )) (( resid  41 and name HD1  ))  4.42  2.62  0.88
 assign (( resid  14 and name HD1* )) (( resid  76 and name HE1  ))  4.42  2.62  0.88
 assign (( resid  73 and name HD1  )) (( resid  76 and name HE1  ))  4.53  2.73  0.91
 assign (( resid  31 and name HB2  )) (( resid  38 and name HD2  ))  4.60  2.80  0.92
 assign (( resid  31 and name HB1  )) (( resid  38 and name HD2  ))  4.78  2.98  0.96
 assign (( resid  39 and name HD2  )) (( resid  59 and name HB2  ))  5.01  3.21  1.00
 assign (( resid  39 and name HD2  )) (( resid  59 and name HB1  ))  5.01  3.21  1.00
 assign (( resid  65 and name HA   )) (( resid  69 and name HD1  ))  5.28  3.48  1.06
 assign (( resid  69 and name HD2  )) (( resid  73 and name HB1  ))  6.40  4.60  1.28
 assign (( resid  32 and name HB2  )) (( resid  69 and name HD2  ))  4.63  2.83  0.93
 assign (( resid  69 and name HD2  )) (( resid  73 and name HE2  ))  4.07  2.27  0.81
 assign (( resid  12 and name HG1* )) (( resid  60 and name HE2  ))  4.46  2.66  0.89
 assign (( resid  60 and name HE1  )) (( resid  66 and name HG12 ))  4.76  2.96  0.95
 assign (( resid  60 and name HE2  )) (( resid  66 and name HG12 ))  5.46  3.66  1.09
 assign (( resid  73 and name HB1  )) (( resid  76 and name HD1  ))  4.47  2.67  0.89
 assign (( resid  76 and name HD1  )) (( resid  88 and name HB*  ))  4.13  2.33  0.83
 assign (( resid  10 and name HB*  )) (( resid  66 and name HD1* ))  3.98  2.18  0.80
 assign (( resid  12 and name HB   )) (( resid  90 and name HG*  ))  4.44  2.64  0.89
 assign (( resid  12 and name HG*  )) (( resid  13 and name HN   ))  3.32  1.52  0.66
 assign (( resid  12 and name HG*  )) (( resid  13 and name HA   ))  3.89  2.09  0.78
 assign (( resid  12 and name HG*  )) (( resid  13 and name HG2* ))  4.73  2.93  0.95
 assign (( resid  12 and name HG*  )) (( resid  58 and name HB   ))  4.24  2.44  0.85
 assign (( resid  12 and name HG*  )) (( resid  60 and name HN   ))  4.78  2.98  0.96
 assign (( resid  12 and name HG*  )) (( resid  60 and name HB2  ))  4.16  2.36  0.83
 assign (( resid  12 and name HG*  )) (( resid  60 and name HE2  ))  3.43  1.63  0.69
 assign (( resid  12 and name HG*  )) (( resid  60 and name HD2  ))  3.11  1.31  0.62
 assign (( resid  12 and name HG*  )) (( resid  63 and name HA   ))  5.63  3.83  1.13
 assign (( resid  12 and name HG*  )) (( resid  66 and name HA   ))  4.19  2.39  0.84
 assign (( resid  12 and name HG*  )) (( resid  66 and name HG2* ))  3.00  1.20  0.60
 assign (( resid  12 and name HG*  )) (( resid  66 and name HG12 ))  3.45  1.65  0.69
 assign (( resid  12 and name HG*  )) (( resid  66 and name HG11 ))  5.53  3.73  1.11
 assign (( resid  12 and name HG*  )) (( resid  66 and name HD1* ))  2.92  1.12  0.58
 assign (( resid  12 and name HG*  )) (( resid  70 and name HB*  ))  4.05  2.25  0.81
 assign (( resid  12 and name HG*  )) (( resid  90 and name HA   ))  4.04  2.24  0.81
 assign (( resid  12 and name HG*  )) (( resid  90 and name HB   ))  4.31  2.51  0.86
 assign (( resid  12 and name HG*  )) (( resid  91 and name HN   ))  3.99  2.19  0.80
 assign (( resid  12 and name HG*  )) (( resid  92 and name HA   ))  3.70  1.90  0.74
 assign (( resid  12 and name HG*  )) (( resid  92 and name HB*  ))  3.88  2.08  0.78
 assign (( resid  12 and name HG*  )) (( resid  93 and name HN   ))  3.60  1.80  0.72
 assign (( resid  12 and name HG*  )) (( resid  93 and name HB*  ))  4.72  2.92  0.94
 assign (( resid  13 and name HB   )) (( resid  91 and name HG*  ))  5.11  3.31  1.02
 assign (( resid  13 and name HG1* )) (( resid  91 and name HG*  ))  4.18  2.38  0.84
 assign (( resid  13 and name HG2* )) (( resid  91 and name HG*  ))  4.40  2.60  0.88
 assign (( resid  15 and name HN   )) (( resid  91 and name HG*  ))  4.49  2.69  0.90
 assign (( resid  16 and name HA   )) (( resid  16 and name HD*  ))  4.75  2.95  0.95
 assign (( resid  16 and name HB*  )) (( resid  75 and name HA2  ))  6.27  4.47  1.25
 assign (( resid  16 and name HB*  )) (( resid  87 and name HD*  ))  5.08  3.28  1.02
 assign (( resid  16 and name HB*  )) (( resid  89 and name HN   ))  4.41  2.61  0.88
 assign (( resid  16 and name HB*  )) (( resid  89 and name HB   ))  4.81  3.01  0.96
 assign (( resid  16 and name HB*  )) (( resid  89 and name HG*  ))  4.55  2.75  0.91
 assign (( resid  16 and name HG*  )) (( resid  89 and name HB   ))  5.61  3.81  1.12
 assign (( resid  16 and name HD*  )) (( resid  89 and name HG*  ))  3.37  1.57  0.67
 assign (( resid  20 and name HA2  )) (( resid  84 and name HD*  ))  6.40  4.60  1.28
 assign (( resid  20 and name HA1  )) (( resid  84 and name HD*  ))  6.40  4.60  1.28
 assign (( resid  21 and name HA   )) (( resid  46 and name HD*  ))  3.84  2.04  0.77
 assign (( resid  21 and name HD1* )) (( resid  28 and name HG*  ))  4.31  2.51  0.86
 assign (( resid  22 and name HB   )) (( resid  23 and name HG*  ))  5.12  3.32  1.02
 assign (( resid  23 and name HN   )) (( resid  23 and name HG*  ))  4.07  2.27  0.81
 assign (( resid  23 and name HN   )) (( resid  23 and name HD*  ))  4.54  2.74  0.91
 assign (( resid  23 and name HN   )) (( resid  23 and name HE*  ))  4.88  3.08  0.98
 assign (( resid  23 and name HA   )) (( resid  23 and name HG*  ))  3.57  1.77  0.71
 assign (( resid  23 and name HA   )) (( resid  23 and name HE*  ))  5.53  3.73  1.11
 assign (( resid  23 and name HB2  )) (( resid  23 and name HE*  ))  3.84  2.04  0.77
 assign (( resid  23 and name HB1  )) (( resid  23 and name HE*  ))  4.24  2.44  0.85
 assign (( resid  23 and name HG*  )) (( resid  23 and name HE*  ))  3.03  1.23  0.61
 assign (( resid  23 and name HG*  )) (( resid  24 and name HN   ))  3.88  2.08  0.78
 assign (( resid  23 and name HG*  )) (( resid  24 and name HA   ))  4.64  2.84  0.93
 assign (( resid  23 and name HG*  )) (( resid  24 and name HG2  ))  4.72  2.92  0.94
 assign (( resid  23 and name HG*  )) (( resid  24 and name HG1  ))  4.62  2.82  0.92
 assign (( resid  23 and name HG*  )) (( resid  41 and name HD2  ))  4.60  2.80  0.92
 assign (( resid  23 and name HG*  )) (( resid  43 and name HA   ))  3.97  2.17  0.79
 assign (( resid  23 and name HG*  )) (( resid  43 and name HB*  ))  6.27  4.47  1.25
 assign (( resid  23 and name HD*  )) (( resid  24 and name HN   ))  4.42  2.62  0.88
 assign (( resid  23 and name HD*  )) (( resid  24 and name HG1  ))  5.06  3.26  1.01
 assign (( resid  23 and name HD*  )) (( resid  41 and name HN   ))  4.93  3.13  0.99
 assign (( resid  23 and name HD*  )) (( resid  41 and name HB2  ))  4.02  2.22  0.80
 assign (( resid  23 and name HD*  )) (( resid  41 and name HB1  ))  5.63  3.83  1.13
 assign (( resid  23 and name HD*  )) (( resid  41 and name HD2  ))  5.21  3.41  1.04
 assign (( resid  23 and name HE*  )) (( resid  24 and name HN   ))  4.90  3.10  0.98
 assign (( resid  23 and name HE*  )) (( resid  26 and name HD2* ))  6.27  4.47  1.25
 assign (( resid  23 and name HE*  )) (( resid  40 and name HA   ))  4.71  2.91  0.94
 assign (( resid  23 and name HE*  )) (( resid  41 and name HN   ))  3.99  2.19  0.80
 assign (( resid  23 and name HE*  )) (( resid  41 and name HB2  ))  3.90  2.10  0.78
 assign (( resid  23 and name HE*  )) (( resid  41 and name HB1  ))  6.04  4.24  1.21
 assign (( resid  25 and name HA   )) (( resid  28 and name HG*  ))  4.57  2.77  0.91
 assign (( resid  25 and name HB1  )) (( resid  28 and name HG*  ))  4.58  2.78  0.92
 assign (( resid  26 and name HA   )) (( resid  28 and name HG*  ))  4.88  3.08  0.98
 assign (( resid  28 and name HN   )) (( resid  28 and name HG*  ))  3.11  1.31  0.62
 assign (( resid  28 and name HA   )) (( resid  28 and name HG*  ))  3.73  1.93  0.75
 assign (( resid  28 and name HA   )) (( resid  31 and name HD*  ))  4.15  2.35  0.83
 assign (( resid  28 and name HB2  )) (( resid  28 and name HG*  ))  2.52  0.72  0.50
 assign (( resid  28 and name HB1  )) (( resid  28 and name HG*  ))  2.60  0.80  0.52
 assign (( resid  28 and name HG*  )) (( resid  29 and name HN   ))  3.44  1.64  0.69
 assign (( resid  28 and name HG*  )) (( resid  29 and name HA   ))  4.04  2.24  0.81
 assign (( resid  28 and name HG*  )) (( resid  29 and name HG1  ))  4.28  2.48  0.86
 assign (( resid  28 and name HG*  )) (( resid  29 and name HE21 ))  3.98  2.18  0.80
 assign (( resid  28 and name HG*  )) (( resid  29 and name HE22 ))  3.89  2.09  0.78
 assign (( resid  31 and name HN   )) (( resid  31 and name HD*  ))  4.88  3.08  0.98
 assign (( resid  31 and name HB2  )) (( resid  31 and name HD*  ))  3.27  1.47  0.65
 assign (( resid  31 and name HD*  )) (( resid  38 and name HB2  ))  5.10  3.30  1.02
 assign (( resid  33 and name HA   )) (( resid  34 and name HD*  ))  3.50  1.70  0.70
 assign (( resid  33 and name HB2  )) (( resid  34 and name HD*  ))  4.42  2.62  0.88
 assign (( resid  33 and name HB2  )) (( resid  36 and name HB*  ))  4.51  2.71  0.90
 assign (( resid  33 and name HB1  )) (( resid  36 and name HB*  ))  5.19  3.39  1.04
 assign (( resid  33 and name HG   )) (( resid  34 and name HD*  ))  4.62  2.82  0.92
 assign (( resid  33 and name HG   )) (( resid  36 and name HB*  ))  5.19  3.39  1.04
 assign (( resid  33 and name HD2* )) (( resid  34 and name HD*  ))  3.87  2.07  0.77
 assign (( resid  33 and name HD2* )) (( resid  65 and name HB*  ))  4.40  2.60  0.88
 assign (( resid  34 and name HG2  )) (( resid  65 and name HB*  ))  6.10  4.30  1.22
 assign (( resid  34 and name HG1  )) (( resid  65 and name HB*  ))  6.27  4.47  1.25
 assign (( resid  34 and name HD*  )) (( resid  69 and name HD1  ))  4.11  2.31  0.82
 assign (( resid  36 and name HA   )) (( resid  61 and name HG*  ))  4.07  2.27  0.81
 assign (( resid  36 and name HA   )) (( resid  61 and name HD*  ))  4.18  2.38  0.84
 assign (( resid  36 and name HB*  )) (( resid  37 and name HN   ))  3.38  1.58  0.68
 assign (( resid  36 and name HB*  )) (( resid  37 and name HA   ))  4.92  3.12  0.98
 assign (( resid  36 and name HB*  )) (( resid  58 and name HG2* ))  4.82  3.02  0.96
 assign (( resid  36 and name HB*  )) (( resid  60 and name HA   ))  4.25  2.45  0.85
 assign (( resid  36 and name HB*  )) (( resid  60 and name HD1  ))  5.34  3.54  1.07
 assign (( resid  36 and name HB*  )) (( resid  61 and name HB2  ))  6.27  4.47  1.25
 assign (( resid  37 and name HN   )) (( resid  37 and name HB*  ))  3.64  1.84  0.73
 assign (( resid  37 and name HN   )) (( resid  59 and name HD2* ))  4.19  2.39  0.84
 assign (( resid  37 and name HN   )) (( resid  61 and name HG*  ))  4.21  2.41  0.84
 assign (( resid  37 and name HN   )) (( resid  61 and name HD*  ))  4.24  2.44  0.85
 assign (( resid  37 and name HB*  )) (( resid  59 and name HN   ))  4.56  2.76  0.91
 assign (( resid  37 and name HB*  )) (( resid  59 and name HB*  ))  4.36  2.56  0.87
 assign (( resid  37 and name HB*  )) (( resid  59 and name HD2* ))  3.16  1.36  0.63
 assign (( resid  37 and name HB*  )) (( resid  61 and name HG*  ))  3.96  2.16  0.79
 assign (( resid  37 and name HB*  )) (( resid  61 and name HD*  ))  3.47  1.67  0.69
 assign (( resid  39 and name HE2  )) (( resid  59 and name HB*  ))  4.50  2.70  0.90
 assign (( resid  46 and name HB2  )) (( resid  84 and name HD*  ))  3.26  1.46  0.65
 assign (( resid  46 and name HD*  )) (( resid  82 and name HB2  ))  3.26  1.46  0.65
 assign (( resid  46 and name HD*  )) (( resid  82 and name HG2  ))  4.27  2.47  0.85
 assign (( resid  46 and name HD*  )) (( resid  82 and name HG1  ))  3.19  1.39  0.64
 assign (( resid  46 and name HD*  )) (( resid  82 and name HE*  ))  3.86  2.06  0.77
 assign (( resid  53 and name HB*  )) (( resid  54 and name HN   ))  3.48  1.68  0.70
 assign (( resid  53 and name HB*  )) (( resid  54 and name HA   ))  4.35  2.55  0.87
 assign (( resid  55 and name HN   )) (( resid  55 and name HD*  ))  5.71  3.91  1.14
 assign (( resid  55 and name HB*  )) (( resid  56 and name HN   ))  4.26  2.46  0.85
 assign (( resid  55 and name HB*  )) (( resid  57 and name HD1  ))  4.88  3.08  0.98
 assign (( resid  55 and name HD*  )) (( resid  56 and name HN   ))  4.61  2.81  0.92
 assign (( resid  59 and name HA   )) (( resid  59 and name HD2* ))  4.58  2.78  0.92
 assign (( resid  59 and name HB*  )) (( resid  59 and name HD2* ))  2.96  1.16  0.59
 assign (( resid  59 and name HB*  )) (( resid  60 and name HN   ))  4.33  2.53  0.87
 assign (( resid  60 and name HD1  )) (( resid  65 and name HB*  ))  4.18  2.38  0.84
 assign (( resid  60 and name HE1  )) (( resid  65 and name HB*  ))  4.71  2.91  0.94
 assign (( resid  60 and name HE2  )) (( resid  90 and name HG*  ))  4.08  2.28  0.82
 assign (( resid  61 and name HN   )) (( resid  61 and name HG*  ))  4.22  2.42  0.84
 assign (( resid  61 and name HA   )) (( resid  61 and name HG*  ))  3.65  1.85  0.73
 assign (( resid  61 and name HA   )) (( resid  61 and name HD*  ))  3.41  1.61  0.68
 assign (( resid  61 and name HB2  )) (( resid  61 and name HD*  ))  3.65  1.85  0.73
 assign (( resid  61 and name HG*  )) (( resid  62 and name HN   ))  4.99  3.19  1.00
 assign (( resid  62 and name HN   )) (( resid  65 and name HB*  ))  4.61  2.81  0.92
 assign (( resid  62 and name HB2  )) (( resid  65 and name HB*  ))  4.30  2.50  0.86
 assign (( resid  62 and name HB1  )) (( resid  65 and name HB*  ))  4.38  2.58  0.88
 assign (( resid  62 and name HD21 )) (( resid  64 and name HB*  ))  3.75  1.95  0.75
 assign (( resid  62 and name HD22 )) (( resid  64 and name HB*  ))  3.50  1.70  0.70
 assign (( resid  62 and name HD22 )) (( resid  65 and name HB*  ))  5.02  3.22  1.00
 assign (( resid  63 and name HB*  )) (( resid  65 and name HN   ))  5.54  3.74  1.11
 assign (( resid  63 and name HG1  )) (( resid  64 and name HB*  ))  5.61  3.81  1.12
 assign (( resid  63 and name HD2  )) (( resid  64 and name HB*  ))  4.05  2.25  0.81
 assign (( resid  64 and name HN   )) (( resid  64 and name HB*  ))  3.00  1.20  0.60
 assign (( resid  64 and name HB*  )) (( resid  66 and name HN   ))  6.18  4.38  1.24
 assign (( resid  64 and name HB*  )) (( resid  67 and name HD1* ))  4.53  2.73  0.91
 assign (( resid  64 and name HB*  )) (( resid  67 and name HD2* ))  5.35  3.55  1.07
 assign (( resid  65 and name HN   )) (( resid  65 and name HB*  ))  3.20  1.40  0.64
 assign (( resid  65 and name HB*  )) (( resid  66 and name HN   ))  3.90  2.10  0.78
 assign (( resid  65 and name HB*  )) (( resid  68 and name HD2* ))  4.43  2.63  0.89
 assign (( resid  65 and name HB*  )) (( resid  69 and name HN   ))  6.11  4.31  1.22
 assign (( resid  65 and name HB*  )) (( resid  69 and name HD1  ))  5.84  4.04  1.17
 assign (( resid  66 and name HG2* )) (( resid  70 and name HD*  ))  4.91  3.11  0.98
 assign (( resid  66 and name HG2* )) (( resid  92 and name HB*  ))  4.42  2.62  0.88
 assign (( resid  67 and name HA   )) (( resid  70 and name HB*  ))  3.82  2.02  0.76
 assign (( resid  69 and name HB2  )) (( resid  70 and name HB*  ))  6.27  4.47  1.25
 assign (( resid  69 and name HB1  )) (( resid  70 and name HB*  ))  5.27  3.47  1.05
 assign (( resid  70 and name HA   )) (( resid  70 and name HD*  ))  4.45  2.65  0.89
 assign (( resid  70 and name HA   )) (( resid  90 and name HG*  ))  3.86  2.06  0.77
 assign (( resid  70 and name HB*  )) (( resid  90 and name HG*  ))  4.73  2.93  0.95
 assign (( resid  70 and name HG*  )) (( resid  71 and name HN   ))  4.30  2.50  0.86
 assign (( resid  70 and name HG*  )) (( resid  90 and name HG*  ))  5.70  3.90  1.14
 assign (( resid  70 and name HD*  )) (( resid  71 and name HA   ))  4.29  2.49  0.86
 assign (( resid  70 and name HD*  )) (( resid  74 and name HN   ))  5.04  3.24  1.01
 assign (( resid  70 and name HD*  )) (( resid  74 and name HB*  ))  4.62  2.82  0.92
 assign (( resid  71 and name HA   )) (( resid  74 and name HB*  ))  3.64  1.84  0.73
 assign (( resid  73 and name HN   )) (( resid  90 and name HG*  ))  4.48  2.68  0.90
 assign (( resid  73 and name HB2  )) (( resid  90 and name HG*  ))  3.32  1.52  0.66
 assign (( resid  73 and name HB1  )) (( resid  90 and name HG*  ))  3.45  1.65  0.69
 assign (( resid  73 and name HD1  )) (( resid  90 and name HG*  ))  4.14  2.34  0.83
 assign (( resid  74 and name HN   )) (( resid  74 and name HB*  ))  3.37  1.57  0.67
 assign (( resid  74 and name HN   )) (( resid  90 and name HG*  ))  3.59  1.79  0.72
 assign (( resid  74 and name HA   )) (( resid  90 and name HG*  ))  3.66  1.86  0.73
 assign (( resid  75 and name HN   )) (( resid  90 and name HG*  ))  3.71  1.91  0.74
 assign (( resid  75 and name HA2  )) (( resid  89 and name HG*  ))  4.67  2.87  0.93
 assign (( resid  75 and name HA2  )) (( resid  90 and name HG*  ))  6.40  4.60  1.28
 assign (( resid  75 and name HA1  )) (( resid  89 and name HG*  ))  4.78  2.98  0.96
 assign (( resid  75 and name HA1  )) (( resid  90 and name HG*  ))  6.40  4.60  1.28
 assign (( resid  76 and name HN   )) (( resid  89 and name HG*  ))  5.69  3.89  1.14
 assign (( resid  76 and name HN   )) (( resid  90 and name HG*  ))  5.92  4.12  1.18
 assign (( resid  76 and name HD1  )) (( resid  78 and name HB*  ))  6.27  4.47  1.25
 assign (( resid  76 and name HE2  )) (( resid  78 and name HB*  ))  4.50  2.70  0.90
 assign (( resid  76 and name HD2  )) (( resid  78 and name HB*  ))  4.08  2.28  0.82
 assign (( resid  77 and name HB   )) (( resid  85 and name HG*  ))  6.13  4.33  1.23
 assign (( resid  77 and name HG2* )) (( resid  85 and name HG*  ))  3.33  1.53  0.67
 assign (( resid  77 and name HG2* )) (( resid  87 and name HD*  ))  4.50  2.70  0.90
 assign (( resid  77 and name HG12 )) (( resid  87 and name HD*  ))  6.26  4.46  1.25
 assign (( resid  77 and name HD1* )) (( resid  85 and name HG*  ))  3.99  2.19  0.80
 assign (( resid  78 and name HN   )) (( resid  78 and name HB*  ))  3.55  1.75  0.71
 assign (( resid  78 and name HB*  )) (( resid  78 and name HD1  ))  3.27  1.47  0.65
 assign (( resid  78 and name HB*  )) (( resid  78 and name HD2  ))  3.27  1.47  0.65
 assign (( resid  78 and name HB*  )) (( resid  79 and name HN   ))  3.94  2.14  0.79
 assign (( resid  78 and name HB*  )) (( resid  86 and name HN   ))  4.39  2.59  0.88
 assign (( resid  78 and name HB*  )) (( resid  86 and name HB2  ))  4.26  2.46  0.85
 assign (( resid  78 and name HB*  )) (( resid  86 and name HD2  ))  4.47  2.67  0.89
 assign (( resid  79 and name HG   )) (( resid  85 and name HG*  ))  3.75  1.95  0.75
 assign (( resid  79 and name HD1* )) (( resid  85 and name HG*  ))  3.99  2.19  0.80
 assign (( resid  80 and name HB*  )) (( resid  82 and name HN   ))  3.96  2.16  0.79
 assign (( resid  80 and name HB*  )) (( resid  84 and name HB2  ))  5.17  3.37  1.03
 assign (( resid  80 and name HB*  )) (( resid  84 and name HG   ))  5.47  3.67  1.09
 assign (( resid  80 and name HB*  )) (( resid  86 and name HE2  ))  3.39  1.59  0.68
 assign (( resid  81 and name HB*  )) (( resid  82 and name HN   ))  3.94  2.14  0.79
 assign (( resid  81 and name HB*  )) (( resid  82 and name HA   ))  4.30  2.50  0.86
 assign (( resid  81 and name HB*  )) (( resid  82 and name HG2  ))  4.55  2.75  0.91
 assign (( resid  82 and name HN   )) (( resid  82 and name HD*  ))  4.60  2.80  0.92
 assign (( resid  82 and name HA   )) (( resid  82 and name HD*  ))  3.13  1.33  0.63
 assign (( resid  82 and name HB2  )) (( resid  84 and name HD*  ))  4.08  2.28  0.82
 assign (( resid  82 and name HB1  )) (( resid  82 and name HD*  ))  2.61  0.81  0.52
 assign (( resid  82 and name HB1  )) (( resid  82 and name HE*  ))  4.74  2.94  0.95
 assign (( resid  82 and name HB1  )) (( resid  84 and name HD*  ))  4.57  2.77  0.91
 assign (( resid  82 and name HG1  )) (( resid  82 and name HE*  ))  3.08  1.28  0.62
 assign (( resid  83 and name HN   )) (( resid  84 and name HD*  ))  4.35  2.55  0.87
 assign (( resid  83 and name HA1  )) (( resid  84 and name HD*  ))  4.69  2.89  0.94
 assign (( resid  84 and name HN   )) (( resid  84 and name HD*  ))  3.51  1.71  0.70
 assign (( resid  84 and name HA   )) (( resid  84 and name HD*  ))  2.79  0.99  0.56
 assign (( resid  84 and name HA   )) (( resid  85 and name HG*  ))  4.80  3.00  0.96
 assign (( resid  84 and name HD*  )) (( resid  85 and name HN   ))  4.20  2.40  0.84
 assign (( resid  84 and name HD*  )) (( resid  86 and name HE1  ))  3.97  2.17  0.79
 assign (( resid  85 and name HN   )) (( resid  85 and name HG*  ))  3.17  1.37  0.63
 assign (( resid  85 and name HA   )) (( resid  85 and name HG*  ))  3.61  1.81  0.72
 assign (( resid  85 and name HB2  )) (( resid  87 and name HD*  ))  5.27  3.47  1.05
 assign (( resid  85 and name HB1  )) (( resid  87 and name HD*  ))  5.49  3.69  1.10
 assign (( resid  85 and name HG*  )) (( resid  86 and name HN   ))  4.57  2.77  0.91
 assign (( resid  86 and name HN   )) (( resid  87 and name HD*  ))  4.12  2.32  0.82
 assign (( resid  86 and name HD1  )) (( resid  87 and name HD*  ))  4.56  2.76  0.91
 assign (( resid  88 and name HA   )) (( resid  89 and name HG*  ))  4.21  2.41  0.84
 assign (( resid  89 and name HN   )) (( resid  89 and name HG*  ))  3.19  1.39  0.64
 assign (( resid  89 and name HA   )) (( resid  89 and name HG*  ))  2.77  0.97  0.55
 assign (( resid  89 and name HG*  )) (( resid  90 and name HN   ))  3.14  1.34  0.63
 assign (( resid  89 and name HG*  )) (( resid  90 and name HA   ))  4.38  2.58  0.88
 assign (( resid  89 and name HG*  )) (( resid  91 and name HB1  ))  3.71  1.91  0.74
 assign (( resid  90 and name HN   )) (( resid  90 and name HG*  ))  3.19  1.39  0.64
 assign (( resid  90 and name HG*  )) (( resid  91 and name HN   ))  3.49  1.69  0.70
 assign (( resid  90 and name HG*  )) (( resid  92 and name HA   ))  4.97  3.17  0.99
 assign (( resid  91 and name HN   )) (( resid  91 and name HG*  ))  3.83  2.03  0.77
 assign (( resid  91 and name HA   )) (( resid  91 and name HG*  ))  3.45  1.65  0.69
 assign (( resid  91 and name HA   )) (( resid  92 and name HB*  ))  4.57  2.77  0.91
 assign (( resid  91 and name HG*  )) (( resid  92 and name HN   ))  3.90  2.10  0.78
 assign (( resid  92 and name HB*  )) (( resid  93 and name HN   ))  3.88  2.08  0.78
 assign (( resid  93 and name HA   )) (( resid  94 and name HD*  ))  3.29  1.49  0.66
 assign (( resid  93 and name HB*  )) (( resid  94 and name HD*  ))  4.04  2.24  0.81
 assign (( resid  94 and name HB*  )) (( resid  95 and name HN   ))  4.00  2.20  0.80
 assign (( resid  96 and name HA   )) (( resid  96 and name HG*  ))  3.40  1.60  0.68
 assign (( resid  96 and name HA   )) (( resid  97 and name HB*  ))  4.56  2.76  0.91
 assign (( resid  96 and name HB*  )) (( resid  96 and name HG*  ))  2.36  0.56  0.47
 assign (( resid  96 and name HB*  )) (( resid  96 and name HE*  ))  3.17  1.37  0.63
 assign (( resid  96 and name HB*  )) (( resid  97 and name HN   ))  3.60  1.80  0.72
 assign (( resid  96 and name HB*  )) (( resid  97 and name HB*  ))  4.75  2.95  0.95
 assign (( resid  96 and name HG*  )) (( resid  97 and name HN   ))  3.99  2.19  0.80
 assign (( resid  96 and name HE*  )) (( resid  97 and name HN   ))  4.46  2.66  0.89
 assign (( resid  96 and name HE*  )) (( resid  97 and name HA   ))  4.77  2.97  0.95
 assign (( resid  96 and name HE*  )) (( resid  97 and name HB*  ))  4.17  2.37  0.83
 assign (( resid  97 and name HN   )) (( resid  97 and name HG*  ))  4.47  2.67  0.89
 assign (( resid  97 and name HA   )) (( resid  97 and name HG*  ))  3.33  1.53  0.67
 assign (( resid  97 and name HA   )) (( resid  97 and name HD*  ))  3.29  1.49  0.66
 assign (( resid  97 and name HA   )) (( resid  97 and name HE*  ))  5.23  3.43  1.05
 assign (( resid  97 and name HB*  )) (( resid  97 and name HE*  ))  4.35  2.55  0.87
 assign (( resid  97 and name HG*  )) (( resid  97 and name HE*  ))  3.33  1.53  0.67

dihedral
   assign (resid   9 and name C   )   (resid  10 and name N   )
          (resid  10 and name CA  )   (resid  10 and name C   )   1.0    -92.30    36.90   2 
   assign (resid  10 and name N   )   (resid  10 and name CA  )
          (resid  10 and name C   )   (resid  11 and name N   )   1.0    134.05    50.25   2 
   assign (resid  10 and name C   )   (resid  11 and name N   )
          (resid  11 and name CA  )   (resid  11 and name C   )   1.0    -96.05    37.15   2 
   assign (resid  11 and name N   )   (resid  11 and name CA  )
          (resid  11 and name C   )   (resid  12 and name N   )   1.0    130.50    47.20   2 
   assign (resid  11 and name C   )   (resid  12 and name N   )
          (resid  12 and name CA  )   (resid  12 and name C   )   1.0   -118.70    20.00   2 
   assign (resid  12 and name N   )   (resid  12 and name CA  )
          (resid  12 and name C   )   (resid  13 and name N   )   1.0    128.20    20.00   2 
   assign (resid  13 and name C   )   (resid  14 and name N   )
          (resid  14 and name CA  )   (resid  14 and name C   )   1.0   -122.30    20.00   2 
   assign (resid  14 and name N   )   (resid  14 and name CA  )
          (resid  14 and name C   )   (resid  15 and name N   )   1.0    126.20    20.00   2 
   assign (resid  14 and name C   )   (resid  15 and name N   )
          (resid  15 and name CA  )   (resid  15 and name C   )   1.0   -124.30    70.00   2 
   assign (resid  15 and name N   )   (resid  15 and name CA  )
          (resid  15 and name C   )   (resid  16 and name N   )   1.0    130.10    41.40   2 
   assign (resid  16 and name C   )   (resid  17 and name N   )
          (resid  17 and name CA  )   (resid  17 and name C   )   1.0   -120.30    67.50   2 
   assign (resid  17 and name N   )   (resid  17 and name CA  )
          (resid  17 and name C   )   (resid  18 and name N   )   1.0    124.30    70.00   2 
   assign (resid  20 and name C   )   (resid  21 and name N   )
          (resid  21 and name CA  )   (resid  21 and name C   )   1.0    -86.80    38.40   2 
   assign (resid  21 and name N   )   (resid  21 and name CA  )
          (resid  21 and name C   )   (resid  22 and name N   )   1.0    144.20    70.00   2 
   assign (resid  21 and name C   )   (resid  22 and name N   )
          (resid  22 and name CA  )   (resid  22 and name C   )   1.0    -94.85    39.45   2 
   assign (resid  22 and name N   )   (resid  22 and name CA  )
          (resid  22 and name C   )   (resid  23 and name N   )   1.0    165.20    20.00   2 
   assign (resid  22 and name C   )   (resid  23 and name N   )
          (resid  23 and name CA  )   (resid  23 and name C   )   1.0    -57.90    20.00   2 
   assign (resid  23 and name N   )   (resid  23 and name CA  )
          (resid  23 and name C   )   (resid  24 and name N   )   1.0    -43.00    20.00   2 
   assign (resid  23 and name C   )   (resid  24 and name N   )
          (resid  24 and name CA  )   (resid  24 and name C   )   1.0    -59.70    20.00   2 
   assign (resid  24 and name N   )   (resid  24 and name CA  )
          (resid  24 and name C   )   (resid  25 and name N   )   1.0    -43.70    20.00   2 
   assign (resid  25 and name C   )   (resid  26 and name N   )
          (resid  26 and name CA  )   (resid  26 and name C   )   1.0    -62.30    20.00   2 
   assign (resid  26 and name N   )   (resid  26 and name CA  )
          (resid  26 and name C   )   (resid  27 and name N   )   1.0    -40.30    20.00   2 
   assign (resid  26 and name C   )   (resid  27 and name N   )
          (resid  27 and name CA  )   (resid  27 and name C   )   1.0    -61.10    20.00   2 
   assign (resid  27 and name N   )   (resid  27 and name CA  )
          (resid  27 and name C   )   (resid  28 and name N   )   1.0    -42.60    20.00   2 
   assign (resid  27 and name C   )   (resid  28 and name N   )
          (resid  28 and name CA  )   (resid  28 and name C   )   1.0    -64.00    20.00   2 
   assign (resid  28 and name N   )   (resid  28 and name CA  )
          (resid  28 and name C   )   (resid  29 and name N   )   1.0    -39.90    20.00   2 
   assign (resid  28 and name C   )   (resid  29 and name N   )
          (resid  29 and name CA  )   (resid  29 and name C   )   1.0    -70.60    24.40   2 
   assign (resid  29 and name N   )   (resid  29 and name CA  )
          (resid  29 and name C   )   (resid  30 and name N   )   1.0    -31.70    24.50   2 
   assign (resid  29 and name C   )   (resid  30 and name N   )
          (resid  30 and name CA  )   (resid  30 and name C   )   1.0    -89.15    38.55   2 
   assign (resid  30 and name N   )   (resid  30 and name CA  )
          (resid  30 and name C   )   (resid  31 and name N   )   1.0    -21.90    45.40   2 
   assign (resid  30 and name C   )   (resid  31 and name N   )
          (resid  31 and name CA  )   (resid  31 and name C   )   1.0   -108.90    60.40   2 
   assign (resid  31 and name N   )   (resid  31 and name CA  )
          (resid  31 and name C   )   (resid  32 and name N   )   1.0    120.20    70.00   2 
   assign (resid  32 and name C   )   (resid  33 and name N   )
          (resid  33 and name CA  )   (resid  33 and name C   )   1.0    -81.65    59.15   2 
   assign (resid  33 and name N   )   (resid  33 and name CA  )
          (resid  33 and name C   )   (resid  34 and name N   )   1.0    134.95    32.15   2 
   assign (resid  36 and name C   )   (resid  37 and name N   )
          (resid  37 and name CA  )   (resid  37 and name C   )   1.0   -117.75    59.55   2 
   assign (resid  37 and name N   )   (resid  37 and name CA  )
          (resid  37 and name C   )   (resid  38 and name N   )   1.0    149.25    22.95   2 
   assign (resid  37 and name C   )   (resid  38 and name N   )
          (resid  38 and name CA  )   (resid  38 and name C   )   1.0   -129.35    50.35   2 
   assign (resid  38 and name N   )   (resid  38 and name CA  )
          (resid  38 and name C   )   (resid  39 and name N   )   1.0    128.65    26.55   2 
   assign (resid  38 and name C   )   (resid  39 and name N   )
          (resid  39 and name CA  )   (resid  39 and name C   )   1.0   -111.20    28.00   2 
   assign (resid  40 and name N   )   (resid  40 and name CA  )
          (resid  40 and name C   )   (resid  41 and name N   )   1.0    127.30    20.00   2 
   assign (resid  40 and name C   )   (resid  41 and name N   )
          (resid  41 and name CA  )   (resid  41 and name C   )   1.0   -119.65    39.95   2 
   assign (resid  41 and name N   )   (resid  41 and name CA  )
          (resid  41 and name C   )   (resid  42 and name N   )   1.0    130.90    20.50   2 
   assign (resid  41 and name C   )   (resid  42 and name N   )
          (resid  42 and name CA  )   (resid  42 and name C   )   1.0   -103.80    20.00   2 
   assign (resid  42 and name N   )   (resid  42 and name CA  )
          (resid  42 and name C   )   (resid  43 and name N   )   1.0    133.20    26.80   2 
   assign (resid  42 and name C   )   (resid  43 and name N   )
          (resid  43 and name CA  )   (resid  43 and name C   )   1.0    -95.15    58.55   2 
   assign (resid  52 and name C   )   (resid  53 and name N   )
          (resid  53 and name CA  )   (resid  53 and name C   )   1.0   -125.35    54.85   2 
   assign (resid  53 and name N   )   (resid  53 and name CA  )
          (resid  53 and name C   )   (resid  54 and name N   )   1.0    149.70    27.10   2 
   assign (resid  53 and name C   )   (resid  54 and name N   )
          (resid  54 and name CA  )   (resid  54 and name C   )   1.0   -118.80    70.00   2 
   assign (resid  54 and name N   )   (resid  54 and name CA  )
          (resid  54 and name C   )   (resid  55 and name N   )   1.0    159.00    24.70   2 
   assign (resid  54 and name C   )   (resid  55 and name N   )
          (resid  55 and name CA  )   (resid  55 and name C   )   1.0   -136.65    38.55   2 
   assign (resid  55 and name N   )   (resid  55 and name CA  )
          (resid  55 and name C   )   (resid  56 and name N   )   1.0    153.70    20.00   2 
   assign (resid  55 and name C   )   (resid  56 and name N   )
          (resid  56 and name CA  )   (resid  56 and name C   )   1.0   -127.30    34.30   2 
   assign (resid  56 and name N   )   (resid  56 and name CA  )
          (resid  56 and name C   )   (resid  57 and name N   )   1.0    147.70    20.00   2 
   assign (resid  56 and name C   )   (resid  57 and name N   )
          (resid  57 and name CA  )   (resid  57 and name C   )   1.0   -131.85    41.05   2 
   assign (resid  57 and name N   )   (resid  57 and name CA  )
          (resid  57 and name C   )   (resid  58 and name N   )   1.0    152.50    23.90   2 
   assign (resid  57 and name C   )   (resid  58 and name N   )
          (resid  58 and name CA  )   (resid  58 and name C   )   1.0   -127.30    32.00   2 
   assign (resid  58 and name N   )   (resid  58 and name CA  )
          (resid  58 and name C   )   (resid  59 and name N   )   1.0    135.80    22.70   2 
   assign (resid  58 and name C   )   (resid  59 and name N   )
          (resid  59 and name CA  )   (resid  59 and name C   )   1.0   -129.55    37.35   2 
   assign (resid  59 and name N   )   (resid  59 and name CA  )
          (resid  59 and name C   )   (resid  60 and name N   )   1.0    133.00    23.00   2 
   assign (resid  60 and name C   )   (resid  61 and name N   )
          (resid  61 and name CA  )   (resid  61 and name C   )   1.0    -78.90    40.50   2 
   assign (resid  61 and name N   )   (resid  61 and name CA  )
          (resid  61 and name C   )   (resid  62 and name N   )   1.0    -23.85    62.55   2 
   assign (resid  61 and name C   )   (resid  62 and name N   )
          (resid  62 and name CA  )   (resid  62 and name C   )   1.0   -108.45    45.75   2 
   assign (resid  62 and name N   )   (resid  62 and name CA  )
          (resid  62 and name C   )   (resid  63 and name N   )   1.0    105.50    67.10   2 
   assign (resid  63 and name C   )   (resid  64 and name N   )
          (resid  64 and name CA  )   (resid  64 and name C   )   1.0    -64.10    20.00   2 
   assign (resid  64 and name N   )   (resid  64 and name CA  )
          (resid  64 and name C   )   (resid  65 and name N   )   1.0    -38.60    20.00   2 
   assign (resid  64 and name C   )   (resid  65 and name N   )
          (resid  65 and name CA  )   (resid  65 and name C   )   1.0    -64.20    20.00   2 
   assign (resid  65 and name N   )   (resid  65 and name CA  )
          (resid  65 and name C   )   (resid  66 and name N   )   1.0    -40.60    20.00   2 
   assign (resid  65 and name C   )   (resid  66 and name N   )
          (resid  66 and name CA  )   (resid  66 and name C   )   1.0    -63.80    20.00   2 
   assign (resid  66 and name N   )   (resid  66 and name CA  )
          (resid  66 and name C   )   (resid  67 and name N   )   1.0    -44.00    20.00   2 
   assign (resid  66 and name C   )   (resid  67 and name N   )
          (resid  67 and name CA  )   (resid  67 and name C   )   1.0    -59.50    20.00   2 
   assign (resid  67 and name N   )   (resid  67 and name CA  )
          (resid  67 and name C   )   (resid  68 and name N   )   1.0    -43.30    20.00   2 
   assign (resid  67 and name C   )   (resid  68 and name N   )
          (resid  68 and name CA  )   (resid  68 and name C   )   1.0    -64.30    20.00   2 
   assign (resid  68 and name N   )   (resid  68 and name CA  )
          (resid  68 and name C   )   (resid  69 and name N   )   1.0    -41.90    20.00   2 
   assign (resid  68 and name C   )   (resid  69 and name N   )
          (resid  69 and name CA  )   (resid  69 and name C   )   1.0    -65.10    20.00   2 
   assign (resid  69 and name N   )   (resid  69 and name CA  )
          (resid  69 and name C   )   (resid  70 and name N   )   1.0    -42.40    20.00   2 
   assign (resid  69 and name C   )   (resid  70 and name N   )
          (resid  70 and name CA  )   (resid  70 and name C   )   1.0    -60.40    20.00   2 
   assign (resid  70 and name N   )   (resid  70 and name CA  )
          (resid  70 and name C   )   (resid  71 and name N   )   1.0    -43.60    20.00   2 
   assign (resid  70 and name C   )   (resid  71 and name N   )
          (resid  71 and name CA  )   (resid  71 and name C   )   1.0    -61.10    20.00   2 
   assign (resid  71 and name N   )   (resid  71 and name CA  )
          (resid  71 and name C   )   (resid  72 and name N   )   1.0    -44.80    20.00   2 
   assign (resid  71 and name C   )   (resid  72 and name N   )
          (resid  72 and name CA  )   (resid  72 and name C   )   1.0    -68.20    20.00   2 
   assign (resid  72 and name N   )   (resid  72 and name CA  )
          (resid  72 and name C   )   (resid  73 and name N   )   1.0    -40.90    20.00   2 
   assign (resid  75 and name C   )   (resid  76 and name N   )
          (resid  76 and name CA  )   (resid  76 and name C   )   1.0    -73.60    20.00   2 
   assign (resid  76 and name N   )   (resid  76 and name CA  )
          (resid  76 and name C   )   (resid  77 and name N   )   1.0    137.90    20.00   2 
   assign (resid  76 and name C   )   (resid  77 and name N   )
          (resid  77 and name CA  )   (resid  77 and name C   )   1.0    -87.30    31.40   2 
   assign (resid  77 and name N   )   (resid  77 and name CA  )
          (resid  77 and name C   )   (resid  78 and name N   )   1.0    121.60    20.00   2 
   assign (resid  77 and name C   )   (resid  78 and name N   )
          (resid  78 and name CA  )   (resid  78 and name C   )   1.0   -108.65    26.95   2 
   assign (resid  78 and name N   )   (resid  78 and name CA  )
          (resid  78 and name C   )   (resid  79 and name N   )   1.0    140.10    22.10   2 
   assign (resid  78 and name C   )   (resid  79 and name N   )
          (resid  79 and name CA  )   (resid  79 and name C   )   1.0   -121.65    27.85   2 
   assign (resid  79 and name N   )   (resid  79 and name CA  )
          (resid  79 and name C   )   (resid  80 and name N   )   1.0    142.45    22.65   2 
   assign (resid  79 and name C   )   (resid  80 and name N   )
          (resid  80 and name CA  )   (resid  80 and name C   )   1.0   -102.65    47.35   2 
   assign (resid  80 and name N   )   (resid  80 and name CA  )
          (resid  80 and name C   )   (resid  81 and name N   )   1.0    152.20    50.30   2 
   assign (resid  80 and name C   )   (resid  81 and name N   )
          (resid  81 and name CA  )   (resid  81 and name C   )   1.0    -61.70    20.00   2 
   assign (resid  81 and name N   )   (resid  81 and name CA  )
          (resid  81 and name C   )   (resid  82 and name N   )   1.0    -17.90    20.00   2 
   assign (resid  81 and name C   )   (resid  82 and name N   )
          (resid  82 and name CA  )   (resid  82 and name C   )   1.0    -90.15    28.95   2 
   assign (resid  82 and name N   )   (resid  82 and name CA  )
          (resid  82 and name C   )   (resid  83 and name N   )   1.0      0.55    26.15   2 
   assign (resid  85 and name C   )   (resid  86 and name N   )
          (resid  86 and name CA  )   (resid  86 and name C   )   1.0    -94.55    50.75   2 
   assign (resid  86 and name N   )   (resid  86 and name CA  )
          (resid  86 and name C   )   (resid  87 and name N   )   1.0    130.25    53.65   2 
   assign (resid  87 and name C   )   (resid  88 and name N   )
          (resid  88 and name CA  )   (resid  88 and name C   )   1.0    -99.00    45.70   2 
   assign (resid  88 and name C   )   (resid  89 and name N   )
          (resid  89 and name CA  )   (resid  89 and name C   )   1.0   -118.50    23.80   2 
   assign (resid  89 and name N   )   (resid  89 and name CA  )
          (resid  89 and name C   )   (resid  90 and name N   )   1.0    128.60    25.50   2 
   assign (resid  89 and name C   )   (resid  90 and name N   )
          (resid  90 and name CA  )   (resid  90 and name C   )   1.0   -117.05    31.65   2 
   assign (resid  90 and name N   )   (resid  90 and name CA  )
          (resid  90 and name C   )   (resid  91 and name N   )   1.0    129.70    20.00   2 
   assign (resid  90 and name C   )   (resid  91 and name N   )
          (resid  91 and name CA  )   (resid  91 and name C   )   1.0   -137.35    33.85   2 
   assign (resid  91 and name N   )   (resid  91 and name CA  )
          (resid  91 and name C   )   (resid  92 and name N   )   1.0    157.25    28.55   2 
   assign (resid  91 and name C   )   (resid  92 and name N   )
          (resid  92 and name CA  )   (resid  92 and name C   )   1.0    -94.40    24.50   2 
   assign (resid  92 and name N   )   (resid  92 and name CA  )
          (resid  92 and name C   )   (resid  93 and name N   )   1.0    131.85    21.25   2 
   assign (resid  92 and name C   )   (resid  93 and name N   )
          (resid  93 and name CA  )   (resid  93 and name C   )   1.0    -75.40    30.30   2 
   assign (resid  93 and name N   )   (resid  93 and name CA  )
          (resid  93 and name C   )   (resid  94 and name N   )   1.0    142.75    32.15   2 
 end


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1H       MET   1  22.305  27.112  14.574
    2    H2   MET   1           2H       MET   1  21.357  28.300  15.310
    3    H3   MET   1           3H       MET   1  21.927  28.531  13.737
    4    HA   MET   1           HA       MET   1  20.008  26.439  14.583
    5    HB2  MET   1           2HB      MET   1  19.595  29.006  13.034
    6    HB3  MET   1           1HB      MET   1  18.384  27.741  13.180
    7    HG2  MET   1           2HG      MET   1  18.360  28.065  15.614
    8    HG3  MET   1           1HG      MET   1  19.543  29.361  15.439
    9    HE1  MET   1           3HE      MET   1  17.535  32.067  13.456
   10    HE2  MET   1           1HE      MET   1  18.597  30.829  12.789
   11    HE3  MET   1           2HE      MET   1  19.053  31.679  14.265
   12    H    GLY   2           H        GLY   2  19.618  24.853  13.122
   13    HA2  GLY   2           2HA      GLY   2  19.932  25.109  10.315
   14    HA3  GLY   2           1HA      GLY   2  21.351  24.324  10.995
   15    H    HIS   3           H        HIS   3  20.893  22.348   9.924
   16    HA   HIS   3           HA       HIS   3  18.901  20.753  11.365
   17    HB2  HIS   3           2HB      HIS   3  19.073  21.004   8.364
   18    HB3  HIS   3           1HB      HIS   3  18.342  19.599   9.139
   19    HD1  HIS   3           HD1      HIS   3  17.603  23.018   8.081
   20    HD2  HIS   3           HD2      HIS   3  16.033  20.286  10.784
   21    HE1  HIS   3           HE1      HIS   3  15.324  23.885   8.662
   22    HE2  HIS   3           HE2      HIS   3  14.488  22.328  10.457
   23    H    HIS   4           H        HIS   4  19.264  18.479  11.325
   24    HA   HIS   4           HA       HIS   4  22.039  17.858  11.644
   25    HB2  HIS   4           2HB      HIS   4  20.376  16.980  13.188
   26    HB3  HIS   4           1HB      HIS   4  19.551  16.149  11.879
   27    HD1  HIS   4           HD1      HIS   4  20.310  13.827  11.341
   28    HD2  HIS   4           HD2      HIS   4  22.940  15.819  13.870
   29    HE1  HIS   4           HE1      HIS   4  21.975  12.101  12.076
   30    HE2  HIS   4           HE2      HIS   4  23.429  13.283  13.749
   31    H    HIS   5           H        HIS   5  20.052  17.781   8.931
   32    HA   HIS   5           HA       HIS   5  20.254  16.954   6.834
   33    HB2  HIS   5           2HB      HIS   5  23.077  16.340   7.735
   34    HB3  HIS   5           1HB      HIS   5  22.508  16.124   6.083
   35    HD1  HIS   5           HD1      HIS   5  21.906  18.300   4.751
   36    HD2  HIS   5           HD2      HIS   5  23.686  18.950   8.448
   37    HE1  HIS   5           HE1      HIS   5  22.630  20.703   4.733
   38    HE2  HIS   5           HE2      HIS   5  23.519  21.117   7.049
   39    H    HIS   6           H        HIS   6  18.715  15.366   7.043
   40    HA   HIS   6           HA       HIS   6  19.566  12.668   7.815
   41    HB2  HIS   6           2HB      HIS   6  17.466  13.675   8.778
   42    HB3  HIS   6           1HB      HIS   6  16.771  13.644   7.161
   43    HD1  HIS   6           HD1      HIS   6  16.476  11.172   6.097
   44    HD2  HIS   6           HD2      HIS   6  17.238  11.338  10.183
   45    HE1  HIS   6           HE1      HIS   6  15.878   8.904   6.989
   46    HE2  HIS   6           HE2      HIS   6  16.270   9.048   9.464
   47    H    HIS   7           H        HIS   7  19.307  10.870   6.432
   48    HA   HIS   7           HA       HIS   7  19.919  11.230   3.739
   49    HB2  HIS   7           2HB      HIS   7  18.730   8.830   5.141
   50    HB3  HIS   7           1HB      HIS   7  19.327   8.799   3.486
   51    HD1  HIS   7           HD1      HIS   7  20.397   7.860   6.688
   52    HD2  HIS   7           HD2      HIS   7  22.220   9.902   3.558
   53    HE1  HIS   7           HE1      HIS   7  22.864   7.642   7.088
   54    HE2  HIS   7           HE2      HIS   7  23.938   8.733   5.093
   55    H    HIS   8           H        HIS   8  18.699  10.712   1.798
   56    HA   HIS   8           HA       HIS   8  16.311  12.289   1.791
   57    HB2  HIS   8           2HB      HIS   8  17.633  10.761  -0.458
   58    HB3  HIS   8           1HB      HIS   8  16.349  11.950  -0.652
   59    HD1  HIS   8           HD1      HIS   8  19.989  11.627  -0.392
   60    HD2  HIS   8           HD2      HIS   8  17.164  14.645   0.044
   61    HE1  HIS   8           HE1      HIS   8  21.279  13.776  -0.474
   62    HE2  HIS   8           HE2      HIS   8  19.576  15.571  -0.069
   63    H    SER   9           H        SER   9  14.244  11.711   1.757
   64    HA   SER   9           HA       SER   9  13.519   8.896   1.860
   65    HB2  SER   9           2HB      SER   9  11.216   9.834   2.334
   66    HB3  SER   9           1HB      SER   9  12.462  10.298   3.494
   67    HG   SER   9           HG       SER   9  10.909  11.878   2.012
   68    H    HIS  10           H        HIS  10  13.347   7.887  -0.065
   69    HA   HIS  10           HA       HIS  10  12.254   9.298  -2.374
   70    HB2  HIS  10           2HB      HIS  10  13.601   6.613  -2.074
   71    HB3  HIS  10           1HB      HIS  10  12.844   7.127  -3.579
   72    HD1  HIS  10           HD1      HIS  10  15.992   6.630  -3.054
   73    HD2  HIS  10           HD2      HIS  10  14.036  10.287  -3.362
   74    HE1  HIS  10           HE1      HIS  10  17.754   8.287  -3.719
   75    HE2  HIS  10           HE2      HIS  10  16.511  10.442  -4.081
   76    H    MET  11           H        MET  11  10.400   8.731  -3.480
   77    HA   MET  11           HA       MET  11   8.302   7.651  -1.829
   78    HB2  MET  11           2HB      MET  11   8.211   8.628  -4.692
   79    HB3  MET  11           1HB      MET  11   6.814   8.294  -3.678
   80    HG2  MET  11           2HG      MET  11   7.488  10.077  -2.150
   81    HG3  MET  11           1HG      MET  11   8.900  10.405  -3.153
   82    HE1  MET  11           3HE      MET  11   8.729  11.309  -5.680
   83    HE2  MET  11           1HE      MET  11   7.197  11.649  -6.484
   84    HE3  MET  11           2HE      MET  11   7.634   9.986  -6.089
   85    H    VAL  12           H        VAL  12   6.904   5.919  -2.306
   86    HA   VAL  12           HA       VAL  12   7.839   3.916  -4.255
   87    HB   VAL  12           HB       VAL  12   7.429   3.466  -1.290
   88   HG11  VAL  12          1HG1      VAL  12   7.720   1.354  -3.427
   89   HG12  VAL  12          2HG1      VAL  12   6.268   1.683  -2.482
   90   HG13  VAL  12          3HG1      VAL  12   7.718   1.073  -1.685
   91   HG21  VAL  12          3HG2      VAL  12   9.771   2.891  -3.121
   92   HG22  VAL  12          1HG2      VAL  12   9.700   2.531  -1.394
   93   HG23  VAL  12          2HG2      VAL  12   9.664   4.205  -1.948
   94    H    VAL  13           H        VAL  13   6.226   2.508  -5.041
   95    HA   VAL  13           HA       VAL  13   3.462   2.987  -4.105
   96    HB   VAL  13           HB       VAL  13   2.661   2.827  -6.462
   97   HG11  VAL  13          1HG1      VAL  13   2.841   4.998  -5.401
   98   HG12  VAL  13          2HG1      VAL  13   3.284   5.124  -7.104
   99   HG13  VAL  13          3HG1      VAL  13   4.537   5.112  -5.865
  100   HG21  VAL  13          3HG2      VAL  13   4.254   3.211  -8.299
  101   HG22  VAL  13          1HG2      VAL  13   4.574   1.692  -7.461
  102   HG23  VAL  13          2HG2      VAL  13   5.591   3.099  -7.154
  103    H    ILE  14           H        ILE  14   1.908   1.314  -4.836
  104    HA   ILE  14           HA       ILE  14   3.170  -1.360  -4.825
  105    HB   ILE  14           HB       ILE  14   1.777  -0.620  -2.818
  106   HG12  ILE  14          2HG1      ILE  14   0.534  -2.848  -2.707
  107   HG13  ILE  14          1HG1      ILE  14   1.122  -3.152  -4.341
  108   HG21  ILE  14          1HG2      ILE  14  -0.498  -0.993  -4.768
  109   HG22  ILE  14          2HG2      ILE  14  -0.025   0.510  -3.973
  110   HG23  ILE  14          3HG2      ILE  14  -0.670  -0.826  -3.021
  111   HD11  ILE  14          3HD1      ILE  14   2.803  -2.724  -1.879
  112   HD12  ILE  14          1HD1      ILE  14   3.430  -2.952  -3.513
  113   HD13  ILE  14          2HD1      ILE  14   2.531  -4.246  -2.724
  114    H    ARG  15           H        ARG  15   2.383  -2.971  -6.241
  115    HA   ARG  15           HA       ARG  15   0.446  -2.083  -8.293
  116    HB2  ARG  15           2HB      ARG  15   2.980  -3.681  -8.694
  117    HB3  ARG  15           1HB      ARG  15   1.729  -3.524  -9.918
  118    HG2  ARG  15           2HG      ARG  15   2.079  -1.016  -9.767
  119    HG3  ARG  15           1HG      ARG  15   3.515  -1.373  -8.803
  120    HD2  ARG  15           2HD      ARG  15   4.400  -2.742 -10.655
  121    HD3  ARG  15           1HD      ARG  15   2.975  -2.352 -11.618
  122    HE   ARG  15           HE       ARG  15   4.677  -0.167 -10.666
  123   HH11  ARG  15          1HH1      ARG  15   3.528  -2.076 -13.305
  124   HH12  ARG  15          2HH1      ARG  15   4.183  -1.004 -14.490
  125   HH21  ARG  15          1HH2      ARG  15   5.528   1.167 -12.197
  126   HH22  ARG  15          2HH2      ARG  15   5.310   0.800 -13.874
  127    H    ARG  16           H        ARG  16  -0.602  -3.817  -9.501
  128    HA   ARG  16           HA       ARG  16  -1.874  -5.665  -9.724
  129    HB2  ARG  16           2HB      ARG  16   0.152  -6.959  -7.891
  130    HB3  ARG  16           1HB      ARG  16  -1.060  -7.817  -8.832
  131    HG2  ARG  16           2HG      ARG  16   0.007  -6.745 -10.889
  132    HG3  ARG  16           1HG      ARG  16   1.338  -6.296  -9.824
  133    HD2  ARG  16           2HD      ARG  16   0.367  -9.082 -10.470
  134    HD3  ARG  16           1HD      ARG  16   1.901  -8.353 -10.939
  135    HE   ARG  16           HE       ARG  16   1.512  -8.482  -8.096
  136   HH11  ARG  16          1HH1      ARG  16   2.692 -10.150 -10.862
  137   HH12  ARG  16          2HH1      ARG  16   3.642 -11.254  -9.934
  138   HH21  ARG  16          1HH2      ARG  16   2.744  -9.892  -6.911
  139   HH22  ARG  16          2HH2      ARG  16   3.673 -11.114  -7.711
  140    H    LEU  17           H        LEU  17  -2.849  -3.846  -7.937
  141    HA   LEU  17           HA       LEU  17  -4.010  -5.454  -5.763
  142    HB2  LEU  17           2HB      LEU  17  -3.629  -2.521  -6.181
  143    HB3  LEU  17           1HB      LEU  17  -4.977  -3.047  -5.195
  144    HG   LEU  17           HG       LEU  17  -3.000  -2.452  -3.852
  145   HD11  LEU  17          1HD1      LEU  17  -4.609  -4.085  -2.997
  146   HD12  LEU  17          2HD1      LEU  17  -2.975  -4.430  -2.432
  147   HD13  LEU  17          3HD1      LEU  17  -3.681  -5.392  -3.732
  148   HD21  LEU  17          3HD2      LEU  17  -1.677  -4.802  -5.211
  149   HD22  LEU  17          1HD2      LEU  17  -1.015  -3.865  -3.871
  150   HD23  LEU  17          2HD2      LEU  17  -1.258  -3.103  -5.442
  151    HA   PRO  18           HA       PRO  18  -7.779  -5.353  -8.327
  152    HB2  PRO  18           2HB      PRO  18  -8.779  -7.705  -7.531
  153    HB3  PRO  18           1HB      PRO  18  -7.426  -7.631  -8.668
  154    HG2  PRO  18           2HG      PRO  18  -7.401  -8.200  -5.728
  155    HG3  PRO  18           1HG      PRO  18  -6.470  -8.970  -7.025
  156    HD2  PRO  18           2HD      PRO  18  -5.514  -6.974  -5.348
  157    HD3  PRO  18           1HD      PRO  18  -4.830  -7.382  -6.933
  158    HA   PRO  19           HA       PRO  19 -10.421  -3.612  -5.185
  159    HB2  PRO  19           2HB      PRO  19 -12.888  -4.074  -6.321
  160    HB3  PRO  19           1HB      PRO  19 -11.807  -2.755  -6.793
  161    HG2  PRO  19           2HG      PRO  19 -12.218  -5.427  -8.089
  162    HG3  PRO  19           1HG      PRO  19 -12.033  -3.831  -8.843
  163    HD2  PRO  19           2HD      PRO  19  -9.996  -5.590  -8.743
  164    HD3  PRO  19           1HD      PRO  19  -9.724  -3.841  -8.593
  165    H    GLY  20           H        GLY  20 -10.596  -4.664  -3.282
  166    HA2  GLY  20           2HA      GLY  20 -12.667  -6.668  -2.962
  167    HA3  GLY  20           1HA      GLY  20 -11.040  -7.274  -2.700
  168    H    LEU  21           H        LEU  21  -9.715  -5.959  -1.110
  169    HA   LEU  21           HA       LEU  21 -11.331  -5.564   1.268
  170    HB2  LEU  21           2HB      LEU  21  -9.361  -5.702   2.541
  171    HB3  LEU  21           1HB      LEU  21  -9.216  -6.914   1.285
  172    HG   LEU  21           HG       LEU  21  -7.803  -4.238   1.357
  173   HD11  LEU  21          1HD1      LEU  21  -6.972  -5.837   2.998
  174   HD12  LEU  21          2HD1      LEU  21  -5.791  -5.560   1.716
  175   HD13  LEU  21          3HD1      LEU  21  -6.751  -7.041   1.726
  176   HD21  LEU  21          3HD2      LEU  21  -6.521  -5.079  -0.579
  177   HD22  LEU  21          1HD2      LEU  21  -8.229  -4.854  -0.952
  178   HD23  LEU  21          2HD2      LEU  21  -7.596  -6.475  -0.667
  179    H    THR  22           H        THR  22 -10.954  -3.775   2.739
  180    HA   THR  22           HA       THR  22 -10.839  -1.211   1.312
  181    HB   THR  22           HB       THR  22 -11.842  -1.893   4.100
  182    HG1  THR  22           HG1      THR  22 -13.131  -2.640   2.297
  183   HG21  THR  22          3HG2      THR  22 -12.780   0.368   4.147
  184   HG22  THR  22          1HG2      THR  22 -12.054   0.716   2.578
  185   HG23  THR  22          2HG2      THR  22 -11.024   0.430   3.982
  186    H    LYS  23           H        LYS  23  -9.634   0.588   2.215
  187    HA   LYS  23           HA       LYS  23  -7.009   0.226   2.666
  188    HB2  LYS  23           2HB      LYS  23  -6.889   2.474   3.607
  189    HB3  LYS  23           1HB      LYS  23  -7.966   2.406   2.222
  190    HG2  LYS  23           2HG      LYS  23  -9.907   2.424   3.700
  191    HG3  LYS  23           1HG      LYS  23  -8.845   2.436   5.111
  192    HD2  LYS  23           2HD      LYS  23  -9.037   4.587   2.991
  193    HD3  LYS  23           1HD      LYS  23  -9.654   4.686   4.641
  194    HE2  LYS  23           2HE      LYS  23  -7.376   4.491   5.513
  195    HE3  LYS  23           1HE      LYS  23  -6.747   4.354   3.873
  196    HZ1  LYS  23           3HZ      LYS  23  -6.486   6.583   4.738
  197    HZ2  LYS  23           1HZ      LYS  23  -8.154   6.714   4.994
  198    HZ3  LYS  23           2HZ      LYS  23  -7.548   6.585   3.423
  199    H    GLU  24           H        GLU  24  -9.447   0.168   5.234
  200    HA   GLU  24           HA       GLU  24  -7.803   0.201   7.477
  201    HB2  GLU  24           2HB      GLU  24 -10.360  -1.373   7.081
  202    HB3  GLU  24           1HB      GLU  24  -9.638  -0.972   8.635
  203    HG2  GLU  24           2HG      GLU  24  -9.985   1.389   8.230
  204    HG3  GLU  24           1HG      GLU  24 -10.619   1.047   6.621
  205    H    GLN  25           H        GLN  25  -8.712  -2.576   5.456
  206    HA   GLN  25           HA       GLN  25  -6.954  -4.358   6.996
  207    HB2  GLN  25           2HB      GLN  25  -8.684  -5.046   4.609
  208    HB3  GLN  25           1HB      GLN  25  -7.935  -6.167   5.738
  209    HG2  GLN  25           2HG      GLN  25  -9.381  -5.308   7.526
  210    HG3  GLN  25           1HG      GLN  25 -10.152  -4.224   6.365
  211   HE21  GLN  25          1HE2      GLN  25 -11.454  -5.134   4.723
  212   HE22  GLN  25          2HE2      GLN  25 -12.115  -6.718   4.881
  213    H    LEU  26           H        LEU  26  -6.743  -2.312   4.384
  214    HA   LEU  26           HA       LEU  26  -4.993  -3.980   2.757
  215    HB2  LEU  26           2HB      LEU  26  -6.569  -2.842   1.478
  216    HB3  LEU  26           1HB      LEU  26  -6.389  -1.363   2.387
  217    HG   LEU  26           HG       LEU  26  -4.070  -1.156   1.351
  218   HD11  LEU  26          1HD1      LEU  26  -5.159  -3.298  -0.477
  219   HD12  LEU  26          2HD1      LEU  26  -3.813  -3.479   0.650
  220   HD13  LEU  26          3HD1      LEU  26  -3.672  -2.380  -0.722
  221   HD21  LEU  26          3HD2      LEU  26  -4.943  -0.235  -0.745
  222   HD22  LEU  26          1HD2      LEU  26  -5.945   0.215   0.634
  223   HD23  LEU  26          2HD2      LEU  26  -6.479  -1.057  -0.467
  224    H    GLU  27           H        GLU  27  -4.791  -0.862   4.508
  225    HA   GLU  27           HA       GLU  27  -2.068  -0.426   3.752
  226    HB2  GLU  27           2HB      GLU  27  -2.130   1.497   5.223
  227    HB3  GLU  27           1HB      GLU  27  -3.598   1.430   4.259
  228    HG2  GLU  27           2HG      GLU  27  -4.770   0.425   6.206
  229    HG3  GLU  27           1HG      GLU  27  -3.305   0.657   7.154
  230    H    GLU  28           H        GLU  28  -3.503  -2.341   6.194
  231    HA   GLU  28           HA       GLU  28  -1.709  -2.144   8.301
  232    HB2  GLU  28           2HB      GLU  28  -2.400  -4.403   8.951
  233    HB3  GLU  28           1HB      GLU  28  -3.777  -3.425   8.471
  234    HG2  GLU  28           2HG      GLU  28  -3.922  -4.551   6.356
  235    HG3  GLU  28           1HG      GLU  28  -2.423  -5.422   6.670
  236    H    GLN  29           H        GLN  29  -1.359  -3.966   5.286
  237    HA   GLN  29           HA       GLN  29   1.305  -4.865   6.136
  238    HB2  GLN  29           2HB      GLN  29   1.283  -6.176   3.988
  239    HB3  GLN  29           1HB      GLN  29   0.069  -6.640   5.167
  240    HG2  GLN  29           2HG      GLN  29  -0.750  -4.664   3.106
  241    HG3  GLN  29           1HG      GLN  29  -0.469  -6.319   2.570
  242   HE21  GLN  29          1HE2      GLN  29  -2.967  -4.787   2.731
  243   HE22  GLN  29          2HE2      GLN  29  -4.023  -5.719   3.733
  244    H    LEU  30           H        LEU  30  -0.029  -2.258   4.501
  245    HA   LEU  30           HA       LEU  30   2.190  -1.954   2.623
  246    HB2  LEU  30           2HB      LEU  30  -0.276  -0.266   3.053
  247    HB3  LEU  30           1HB      LEU  30   0.950   0.052   1.840
  248    HG   LEU  30           HG       LEU  30  -0.839  -2.382   1.958
  249   HD11  LEU  30          1HD1      LEU  30  -1.802  -1.471  -0.104
  250   HD12  LEU  30          2HD1      LEU  30  -0.781  -0.041   0.054
  251   HD13  LEU  30          3HD1      LEU  30  -2.021  -0.379   1.263
  252   HD21  LEU  30          3HD2      LEU  30   0.149  -2.964  -0.221
  253   HD22  LEU  30          1HD2      LEU  30   1.347  -2.982   1.072
  254   HD23  LEU  30          2HD2      LEU  30   1.287  -1.627  -0.055
  255    H    ARG  31           H        ARG  31   1.201  -0.717   5.734
  256    HA   ARG  31           HA       ARG  31   3.586   1.002   5.689
  257    HB2  ARG  31           2HB      ARG  31   2.318   2.757   6.958
  258    HB3  ARG  31           1HB      ARG  31   1.855   2.546   5.280
  259    HG2  ARG  31           2HG      ARG  31  -0.189   2.771   6.290
  260    HG3  ARG  31           1HG      ARG  31  -0.017   1.018   6.267
  261    HD2  ARG  31           2HD      ARG  31   0.504   0.942   8.575
  262    HD3  ARG  31           1HD      ARG  31   0.794   2.682   8.642
  263    HE   ARG  31           HE       ARG  31  -1.862   2.266   7.861
  264   HH11  ARG  31          1HH1      ARG  31   0.120   1.799  10.650
  265   HH12  ARG  31          2HH1      ARG  31  -1.199   2.032  11.744
  266   HH21  ARG  31          1HH2      ARG  31  -3.522   2.561   9.275
  267   HH22  ARG  31          2HH2      ARG  31  -3.232   2.444  10.980
  268    HA   PRO  32           HA       PRO  32   3.359  -1.113   9.897
  269    HB2  PRO  32           2HB      PRO  32   4.348  -3.574   9.581
  270    HB3  PRO  32           1HB      PRO  32   2.644  -3.240   9.238
  271    HG2  PRO  32           2HG      PRO  32   4.938  -3.550   7.339
  272    HG3  PRO  32           1HG      PRO  32   3.277  -4.155   7.198
  273    HD2  PRO  32           2HD      PRO  32   4.248  -1.842   5.991
  274    HD3  PRO  32           1HD      PRO  32   2.536  -2.204   6.276
  275    H    LEU  33           H        LEU  33   5.361   0.277   8.017
  276    HA   LEU  33           HA       LEU  33   7.941  -0.862   8.501
  277    HB2  LEU  33           2HB      LEU  33   7.056   1.791   7.365
  278    HB3  LEU  33           1HB      LEU  33   8.736   1.313   7.480
  279    HG   LEU  33           HG       LEU  33   8.274  -0.593   5.952
  280   HD11  LEU  33          1HD1      LEU  33   5.532   0.646   5.717
  281   HD12  LEU  33          2HD1      LEU  33   5.913  -0.938   6.393
  282   HD13  LEU  33          3HD1      LEU  33   6.176  -0.625   4.677
  283   HD21  LEU  33          3HD2      LEU  33   7.512   2.137   4.921
  284   HD22  LEU  33          1HD2      LEU  33   8.009   0.769   3.924
  285   HD23  LEU  33          2HD2      LEU  33   9.144   1.484   5.070
  286    HA   PRO  34           HA       PRO  34   9.144   1.310  12.241
  287    HB2  PRO  34           2HB      PRO  34  11.830   1.772  11.132
  288    HB3  PRO  34           1HB      PRO  34  11.339   0.754  12.489
  289    HG2  PRO  34           2HG      PRO  34  12.189  -0.292  10.151
  290    HG3  PRO  34           1HG      PRO  34  10.947  -1.081  11.143
  291    HD2  PRO  34           2HD      PRO  34  10.615   0.612   8.683
  292    HD3  PRO  34           1HD      PRO  34   9.807  -0.909   9.121
  293    H    ALA  35           H        ALA  35  11.147   2.952   9.749
  294    HA   ALA  35           HA       ALA  35  10.110   5.532  10.764
  295    HB1  ALA  35           3HB      ALA  35  12.713   4.985   9.331
  296    HB2  ALA  35           1HB      ALA  35  12.520   5.179  11.073
  297    HB3  ALA  35           2HB      ALA  35  12.188   6.534   9.994
  298    H    HIS  36           H        HIS  36   8.342   5.897   9.445
  299    HA   HIS  36           HA       HIS  36   8.839   6.338   6.605
  300    HB2  HIS  36           2HB      HIS  36   7.183   4.790   5.814
  301    HB3  HIS  36           1HB      HIS  36   8.271   3.894   6.873
  302    HD1  HIS  36           HD1      HIS  36   4.764   4.522   6.294
  303    HD2  HIS  36           HD2      HIS  36   7.104   3.600   9.604
  304    HE1  HIS  36           HE1      HIS  36   3.163   3.697   8.044
  305    HE2  HIS  36           HE2      HIS  36   4.601   3.092  10.014
  306    H    ASP  37           H        ASP  37   6.514   6.671   5.560
  307    HA   ASP  37           HA       ASP  37   4.692   8.181   7.301
  308    HB2  ASP  37           2HB      ASP  37   6.215   9.776   6.115
  309    HB3  ASP  37           1HB      ASP  37   5.702   9.094   4.580
  310    H    TYR  38           H        TYR  38   2.661   8.711   5.453
  311    HA   TYR  38           HA       TYR  38   2.357   6.482   3.651
  312    HB2  TYR  38           2HB      TYR  38   0.342   5.531   4.618
  313    HB3  TYR  38           1HB      TYR  38   1.676   5.425   5.753
  314    HD1  TYR  38           HD2      TYR  38   1.685   6.831   7.793
  315    HD2  TYR  38           HD1      TYR  38  -1.615   6.847   5.100
  316    HE1  TYR  38           HE2      TYR  38   0.280   7.866   9.526
  317    HE2  TYR  38           HE1      TYR  38  -3.031   7.877   6.828
  318    HH   TYR  38           HH       TYR  38  -1.753   9.182   9.730
  319    H    PHE  39           H        PHE  39   0.666   6.650   2.186
  320    HA   PHE  39           HA       PHE  39  -0.445   9.366   1.932
  321    HB2  PHE  39           2HB      PHE  39   0.721   7.426   0.026
  322    HB3  PHE  39           1HB      PHE  39  -0.715   8.259  -0.555
  323    HD1  PHE  39           HD2      PHE  39   2.747   8.745   0.658
  324    HD2  PHE  39           HD1      PHE  39  -0.653  10.521  -1.195
  325    HE1  PHE  39           HE2      PHE  39   4.105  10.699   0.037
  326    HE2  PHE  39           HE1      PHE  39   0.697  12.470  -1.819
  327    HZ   PHE  39           HZ       PHE  39   3.083  12.568  -1.202
  328    H    GLU  40           H        GLU  40  -2.284   9.004   0.007
  329    HA   GLU  40           HA       GLU  40  -4.577   8.028   1.301
  330    HB2  GLU  40           2HB      GLU  40  -5.638   8.338  -0.992
  331    HB3  GLU  40           1HB      GLU  40  -4.856   9.750  -0.294
  332    HG2  GLU  40           2HG      GLU  40  -2.862   9.295  -1.687
  333    HG3  GLU  40           1HG      GLU  40  -3.720   7.950  -2.432
  334    H    PHE  41           H        PHE  41  -5.231   6.012   1.619
  335    HA   PHE  41           HA       PHE  41  -4.463   3.890  -0.284
  336    HB2  PHE  41           2HB      PHE  41  -5.477   3.659   2.564
  337    HB3  PHE  41           1HB      PHE  41  -5.060   2.303   1.522
  338    HD1  PHE  41           HD1      PHE  41  -2.653   2.161   0.671
  339    HD2  PHE  41           HD2      PHE  41  -3.842   4.670   3.904
  340    HE1  PHE  41           HE1      PHE  41  -0.322   2.267   1.449
  341    HE2  PHE  41           HE2      PHE  41  -1.513   4.777   4.680
  342    HZ   PHE  41           HZ       PHE  41   0.254   3.576   3.455
  343    H    PHE  42           H        PHE  42  -6.010   2.755  -1.392
  344    HA   PHE  42           HA       PHE  42  -8.576   3.999  -1.620
  345    HB2  PHE  42           2HB      PHE  42  -8.985   2.488  -3.460
  346    HB3  PHE  42           1HB      PHE  42  -7.354   3.126  -3.579
  347    HD1  PHE  42           HD1      PHE  42  -9.384   0.136  -2.956
  348    HD2  PHE  42           HD2      PHE  42  -5.421   1.669  -3.326
  349    HE1  PHE  42           HE1      PHE  42  -8.517  -2.157  -3.173
  350    HE2  PHE  42           HE2      PHE  42  -4.555  -0.620  -3.539
  351    HZ   PHE  42           HZ       PHE  42  -6.102  -2.535  -3.462
  352    H    ALA  43           H        ALA  43 -10.610   2.719  -1.757
  353    HA   ALA  43           HA       ALA  43 -10.772   0.671   0.365
  354    HB1  ALA  43           3HB      ALA  43 -12.801   2.826  -0.236
  355    HB2  ALA  43           1HB      ALA  43 -11.693   2.810   1.134
  356    HB3  ALA  43           2HB      ALA  43 -12.949   1.577   1.002
  357    H    ALA  44           H        ALA  44 -12.347  -0.982   0.084
  358    HA   ALA  44           HA       ALA  44 -13.947  -1.105  -2.302
  359    HB1  ALA  44           3HB      ALA  44 -12.867  -3.040  -3.316
  360    HB2  ALA  44           1HB      ALA  44 -11.609  -3.008  -2.077
  361    HB3  ALA  44           2HB      ALA  44 -11.752  -1.678  -3.227
  362    H    ASP  45           H        ASP  45 -15.508  -2.691  -2.245
  363    HA   ASP  45           HA       ASP  45 -15.747  -4.224   0.252
  364    HB2  ASP  45           2HB      ASP  45 -17.838  -3.518  -1.829
  365    HB3  ASP  45           1HB      ASP  45 -18.141  -4.411  -0.339
  366    H    LEU  46           H        LEU  46 -15.029  -6.286   0.092
  367    HA   LEU  46           HA       LEU  46 -14.682  -7.719  -2.291
  368    HB2  LEU  46           2HB      LEU  46 -14.367  -9.706  -0.922
  369    HB3  LEU  46           1HB      LEU  46 -13.521  -8.338  -0.231
  370    HG   LEU  46           HG       LEU  46 -16.230  -9.196   0.793
  371   HD11  LEU  46          1HD1      LEU  46 -13.532 -10.149   1.755
  372   HD12  LEU  46          2HD1      LEU  46 -14.759 -11.134   0.955
  373   HD13  LEU  46          3HD1      LEU  46 -15.078 -10.449   2.549
  374   HD21  LEU  46          3HD2      LEU  46 -15.498  -8.045   2.826
  375   HD22  LEU  46          1HD2      LEU  46 -15.473  -6.961   1.437
  376   HD23  LEU  46          2HD2      LEU  46 -13.965  -7.638   2.053
  377    H    SER  47           H        SER  47 -17.502  -7.399  -0.224
  378    HA   SER  47           HA       SER  47 -19.061  -9.422  -1.524
  379    HB2  SER  47           2HB      SER  47 -20.004  -6.997   0.039
  380    HB3  SER  47           1HB      SER  47 -20.985  -8.398  -0.385
  381    HG   SER  47           HG       SER  47 -19.173  -8.067   1.644
  382    H    LEU  48           H        LEU  48 -18.694  -9.006  -3.738
  383    HA   LEU  48           HA       LEU  48 -19.054  -8.170  -5.805
  384    HB2  LEU  48           2HB      LEU  48 -21.294  -6.636  -4.466
  385    HB3  LEU  48           1HB      LEU  48 -21.045  -6.730  -6.201
  386    HG   LEU  48           HG       LEU  48 -21.661  -9.081  -4.394
  387   HD11  LEU  48          1HD1      LEU  48 -23.827  -9.126  -5.534
  388   HD12  LEU  48          2HD1      LEU  48 -23.398  -7.657  -6.411
  389   HD13  LEU  48          3HD1      LEU  48 -23.586  -7.615  -4.657
  390   HD21  LEU  48          3HD2      LEU  48 -21.886 -10.362  -6.461
  391   HD22  LEU  48          1HD2      LEU  48 -20.255  -9.715  -6.294
  392   HD23  LEU  48          2HD2      LEU  48 -21.397  -8.952  -7.401
  393    H    TYR  49           H        TYR  49 -17.091  -7.178  -5.971
  394    HA   TYR  49           HA       TYR  49 -16.279  -4.789  -4.779
  395    HB2  TYR  49           2HB      TYR  49 -14.503  -4.813  -6.634
  396    HB3  TYR  49           1HB      TYR  49 -14.582  -6.209  -5.566
  397    HD1  TYR  49           HD1      TYR  49 -15.348  -4.992  -8.978
  398    HD2  TYR  49           HD2      TYR  49 -15.149  -8.376  -6.397
  399    HE1  TYR  49           HE1      TYR  49 -15.577  -6.484 -10.921
  400    HE2  TYR  49           HE2      TYR  49 -15.377  -9.871  -8.331
  401    HH   TYR  49           HH       TYR  49 -16.237  -9.824 -10.598
  402    HA   PRO  50           HA       PRO  50 -18.049  -1.514  -7.181
  403    HB2  PRO  50           2HB      PRO  50 -16.235   0.459  -6.860
  404    HB3  PRO  50           1HB      PRO  50 -17.214  -0.146  -5.517
  405    HG2  PRO  50           2HG      PRO  50 -14.386  -0.822  -6.254
  406    HG3  PRO  50           1HG      PRO  50 -15.064  -0.445  -4.659
  407    HD2  PRO  50           2HD      PRO  50 -14.604  -2.992  -5.510
  408    HD3  PRO  50           1HD      PRO  50 -15.904  -2.575  -4.375
  409    H    HIS  51           H        HIS  51 -15.964  -3.384  -8.625
  410    HA   HIS  51           HA       HIS  51 -15.448  -3.667 -10.824
  411    HB2  HIS  51           2HB      HIS  51 -17.555  -2.405 -11.263
  412    HB3  HIS  51           1HB      HIS  51 -16.630  -0.914 -11.281
  413    HD1  HIS  51           HD1      HIS  51 -18.325  -2.472 -13.629
  414    HD2  HIS  51           HD2      HIS  51 -14.219  -1.915 -13.340
  415    HE1  HIS  51           HE1      HIS  51 -17.458  -2.638 -15.973
  416    HE2  HIS  51           HE2      HIS  51 -15.015  -2.088 -15.791
  417    H    LEU  52           H        LEU  52 -14.834  -0.204 -10.134
  418    HA   LEU  52           HA       LEU  52 -12.701  -0.004 -11.946
  419    HB2  LEU  52           2HB      LEU  52 -12.247   2.189 -10.769
  420    HB3  LEU  52           1HB      LEU  52 -13.847   1.969 -11.445
  421    HG   LEU  52           HG       LEU  52 -14.596   1.320  -9.079
  422   HD11  LEU  52          1HD1      LEU  52 -13.255   2.226  -7.231
  423   HD12  LEU  52          2HD1      LEU  52 -11.957   2.607  -8.362
  424   HD13  LEU  52          3HD1      LEU  52 -12.414   0.929  -8.078
  425   HD21  LEU  52          3HD2      LEU  52 -14.900   3.648  -8.423
  426   HD22  LEU  52          1HD2      LEU  52 -15.166   3.445 -10.154
  427   HD23  LEU  52          2HD2      LEU  52 -13.658   4.151  -9.571
  428    H    TYR  53           H        TYR  53 -10.492   0.503 -11.598
  429    HA   TYR  53           HA       TYR  53  -9.252  -1.000  -9.401
  430    HB2  TYR  53           2HB      TYR  53  -8.355  -1.710 -11.462
  431    HB3  TYR  53           1HB      TYR  53  -8.289  -0.074 -12.106
  432    HD1  TYR  53           HD2      TYR  53  -6.675  -2.384  -9.664
  433    HD2  TYR  53           HD1      TYR  53  -6.336   1.245 -11.870
  434    HE1  TYR  53           HE2      TYR  53  -4.308  -2.208  -9.014
  435    HE2  TYR  53           HE1      TYR  53  -3.974   1.428 -11.224
  436    HH   TYR  53           HH       TYR  53  -2.233  -1.124  -9.872
  437    H    SER  54           H        SER  54  -7.776  -0.090  -7.993
  438    HA   SER  54           HA       SER  54  -7.108   2.748  -8.255
  439    HB2  SER  54           2HB      SER  54  -8.313   1.546  -5.745
  440    HB3  SER  54           1HB      SER  54  -7.677   3.184  -5.889
  441    HG   SER  54           HG       SER  54  -9.379   2.939  -7.852
  442    H    ARG  55           H        ARG  55  -5.201   3.367  -7.119
  443    HA   ARG  55           HA       ARG  55  -3.502   1.066  -6.363
  444    HB2  ARG  55           2HB      ARG  55  -2.902   2.029  -8.548
  445    HB3  ARG  55           1HB      ARG  55  -2.690   3.607  -7.801
  446    HG2  ARG  55           2HG      ARG  55  -0.805   2.806  -6.526
  447    HG3  ARG  55           1HG      ARG  55  -1.064   1.160  -7.112
  448    HD2  ARG  55           2HD      ARG  55  -0.333   3.556  -8.806
  449    HD3  ARG  55           1HD      ARG  55   0.757   2.253  -8.327
  450    HE   ARG  55           HE       ARG  55  -1.359   1.034  -9.602
  451   HH11  ARG  55          1HH1      ARG  55   1.018   3.383 -10.462
  452   HH12  ARG  55          2HH1      ARG  55   1.024   2.923 -12.128
  453   HH21  ARG  55          1HH2      ARG  55  -1.334   0.452 -11.739
  454   HH22  ARG  55          2HH2      ARG  55  -0.294   1.283 -12.846
  455    H    ALA  56           H        ALA  56  -2.312   1.193  -4.512
  456    HA   ALA  56           HA       ALA  56  -2.756   3.499  -2.770
  457    HB1  ALA  56           3HB      ALA  56  -1.493   0.824  -2.163
  458    HB2  ALA  56           1HB      ALA  56  -3.174   1.268  -1.864
  459    HB3  ALA  56           2HB      ALA  56  -1.878   2.079  -0.985
  460    H    TYR  57           H        TYR  57  -1.094   4.687  -1.789
  461    HA   TYR  57           HA       TYR  57   1.543   4.487  -3.112
  462    HB2  TYR  57           2HB      TYR  57   0.113   6.997  -2.191
  463    HB3  TYR  57           1HB      TYR  57   1.701   6.937  -2.954
  464    HD1  TYR  57           HD1      TYR  57  -1.924   6.471  -3.512
  465    HD2  TYR  57           HD2      TYR  57   1.917   6.680  -5.342
  466    HE1  TYR  57           HE1      TYR  57  -2.988   6.641  -5.719
  467    HE2  TYR  57           HE2      TYR  57   0.858   6.842  -7.556
  468    HH   TYR  57           HH       TYR  57  -2.360   7.571  -8.008
  469    H    ILE  58           H        ILE  58   3.358   4.602  -1.875
  470    HA   ILE  58           HA       ILE  58   2.993   4.786   1.053
  471    HB   ILE  58           HB       ILE  58   5.038   3.113  -0.438
  472   HG12  ILE  58          2HG1      ILE  58   2.557   2.240   1.076
  473   HG13  ILE  58          1HG1      ILE  58   2.721   2.245  -0.676
  474   HG21  ILE  58          1HG2      ILE  58   5.827   3.892   1.752
  475   HG22  ILE  58          2HG2      ILE  58   5.550   2.150   1.755
  476   HG23  ILE  58          3HG2      ILE  58   4.379   3.232   2.512
  477   HD11  ILE  58          3HD1      ILE  58   4.531   0.594  -0.485
  478   HD12  ILE  58          1HD1      ILE  58   3.007   0.016   0.188
  479   HD13  ILE  58          2HD1      ILE  58   4.293   0.562   1.263
  480    H    ASN  59           H        ASN  59   4.466   5.979   2.238
  481    HA   ASN  59           HA       ASN  59   6.606   7.361   0.749
  482    HB2  ASN  59           2HB      ASN  59   4.698   8.885   1.162
  483    HB3  ASN  59           1HB      ASN  59   4.838   8.582   2.888
  484   HD21  ASN  59          1HD2      ASN  59   5.145  10.827   3.189
  485   HD22  ASN  59          2HD2      ASN  59   6.666  11.575   2.849
  486    H    PHE  60           H        PHE  60   8.500   7.877   1.938
  487    HA   PHE  60           HA       PHE  60   8.862   6.215   4.363
  488    HB2  PHE  60           2HB      PHE  60  10.645   6.594   1.959
  489    HB3  PHE  60           1HB      PHE  60  11.292   6.032   3.496
  490    HD1  PHE  60           HD2      PHE  60   8.574   5.237   1.048
  491    HD2  PHE  60           HD1      PHE  60  11.373   3.783   3.910
  492    HE1  PHE  60           HE2      PHE  60   7.953   2.924   0.482
  493    HE2  PHE  60           HE1      PHE  60  10.763   1.478   3.343
  494    HZ   PHE  60           HZ       PHE  60   9.051   1.042   1.627
  495    H    ARG  61           H        ARG  61  10.925   6.777   5.561
  496    HA   ARG  61           HA       ARG  61  11.475   9.685   5.540
  497    HB2  ARG  61           2HB      ARG  61  11.670   7.765   7.879
  498    HB3  ARG  61           1HB      ARG  61  12.087   9.472   7.924
  499    HG2  ARG  61           2HG      ARG  61   9.333   8.384   7.348
  500    HG3  ARG  61           1HG      ARG  61   9.883   8.977   8.916
  501    HD2  ARG  61           2HD      ARG  61  10.250  11.196   7.959
  502    HD3  ARG  61           1HD      ARG  61   9.756  10.603   6.371
  503    HE   ARG  61           HE       ARG  61   7.620  10.044   7.935
  504   HH11  ARG  61          1HH1      ARG  61   9.444  12.930   7.441
  505   HH12  ARG  61          2HH1      ARG  61   8.069  13.959   7.657
  506   HH21  ARG  61          1HH2      ARG  61   5.877  11.385   8.248
  507   HH22  ARG  61          2HH2      ARG  61   6.087  13.098   8.117
  508    H    ASN  62           H        ASN  62  12.788   6.495   5.283
  509    HA   ASN  62           HA       ASN  62  15.522   7.573   5.095
  510    HB2  ASN  62           2HB      ASN  62  15.086   6.605   7.388
  511    HB3  ASN  62           1HB      ASN  62  14.829   5.046   6.618
  512   HD21  ASN  62          1HD2      ASN  62  16.548   4.078   7.646
  513   HD22  ASN  62          2HD2      ASN  62  18.192   4.454   7.268
  514    HA   PRO  63           HA       PRO  63  15.469   5.066   1.336
  515    HB2  PRO  63           2HB      PRO  63  18.202   5.058   0.927
  516    HB3  PRO  63           1HB      PRO  63  17.119   6.363   0.434
  517    HG2  PRO  63           2HG      PRO  63  18.841   6.154   2.879
  518    HG3  PRO  63           1HG      PRO  63  18.562   7.549   1.820
  519    HD2  PRO  63           2HD      PRO  63  17.319   7.341   4.183
  520    HD3  PRO  63           1HD      PRO  63  16.491   8.022   2.768
  521    H    ASP  64           H        ASP  64  17.364   4.299   4.190
  522    HA   ASP  64           HA       ASP  64  18.046   1.633   3.384
  523    HB2  ASP  64           2HB      ASP  64  17.970   2.880   6.143
  524    HB3  ASP  64           1HB      ASP  64  18.691   1.319   5.750
  525    H    ASP  65           H        ASP  65  15.407   3.071   5.230
  526    HA   ASP  65           HA       ASP  65  14.104   0.734   6.077
  527    HB2  ASP  65           2HB      ASP  65  13.673   3.327   6.524
  528    HB3  ASP  65           1HB      ASP  65  12.534   3.145   5.197
  529    H    ILE  66           H        ILE  66  14.195   2.411   2.998
  530    HA   ILE  66           HA       ILE  66  12.059   1.197   1.664
  531    HB   ILE  66           HB       ILE  66  14.676   2.142   0.471
  532   HG12  ILE  66          2HG1      ILE  66  12.017   3.568   0.808
  533   HG13  ILE  66          1HG1      ILE  66  13.495   3.916   1.701
  534   HG21  ILE  66          1HG2      ILE  66  13.424   2.315  -1.642
  535   HG22  ILE  66          2HG2      ILE  66  12.016   1.594  -0.861
  536   HG23  ILE  66          3HG2      ILE  66  13.495   0.653  -1.056
  537   HD11  ILE  66          3HD1      ILE  66  13.105   5.543  -0.060
  538   HD12  ILE  66          1HD1      ILE  66  13.101   4.260  -1.268
  539   HD13  ILE  66          2HD1      ILE  66  14.575   4.624  -0.371
  540    H    LEU  67           H        LEU  67  15.523   0.308   1.197
  541    HA   LEU  67           HA       LEU  67  14.943  -2.011  -0.262
  542    HB2  LEU  67           2HB      LEU  67  17.300  -2.690   0.206
  543    HB3  LEU  67           1HB      LEU  67  17.109  -1.084  -0.459
  544    HG   LEU  67           HG       LEU  67  17.344  -0.224   1.948
  545   HD11  LEU  67          1HD1      LEU  67  17.006  -2.312   3.141
  546   HD12  LEU  67          2HD1      LEU  67  18.608  -1.660   3.480
  547   HD13  LEU  67          3HD1      LEU  67  18.426  -3.011   2.362
  548   HD21  LEU  67          3HD2      LEU  67  19.066   0.068   0.269
  549   HD22  LEU  67          1HD2      LEU  67  19.680  -1.560   0.578
  550   HD23  LEU  67          2HD2      LEU  67  19.800  -0.318   1.824
  551    H    LEU  68           H        LEU  68  14.865  -1.488   3.137
  552    HA   LEU  68           HA       LEU  68  15.045  -4.132   4.076
  553    HB2  LEU  68           2HB      LEU  68  15.143  -2.235   5.576
  554    HB3  LEU  68           1HB      LEU  68  13.526  -1.737   5.123
  555    HG   LEU  68           HG       LEU  68  12.595  -3.743   6.194
  556   HD11  LEU  68          1HD1      LEU  68  15.449  -4.307   7.028
  557   HD12  LEU  68          2HD1      LEU  68  14.489  -5.256   5.891
  558   HD13  LEU  68          3HD1      LEU  68  14.017  -5.175   7.586
  559   HD21  LEU  68          3HD2      LEU  68  12.779  -1.692   7.489
  560   HD22  LEU  68          1HD2      LEU  68  14.417  -2.122   7.980
  561   HD23  LEU  68          2HD2      LEU  68  13.048  -3.095   8.523
  562    H    PHE  69           H        PHE  69  12.035  -2.228   3.613
  563    HA   PHE  69           HA       PHE  69  10.456  -4.650   3.661
  564    HB2  PHE  69           2HB      PHE  69   9.854  -1.727   3.572
  565    HB3  PHE  69           1HB      PHE  69   8.582  -2.868   3.140
  566    HD1  PHE  69           HD1      PHE  69  11.068  -2.164   5.835
  567    HD2  PHE  69           HD2      PHE  69   7.261  -3.776   4.819
  568    HE1  PHE  69           HE1      PHE  69  10.582  -2.516   8.219
  569    HE2  PHE  69           HE2      PHE  69   6.770  -4.129   7.202
  570    HZ   PHE  69           HZ       PHE  69   8.432  -3.499   8.905
  571    H    ARG  70           H        ARG  70  11.723  -2.587   1.161
  572    HA   ARG  70           HA       ARG  70   9.905  -3.172  -0.905
  573    HB2  ARG  70           2HB      ARG  70  11.631  -1.342  -0.893
  574    HB3  ARG  70           1HB      ARG  70  12.855  -2.557  -1.210
  575    HG2  ARG  70           2HG      ARG  70  10.519  -2.240  -3.067
  576    HG3  ARG  70           1HG      ARG  70  11.901  -1.152  -3.174
  577    HD2  ARG  70           2HD      ARG  70  13.385  -3.058  -3.543
  578    HD3  ARG  70           1HD      ARG  70  12.024  -4.166  -3.384
  579    HE   ARG  70           HE       ARG  70  12.495  -2.309  -5.612
  580   HH11  ARG  70          1HH1      ARG  70  10.804  -4.983  -4.256
  581   HH12  ARG  70          2HH1      ARG  70  10.044  -5.406  -5.751
  582   HH21  ARG  70          1HH2      ARG  70  11.530  -2.873  -7.538
  583   HH22  ARG  70          2HH2      ARG  70  10.445  -4.221  -7.588
  584    H    ASP  71           H        ASP  71  12.705  -4.945   0.279
  585    HA   ASP  71           HA       ASP  71  12.773  -6.778  -1.939
  586    HB2  ASP  71           2HB      ASP  71  14.795  -6.169  -0.648
  587    HB3  ASP  71           1HB      ASP  71  14.117  -6.962   0.769
  588    H    ARG  72           H        ARG  72  11.549  -6.907   1.394
  589    HA   ARG  72           HA       ARG  72  10.878  -9.697   1.265
  590    HB2  ARG  72           2HB      ARG  72   9.763  -9.249   3.482
  591    HB3  ARG  72           1HB      ARG  72  11.474  -8.848   3.405
  592    HG2  ARG  72           2HG      ARG  72  10.896  -6.485   3.082
  593    HG3  ARG  72           1HG      ARG  72   9.185  -6.895   3.196
  594    HD2  ARG  72           2HD      ARG  72  11.173  -7.483   5.385
  595    HD3  ARG  72           1HD      ARG  72  10.259  -5.978   5.295
  596    HE   ARG  72           HE       ARG  72   8.542  -8.244   5.180
  597   HH11  ARG  72          1HH1      ARG  72  10.482  -6.447   7.399
  598   HH12  ARG  72          2HH1      ARG  72   9.414  -6.734   8.728
  599   HH21  ARG  72          1HH2      ARG  72   7.190  -8.612   6.892
  600   HH22  ARG  72          2HH2      ARG  72   7.573  -7.949   8.446
  601    H    PHE  73           H        PHE  73   9.104  -6.727   0.662
  602    HA   PHE  73           HA       PHE  73   6.572  -8.201   0.484
  603    HB2  PHE  73           2HB      PHE  73   7.285  -5.296   0.635
  604    HB3  PHE  73           1HB      PHE  73   5.737  -5.772  -0.047
  605    HD1  PHE  73           HD2      PHE  73   7.794  -5.763   3.010
  606    HD2  PHE  73           HD1      PHE  73   3.981  -6.642   1.337
  607    HE1  PHE  73           HE2      PHE  73   6.851  -5.976   5.272
  608    HE2  PHE  73           HE1      PHE  73   3.033  -6.855   3.596
  609    HZ   PHE  73           HZ       PHE  73   4.468  -6.523   5.567
  610    H    ASP  74           H        ASP  74   9.033  -7.721  -1.563
  611    HA   ASP  74           HA       ASP  74   7.828  -6.799  -3.939
  612    HB2  ASP  74           2HB      ASP  74  10.253  -6.885  -3.692
  613    HB3  ASP  74           1HB      ASP  74  10.206  -8.641  -3.563
  614    H    GLY  75           H        GLY  75   5.803  -7.801  -4.177
  615    HA2  GLY  75           2HA      GLY  75   4.449  -9.242  -5.363
  616    HA3  GLY  75           1HA      GLY  75   5.885 -10.135  -5.833
  617    H    TYR  76           H        TYR  76   4.037  -9.542  -2.807
  618    HA   TYR  76           HA       TYR  76   4.277 -12.438  -2.257
  619    HB2  TYR  76           2HB      TYR  76   4.602 -12.023  -0.047
  620    HB3  TYR  76           1HB      TYR  76   5.136 -10.457  -0.634
  621    HD1  TYR  76           HD1      TYR  76   3.467  -8.515  -0.589
  622    HD2  TYR  76           HD2      TYR  76   2.775 -12.208   1.420
  623    HE1  TYR  76           HE1      TYR  76   1.788  -7.425   0.842
  624    HE2  TYR  76           HE2      TYR  76   1.094 -11.125   2.847
  625    HH   TYR  76           HH       TYR  76  -0.174  -8.051   2.187
  626    H    ILE  77           H        ILE  77   2.442 -13.582  -1.454
  627    HA   ILE  77           HA       ILE  77  -0.069 -12.505  -2.518
  628    HB   ILE  77           HB       ILE  77   0.647 -15.313  -1.651
  629   HG12  ILE  77          2HG1      ILE  77   1.821 -14.572  -3.690
  630   HG13  ILE  77          1HG1      ILE  77   0.646 -15.832  -4.045
  631   HG21  ILE  77          1HG2      ILE  77  -1.722 -14.957  -1.340
  632   HG22  ILE  77          2HG2      ILE  77  -1.469 -15.969  -2.762
  633   HG23  ILE  77          3HG2      ILE  77  -1.869 -14.260  -2.956
  634   HD11  ILE  77          3HD1      ILE  77  -0.918 -14.120  -4.849
  635   HD12  ILE  77          1HD1      ILE  77   0.598 -14.129  -5.747
  636   HD13  ILE  77          2HD1      ILE  77   0.301 -12.885  -4.534
  637    H    PHE  78           H        PHE  78  -1.253 -11.380  -1.088
  638    HA   PHE  78           HA       PHE  78  -1.611 -12.391   1.652
  639    HB2  PHE  78           2HB      PHE  78  -1.175  -9.974   1.364
  640    HB3  PHE  78           1HB      PHE  78  -2.608  -9.835   0.351
  641    HD1  PHE  78           HD1      PHE  78  -1.517 -10.791   3.782
  642    HD2  PHE  78           HD2      PHE  78  -4.670  -9.327   1.321
  643    HE1  PHE  78           HE1      PHE  78  -2.868 -10.336   5.787
  644    HE2  PHE  78           HE2      PHE  78  -6.023  -8.870   3.324
  645    HZ   PHE  78           HZ       PHE  78  -5.125  -9.372   5.562
  646    H    LEU  79           H        LEU  79  -3.519 -13.351   2.324
  647    HA   LEU  79           HA       LEU  79  -5.486 -13.845   0.180
  648    HB2  LEU  79           2HB      LEU  79  -4.622 -15.544   2.509
  649    HB3  LEU  79           1HB      LEU  79  -6.033 -15.916   1.533
  650    HG   LEU  79           HG       LEU  79  -3.225 -15.686   0.431
  651   HD11  LEU  79          1HD1      LEU  79  -3.298 -18.139   0.268
  652   HD12  LEU  79          2HD1      LEU  79  -4.826 -18.142   1.148
  653   HD13  LEU  79          3HD1      LEU  79  -3.354 -17.579   1.939
  654   HD21  LEU  79          3HD2      LEU  79  -4.184 -16.747  -1.555
  655   HD22  LEU  79          1HD2      LEU  79  -4.964 -15.203  -1.206
  656   HD23  LEU  79          2HD2      LEU  79  -5.781 -16.716  -0.804
  657    H    ASP  80           H        ASP  80  -7.474 -13.170   0.375
  658    HA   ASP  80           HA       ASP  80  -8.533 -12.084   2.839
  659    HB2  ASP  80           2HB      ASP  80  -9.083 -10.890   0.850
  660    HB3  ASP  80           1HB      ASP  80  -9.587 -12.355   0.016
  661    H    SER  81           H        SER  81 -10.912 -12.701   3.361
  662    HA   SER  81           HA       SER  81 -11.206 -15.244   4.374
  663    HB2  SER  81           2HB      SER  81 -13.504 -13.570   3.323
  664    HB3  SER  81           1HB      SER  81 -13.554 -14.746   4.638
  665    HG   SER  81           HG       SER  81 -12.286 -12.202   4.588
  666    H    LYS  82           H        LYS  82 -12.315 -14.064   1.200
  667    HA   LYS  82           HA       LYS  82 -13.469 -16.545   0.365
  668    HB2  LYS  82           2HB      LYS  82 -12.732 -13.978  -1.012
  669    HB3  LYS  82           1HB      LYS  82 -13.221 -15.371  -1.964
  670    HG2  LYS  82           2HG      LYS  82 -14.917 -14.264   0.264
  671    HG3  LYS  82           1HG      LYS  82 -15.023 -13.684  -1.401
  672    HD2  LYS  82           2HD      LYS  82 -15.494 -16.008  -2.138
  673    HD3  LYS  82           1HD      LYS  82 -15.480 -16.519  -0.449
  674    HE2  LYS  82           2HE      LYS  82 -17.349 -14.439  -1.587
  675    HE3  LYS  82           1HE      LYS  82 -17.760 -16.142  -1.387
  676    HZ1  LYS  82           3HZ      LYS  82 -16.996 -14.291   0.807
  677    HZ2  LYS  82           1HZ      LYS  82 -17.411 -15.921   0.984
  678    HZ3  LYS  82           2HZ      LYS  82 -18.565 -14.806   0.453
  679    H    GLY  83           H        GLY  83 -10.249 -15.650   0.704
  680    HA2  GLY  83           2HA      GLY  83  -8.331 -16.849   0.103
  681    HA3  GLY  83           1HA      GLY  83  -9.298 -17.802  -1.015
  682    H    LEU  84           H        LEU  84  -9.483 -14.332  -1.039
  683    HA   LEU  84           HA       LEU  84  -8.746 -14.168  -3.784
  684    HB2  LEU  84           2HB      LEU  84  -9.058 -11.945  -1.759
  685    HB3  LEU  84           1HB      LEU  84  -8.991 -11.743  -3.501
  686    HG   LEU  84           HG       LEU  84 -11.177 -13.156  -1.960
  687   HD11  LEU  84          1HD1      LEU  84 -11.267 -10.741  -1.700
  688   HD12  LEU  84          2HD1      LEU  84 -12.592 -11.302  -2.719
  689   HD13  LEU  84          3HD1      LEU  84 -11.184 -10.529  -3.450
  690   HD21  LEU  84          3HD2      LEU  84 -10.828 -14.224  -4.117
  691   HD22  LEU  84          1HD2      LEU  84 -10.913 -12.659  -4.928
  692   HD23  LEU  84          2HD2      LEU  84 -12.337 -13.311  -4.118
  693    H    GLU  85           H        GLU  85  -6.689 -14.560  -4.361
  694    HA   GLU  85           HA       GLU  85  -4.393 -13.935  -2.831
  695    HB2  GLU  85           2HB      GLU  85  -4.626 -14.463  -5.802
  696    HB3  GLU  85           1HB      GLU  85  -3.130 -14.482  -4.879
  697    HG2  GLU  85           2HG      GLU  85  -3.964 -16.376  -3.571
  698    HG3  GLU  85           1HG      GLU  85  -5.459 -16.361  -4.506
  699    H    TYR  86           H        TYR  86  -3.918 -11.866  -2.325
  700    HA   TYR  86           HA       TYR  86  -3.928  -9.811  -4.416
  701    HB2  TYR  86           2HB      TYR  86  -3.387  -9.590  -1.439
  702    HB3  TYR  86           1HB      TYR  86  -3.410  -8.238  -2.563
  703    HD1  TYR  86           HD1      TYR  86  -5.628  -7.887  -3.891
  704    HD2  TYR  86           HD2      TYR  86  -5.352 -10.181  -0.315
  705    HE1  TYR  86           HE1      TYR  86  -8.042  -7.603  -3.531
  706    HE2  TYR  86           HE2      TYR  86  -7.767  -9.906   0.053
  707    HH   TYR  86           HH       TYR  86  -9.883  -8.832  -2.303
  708    HA   PRO  87           HA       PRO  87   0.465 -11.022  -4.657
  709    HB2  PRO  87           2HB      PRO  87   0.806 -10.573  -7.274
  710    HB3  PRO  87           1HB      PRO  87  -0.130 -11.960  -6.703
  711    HG2  PRO  87           2HG      PRO  87  -1.091  -9.339  -7.784
  712    HG3  PRO  87           1HG      PRO  87  -1.717 -10.971  -8.083
  713    HD2  PRO  87           2HD      PRO  87  -2.789  -9.160  -6.265
  714    HD3  PRO  87           1HD      PRO  87  -3.044 -10.915  -6.223
  715    H    ALA  88           H        ALA  88   0.391  -8.860  -3.287
  716    HA   ALA  88           HA       ALA  88   0.627  -6.342  -4.507
  717    HB1  ALA  88           3HB      ALA  88  -0.031  -6.646  -2.184
  718    HB2  ALA  88           1HB      ALA  88   1.348  -5.556  -2.307
  719    HB3  ALA  88           2HB      ALA  88   1.587  -7.225  -1.787
  720    H    VAL  89           H        VAL  89   2.213  -5.592  -5.765
  721    HA   VAL  89           HA       VAL  89   5.000  -6.414  -5.221
  722    HB   VAL  89           HB       VAL  89   3.829  -5.192  -7.731
  723   HG11  VAL  89          1HG1      VAL  89   6.664  -6.075  -7.143
  724   HG12  VAL  89          2HG1      VAL  89   6.116  -4.416  -7.389
  725   HG13  VAL  89          3HG1      VAL  89   6.058  -5.571  -8.720
  726   HG21  VAL  89          3HG2      VAL  89   3.200  -7.527  -7.442
  727   HG22  VAL  89          1HG2      VAL  89   4.889  -7.970  -7.186
  728   HG23  VAL  89          2HG2      VAL  89   4.364  -7.362  -8.756
  729    H    VAL  90           H        VAL  90   6.221  -5.000  -4.173
  730    HA   VAL  90           HA       VAL  90   5.532  -2.161  -4.139
  731    HB   VAL  90           HB       VAL  90   5.977  -3.172  -1.990
  732   HG11  VAL  90          1HG1      VAL  90   8.171  -4.111  -1.407
  733   HG12  VAL  90          2HG1      VAL  90   8.695  -3.911  -3.079
  734   HG13  VAL  90          3HG1      VAL  90   7.384  -5.026  -2.694
  735   HG21  VAL  90          3HG2      VAL  90   8.274  -1.380  -2.790
  736   HG22  VAL  90          1HG2      VAL  90   7.730  -1.688  -1.140
  737   HG23  VAL  90          2HG2      VAL  90   6.675  -0.846  -2.275
  738    H    GLU  91           H        GLU  91   6.607  -0.651  -5.333
  739    HA   GLU  91           HA       GLU  91   9.374  -1.178  -6.159
  740    HB2  GLU  91           2HB      GLU  91   8.981  -0.567  -8.476
  741    HB3  GLU  91           1HB      GLU  91   7.984  -1.949  -8.045
  742    HG2  GLU  91           2HG      GLU  91   6.018  -0.729  -8.122
  743    HG3  GLU  91           1HG      GLU  91   6.838   0.809  -7.871
  744    H    PHE  92           H        PHE  92  10.282   0.828  -7.345
  745    HA   PHE  92           HA       PHE  92   9.897   3.095  -5.607
  746    HB2  PHE  92           2HB      PHE  92  11.646   2.792  -8.062
  747    HB3  PHE  92           1HB      PHE  92  11.729   4.117  -6.904
  748    HD1  PHE  92           HD1      PHE  92  12.695   3.784  -4.696
  749    HD2  PHE  92           HD2      PHE  92  12.500   0.589  -7.516
  750    HE1  PHE  92           HE1      PHE  92  14.296   2.495  -3.351
  751    HE2  PHE  92           HE2      PHE  92  14.103  -0.699  -6.166
  752    HZ   PHE  92           HZ       PHE  92  15.004   0.252  -4.080
  753    H    ALA  93           H        ALA  93   8.713   4.871  -5.973
  754    HA   ALA  93           HA       ALA  93   6.905   4.952  -8.200
  755    HB1  ALA  93           3HB      ALA  93   6.277   5.677  -5.922
  756    HB2  ALA  93           1HB      ALA  93   5.986   6.926  -7.134
  757    HB3  ALA  93           2HB      ALA  93   7.387   7.037  -6.070
  758    HA   PRO  94           HA       PRO  94   9.179   7.495 -11.126
  759    HB2  PRO  94           2HB      PRO  94   6.539   8.840 -11.513
  760    HB3  PRO  94           1HB      PRO  94   7.636   8.149 -12.715
  761    HG2  PRO  94           2HG      PRO  94   5.407   6.864 -12.028
  762    HG3  PRO  94           1HG      PRO  94   6.912   5.972 -12.320
  763    HD2  PRO  94           2HD      PRO  94   5.593   6.675  -9.725
  764    HD3  PRO  94           1HD      PRO  94   6.464   5.197 -10.183
  765    H    PHE  95           H        PHE  95  10.488   8.774  -9.884
  766    HA   PHE  95           HA       PHE  95   9.585  10.490  -7.852
  767    HB2  PHE  95           2HB      PHE  95  12.271  10.517  -9.244
  768    HB3  PHE  95           1HB      PHE  95  11.909  11.207  -7.663
  769    HD1  PHE  95           HD2      PHE  95  11.020   9.581  -5.861
  770    HD2  PHE  95           HD1      PHE  95  13.016   8.317  -9.403
  771    HE1  PHE  95           HE2      PHE  95  11.523   7.415  -4.806
  772    HE2  PHE  95           HE1      PHE  95  13.517   6.151  -8.353
  773    HZ   PHE  95           HZ       PHE  95  12.770   5.698  -6.054
  774    H    GLN  96           H        GLN  96   9.120  12.593  -7.742
  775    HA   GLN  96           HA       GLN  96   9.676  14.361 -10.007
  776    HB2  GLN  96           2HB      GLN  96   7.435  13.545 -10.456
  777    HB3  GLN  96           1HB      GLN  96   6.928  13.916  -8.816
  778    HG2  GLN  96           2HG      GLN  96   6.098  15.543 -10.456
  779    HG3  GLN  96           1HG      GLN  96   7.124  16.282  -9.232
  780   HE21  GLN  96          1HE2      GLN  96   9.066  17.188  -9.839
  781   HE22  GLN  96          2HE2      GLN  96   9.529  17.407 -11.489
  782    H    LYS  97           H        LYS  97  10.870  15.896  -9.108
  783    HA   LYS  97           HA       LYS  97  10.728  16.702  -6.388
  784    HB2  LYS  97           2HB      LYS  97  12.742  16.850  -7.894
  785    HB3  LYS  97           1HB      LYS  97  11.977  18.198  -8.711
  786    HG2  LYS  97           2HG      LYS  97  12.524  18.251  -5.758
  787    HG3  LYS  97           1HG      LYS  97  13.755  18.695  -6.933
  788    HD2  LYS  97           2HD      LYS  97  11.040  20.010  -6.703
  789    HD3  LYS  97           1HD      LYS  97  12.518  20.635  -5.982
  790    HE2  LYS  97           2HE      LYS  97  12.155  21.828  -8.013
  791    HE3  LYS  97           1HE      LYS  97  13.507  20.733  -8.283
  792    HZ1  LYS  97           3HZ      LYS  97  12.114  19.277  -9.517
  793    HZ2  LYS  97           1HZ      LYS  97  11.861  20.834 -10.118
  794    HZ3  LYS  97           2HZ      LYS  97  10.717  20.129  -9.096
  Start of MODEL    2
    1    H1   MET   1           1H       MET   1  29.600  22.095  14.359
    2    H2   MET   1           2H       MET   1  28.244  22.804  15.082
    3    H3   MET   1           3H       MET   1  29.707  23.645  15.031
    4    HA   MET   1           HA       MET   1  28.167  24.509  13.396
    5    HB2  MET   1           2HB      MET   1  30.497  22.983  12.198
    6    HB3  MET   1           1HB      MET   1  29.635  24.291  11.400
    7    HG2  MET   1           2HG      MET   1  30.358  25.839  13.148
    8    HG3  MET   1           1HG      MET   1  31.219  24.527  13.954
    9    HE1  MET   1           3HE      MET   1  33.445  25.957  13.967
   10    HE2  MET   1           1HE      MET   1  32.627  27.290  13.155
   11    HE3  MET   1           2HE      MET   1  34.157  26.682  12.527
   12    H    GLY   2           H        GLY   2  26.419  24.096  12.159
   13    HA2  GLY   2           2HA      GLY   2  25.495  21.419  11.798
   14    HA3  GLY   2           1HA      GLY   2  24.738  22.873  11.171
   15    H    HIS   3           H        HIS   3  25.713  20.045  10.144
   16    HA   HIS   3           HA       HIS   3  26.992  21.018   7.667
   17    HB2  HIS   3           2HB      HIS   3  26.949  18.253   8.905
   18    HB3  HIS   3           1HB      HIS   3  27.643  18.620   7.329
   19    HD1  HIS   3           HD1      HIS   3  28.223  19.188  11.009
   20    HD2  HIS   3           HD2      HIS   3  30.151  19.816   7.380
   21    HE1  HIS   3           HE1      HIS   3  30.576  19.827  11.599
   22    HE2  HIS   3           HE2      HIS   3  31.736  20.169   9.396
   23    H    HIS   4           H        HIS   4  25.584  21.366   6.081
   24    HA   HIS   4           HA       HIS   4  23.020  20.007   5.975
   25    HB2  HIS   4           2HB      HIS   4  22.635  21.515   3.989
   26    HB3  HIS   4           1HB      HIS   4  22.990  22.351   5.495
   27    HD1  HIS   4           HD1      HIS   4  24.887  23.984   5.463
   28    HD2  HIS   4           HD2      HIS   4  24.922  21.463   2.156
   29    HE1  HIS   4           HE1      HIS   4  26.668  24.883   3.950
   30    HE2  HIS   4           HE2      HIS   4  26.769  23.265   2.029
   31    H    HIS   5           H        HIS   5  24.982  18.136   5.669
   32    HA   HIS   5           HA       HIS   5  25.244  17.579   2.787
   33    HB2  HIS   5           2HB      HIS   5  27.268  17.662   4.339
   34    HB3  HIS   5           1HB      HIS   5  26.659  16.186   5.073
   35    HD1  HIS   5           HD1      HIS   5  26.872  14.004   3.688
   36    HD2  HIS   5           HD2      HIS   5  28.427  17.368   1.816
   37    HE1  HIS   5           HE1      HIS   5  28.237  13.133   1.774
   38    HE2  HIS   5           HE2      HIS   5  29.271  15.177   0.737
   39    H    HIS   6           H        HIS   6  22.691  17.122   3.702
   40    HA   HIS   6           HA       HIS   6  22.548  14.178   3.882
   41    HB2  HIS   6           2HB      HIS   6  20.726  14.288   5.470
   42    HB3  HIS   6           1HB      HIS   6  22.102  15.180   6.107
   43    HD1  HIS   6           HD1      HIS   6  18.562  15.453   5.659
   44    HD2  HIS   6           HD2      HIS   6  21.744  18.126   5.628
   45    HE1  HIS   6           HE1      HIS   6  17.540  17.721   6.006
   46    HE2  HIS   6           HE2      HIS   6  19.467  19.332   5.843
   47    H    HIS   7           H        HIS   7  21.061  13.177   2.630
   48    HA   HIS   7           HA       HIS   7  19.596  14.825   0.702
   49    HB2  HIS   7           2HB      HIS   7  20.217  11.863   0.771
   50    HB3  HIS   7           1HB      HIS   7  19.241  12.627  -0.477
   51    HD1  HIS   7           HD1      HIS   7  20.462  13.966  -2.283
   52    HD2  HIS   7           HD2      HIS   7  22.984  12.458   0.656
   53    HE1  HIS   7           HE1      HIS   7  22.785  14.267  -3.171
   54    HE2  HIS   7           HE2      HIS   7  24.294  13.537  -1.298
   55    H    HIS   8           H        HIS   8  17.526  13.364  -0.083
   56    HA   HIS   8           HA       HIS   8  15.840  12.982   2.316
   57    HB2  HIS   8           2HB      HIS   8  15.071  13.909  -0.466
   58    HB3  HIS   8           1HB      HIS   8  13.909  13.508   0.794
   59    HD1  HIS   8           HD1      HIS   8  13.090  15.475   2.027
   60    HD2  HIS   8           HD2      HIS   8  16.919  16.097   0.543
   61    HE1  HIS   8           HE1      HIS   8  13.680  17.831   2.656
   62    HE2  HIS   8           HE2      HIS   8  16.047  18.138   1.870
   63    H    SER   9           H        SER   9  13.771  11.609   1.534
   64    HA   SER   9           HA       SER   9  14.844   9.023   0.780
   65    HB2  SER   9           2HB      SER   9  12.596   8.166   1.330
   66    HB3  SER   9           1HB      SER   9  13.252   9.154   2.635
   67    HG   SER   9           HG       SER   9  10.936   9.446   1.546
   68    H    HIS  10           H        HIS  10  13.768   7.646  -0.824
   69    HA   HIS  10           HA       HIS  10  12.845   9.191  -3.161
   70    HB2  HIS  10           2HB      HIS  10  14.179   6.477  -2.964
   71    HB3  HIS  10           1HB      HIS  10  13.491   7.112  -4.454
   72    HD1  HIS  10           HD1      HIS  10  15.848   7.075  -5.557
   73    HD2  HIS  10           HD2      HIS  10  15.560   9.587  -2.257
   74    HE1  HIS  10           HE1      HIS  10  17.905   8.509  -5.618
   75    HE2  HIS  10           HE2      HIS  10  17.662  10.088  -3.676
   76    H    MET  11           H        MET  11  10.889   8.751  -4.099
   77    HA   MET  11           HA       MET  11   8.921   7.529  -2.460
   78    HB2  MET  11           2HB      MET  11   7.380   7.988  -4.403
   79    HB3  MET  11           1HB      MET  11   8.224   9.381  -3.745
   80    HG2  MET  11           2HG      MET  11   9.102   7.884  -6.210
   81    HG3  MET  11           1HG      MET  11   8.092   9.329  -6.227
   82    HE1  MET  11           3HE      MET  11   9.294  11.095  -3.910
   83    HE2  MET  11           1HE      MET  11   8.919  11.739  -5.508
   84    HE3  MET  11           2HE      MET  11  10.496  12.051  -4.780
   85    H    VAL  12           H        VAL  12   8.584   5.448  -2.222
   86    HA   VAL  12           HA       VAL  12   8.727   3.659  -4.569
   87    HB   VAL  12           HB       VAL  12   9.239   2.939  -1.668
   88   HG11  VAL  12          1HG1      VAL  12   9.436   1.237  -4.159
   89   HG12  VAL  12          2HG1      VAL  12   8.208   1.095  -2.899
   90   HG13  VAL  12          3HG1      VAL  12   9.895   0.740  -2.529
   91   HG21  VAL  12          3HG2      VAL  12  11.564   2.530  -2.425
   92   HG22  VAL  12          1HG2      VAL  12  11.087   4.224  -2.559
   93   HG23  VAL  12          2HG2      VAL  12  11.143   3.209  -3.998
   94    H    VAL  13           H        VAL  13   6.830   2.763  -5.135
   95    HA   VAL  13           HA       VAL  13   4.560   3.040  -3.269
   96    HB   VAL  13           HB       VAL  13   3.101   3.220  -5.224
   97   HG11  VAL  13          1HG1      VAL  13   3.988   5.268  -4.275
   98   HG12  VAL  13          2HG1      VAL  13   3.863   5.427  -6.028
   99   HG13  VAL  13          3HG1      VAL  13   5.433   5.138  -5.278
  100   HG21  VAL  13          3HG2      VAL  13   5.646   3.092  -6.863
  101   HG22  VAL  13          1HG2      VAL  13   4.032   3.434  -7.488
  102   HG23  VAL  13          2HG2      VAL  13   4.392   1.851  -6.797
  103    H    ILE  14           H        ILE  14   2.635   1.590  -4.341
  104    HA   ILE  14           HA       ILE  14   3.657  -1.180  -4.299
  105    HB   ILE  14           HB       ILE  14   2.286  -0.559  -2.349
  106   HG12  ILE  14          2HG1      ILE  14   0.594  -2.415  -2.533
  107   HG13  ILE  14          1HG1      ILE  14   1.026  -2.569  -4.234
  108   HG21  ILE  14          1HG2      ILE  14   0.075  -0.069  -4.349
  109   HG22  ILE  14          2HG2      ILE  14   0.878   1.143  -3.349
  110   HG23  ILE  14          3HG2      ILE  14  -0.115  -0.103  -2.595
  111   HD11  ILE  14          3HD1      ILE  14   2.867  -2.976  -1.887
  112   HD12  ILE  14          1HD1      ILE  14   3.326  -3.106  -3.585
  113   HD13  ILE  14          2HD1      ILE  14   2.159  -4.232  -2.899
  114    H    ARG  15           H        ARG  15   2.696  -2.727  -5.692
  115    HA   ARG  15           HA       ARG  15   1.205  -1.625  -7.993
  116    HB2  ARG  15           2HB      ARG  15   3.802  -2.853  -7.918
  117    HB3  ARG  15           1HB      ARG  15   2.718  -3.900  -8.818
  118    HG2  ARG  15           2HG      ARG  15   3.875  -2.393 -10.306
  119    HG3  ARG  15           1HG      ARG  15   2.147  -2.040 -10.300
  120    HD2  ARG  15           2HD      ARG  15   2.468  -0.100  -8.946
  121    HD3  ARG  15           1HD      ARG  15   4.151  -0.526  -8.629
  122    HE   ARG  15           HE       ARG  15   4.167  -0.290 -11.279
  123   HH11  ARG  15          1HH1      ARG  15   2.824   1.783  -8.877
  124   HH12  ARG  15          2HH1      ARG  15   3.100   3.213  -9.806
  125   HH21  ARG  15          1HH2      ARG  15   4.520   1.518 -12.451
  126   HH22  ARG  15          2HH2      ARG  15   4.029   3.060 -11.839
  127    H    ARG  16           H        ARG  16  -0.169  -3.105  -9.122
  128    HA   ARG  16           HA       ARG  16  -1.779  -4.680  -9.317
  129    HB2  ARG  16           2HB      ARG  16   0.112  -6.329  -7.629
  130    HB3  ARG  16           1HB      ARG  16  -1.325  -6.964  -8.421
  131    HG2  ARG  16           2HG      ARG  16  -0.370  -6.302 -10.606
  132    HG3  ARG  16           1HG      ARG  16   1.093  -5.772  -9.772
  133    HD2  ARG  16           2HD      ARG  16   1.486  -8.038  -8.971
  134    HD3  ARG  16           1HD      ARG  16  -0.018  -8.582  -9.716
  135    HE   ARG  16           HE       ARG  16   1.922  -7.386 -11.506
  136   HH11  ARG  16          1HH1      ARG  16   0.705 -10.318 -10.153
  137   HH12  ARG  16          2HH1      ARG  16   1.290 -11.280 -11.459
  138   HH21  ARG  16          1HH2      ARG  16   2.661  -8.641 -13.160
  139   HH22  ARG  16          2HH2      ARG  16   2.382 -10.346 -13.141
  140    H    LEU  17           H        LEU  17  -3.136  -3.211  -8.051
  141    HA   LEU  17           HA       LEU  17  -3.884  -4.360  -5.432
  142    HB2  LEU  17           2HB      LEU  17  -3.961  -1.528  -6.436
  143    HB3  LEU  17           1HB      LEU  17  -5.031  -2.037  -5.145
  144    HG   LEU  17           HG       LEU  17  -3.099  -0.960  -4.192
  145   HD11  LEU  17          1HD1      LEU  17  -2.279  -2.716  -2.703
  146   HD12  LEU  17          2HD1      LEU  17  -2.941  -3.944  -3.782
  147   HD13  LEU  17          3HD1      LEU  17  -4.023  -2.833  -2.941
  148   HD21  LEU  17          3HD2      LEU  17  -1.424  -3.007  -5.648
  149   HD22  LEU  17          1HD2      LEU  17  -0.831  -1.817  -4.491
  150   HD23  LEU  17          2HD2      LEU  17  -1.520  -1.286  -6.025
  151    HA   PRO  18           HA       PRO  18  -7.612  -5.316  -7.926
  152    HB2  PRO  18           2HB      PRO  18  -7.965  -7.379  -5.847
  153    HB3  PRO  18           1HB      PRO  18  -7.864  -7.564  -7.601
  154    HG2  PRO  18           2HG      PRO  18  -5.880  -8.379  -5.970
  155    HG3  PRO  18           1HG      PRO  18  -5.553  -7.721  -7.586
  156    HD2  PRO  18           2HD      PRO  18  -5.354  -6.364  -4.908
  157    HD3  PRO  18           1HD      PRO  18  -4.232  -6.302  -6.287
  158    HA   PRO  19           HA       PRO  19 -10.135  -2.862  -5.120
  159    HB2  PRO  19           2HB      PRO  19 -12.503  -3.111  -6.482
  160    HB3  PRO  19           1HB      PRO  19 -11.217  -1.995  -6.952
  161    HG2  PRO  19           2HG      PRO  19 -11.839  -4.729  -8.027
  162    HG3  PRO  19           1HG      PRO  19 -11.425  -3.249  -8.914
  163    HD2  PRO  19           2HD      PRO  19  -9.604  -5.173  -8.468
  164    HD3  PRO  19           1HD      PRO  19  -9.156  -3.453  -8.446
  165    H    GLY  20           H        GLY  20  -9.944  -4.452  -3.388
  166    HA2  GLY  20           2HA      GLY  20 -12.406  -6.053  -3.074
  167    HA3  GLY  20           1HA      GLY  20 -10.839  -6.790  -2.798
  168    H    LEU  21           H        LEU  21  -9.646  -6.212  -0.948
  169    HA   LEU  21           HA       LEU  21 -11.238  -5.892   1.349
  170    HB2  LEU  21           2HB      LEU  21  -9.266  -6.151   2.622
  171    HB3  LEU  21           1HB      LEU  21  -9.083  -7.161   1.203
  172    HG   LEU  21           HG       LEU  21  -7.747  -4.483   1.668
  173   HD11  LEU  21          1HD1      LEU  21  -6.814  -6.254   3.041
  174   HD12  LEU  21          2HD1      LEU  21  -5.681  -5.801   1.767
  175   HD13  LEU  21          3HD1      LEU  21  -6.625  -7.287   1.622
  176   HD21  LEU  21          3HD2      LEU  21  -6.508  -4.903  -0.388
  177   HD22  LEU  21          1HD2      LEU  21  -8.238  -4.827  -0.716
  178   HD23  LEU  21          2HD2      LEU  21  -7.419  -6.388  -0.659
  179    H    THR  22           H        THR  22 -10.880  -4.337   3.107
  180    HA   THR  22           HA       THR  22 -11.000  -1.595   2.117
  181    HB   THR  22           HB       THR  22 -11.401  -2.569   4.965
  182    HG1  THR  22           HG1      THR  22 -13.516  -2.073   3.137
  183   HG21  THR  22          3HG2      THR  22 -11.095  -0.143   4.738
  184   HG22  THR  22          1HG2      THR  22 -12.744  -0.538   5.221
  185   HG23  THR  22          2HG2      THR  22 -12.399  -0.086   3.550
  186    H    LYS  23           H        LYS  23  -9.769   0.145   3.218
  187    HA   LYS  23           HA       LYS  23  -7.057  -0.271   3.317
  188    HB2  LYS  23           2HB      LYS  23  -6.850   1.878   4.517
  189    HB3  LYS  23           1HB      LYS  23  -7.896   1.952   3.109
  190    HG2  LYS  23           2HG      LYS  23  -9.836   2.152   4.409
  191    HG3  LYS  23           1HG      LYS  23  -9.024   1.581   5.870
  192    HD2  LYS  23           2HD      LYS  23  -9.469   4.057   5.808
  193    HD3  LYS  23           1HD      LYS  23  -7.782   3.614   6.074
  194    HE2  LYS  23           2HE      LYS  23  -7.332   4.001   3.671
  195    HE3  LYS  23           1HE      LYS  23  -9.009   4.506   3.458
  196    HZ1  LYS  23           3HZ      LYS  23  -7.093   5.830   5.297
  197    HZ2  LYS  23           1HZ      LYS  23  -8.643   6.363   4.893
  198    HZ3  LYS  23           2HZ      LYS  23  -7.419   6.363   3.726
  199    H    GLU  24           H        GLU  24  -9.314  -0.955   5.870
  200    HA   GLU  24           HA       GLU  24  -7.686  -0.848   8.117
  201    HB2  GLU  24           2HB      GLU  24  -9.873  -2.848   7.511
  202    HB3  GLU  24           1HB      GLU  24  -9.212  -2.517   9.110
  203    HG2  GLU  24           2HG      GLU  24 -10.006  -0.214   8.972
  204    HG3  GLU  24           1HG      GLU  24 -10.652  -0.525   7.362
  205    H    GLN  25           H        GLN  25  -8.238  -3.730   6.044
  206    HA   GLN  25           HA       GLN  25  -5.947  -5.094   7.235
  207    HB2  GLN  25           2HB      GLN  25  -7.729  -5.936   4.930
  208    HB3  GLN  25           1HB      GLN  25  -6.546  -6.955   5.738
  209    HG2  GLN  25           2HG      GLN  25  -7.832  -6.861   7.796
  210    HG3  GLN  25           1HG      GLN  25  -8.987  -5.762   7.039
  211   HE21  GLN  25          1HE2      GLN  25 -10.424  -6.572   5.499
  212   HE22  GLN  25          2HE2      GLN  25 -10.722  -8.262   5.319
  213    H    LEU  26           H        LEU  26  -6.677  -3.192   4.462
  214    HA   LEU  26           HA       LEU  26  -4.643  -4.156   2.723
  215    HB2  LEU  26           2HB      LEU  26  -6.521  -3.172   1.731
  216    HB3  LEU  26           1HB      LEU  26  -6.439  -1.762   2.758
  217    HG   LEU  26           HG       LEU  26  -4.280  -1.161   1.538
  218   HD11  LEU  26          1HD1      LEU  26  -5.284  -3.272  -0.368
  219   HD12  LEU  26          2HD1      LEU  26  -3.795  -3.338   0.576
  220   HD13  LEU  26          3HD1      LEU  26  -3.981  -2.127  -0.691
  221   HD21  LEU  26          3HD2      LEU  26  -6.866  -1.223  -0.013
  222   HD22  LEU  26          1HD2      LEU  26  -5.482  -0.186  -0.364
  223   HD23  LEU  26          2HD2      LEU  26  -6.370   0.011   1.147
  224    H    GLU  27           H        GLU  27  -4.826  -1.207   4.759
  225    HA   GLU  27           HA       GLU  27  -2.331  -0.213   3.808
  226    HB2  GLU  27           2HB      GLU  27  -2.556   1.565   5.365
  227    HB3  GLU  27           1HB      GLU  27  -4.168   1.210   4.760
  228    HG2  GLU  27           2HG      GLU  27  -4.649  -0.043   6.822
  229    HG3  GLU  27           1HG      GLU  27  -3.036   0.349   7.420
  230    H    GLU  28           H        GLU  28  -3.238  -2.148   6.632
  231    HA   GLU  28           HA       GLU  28  -0.963  -1.784   8.187
  232    HB2  GLU  28           2HB      GLU  28  -1.493  -3.882   9.286
  233    HB3  GLU  28           1HB      GLU  28  -2.964  -2.967   8.984
  234    HG2  GLU  28           2HG      GLU  28  -3.675  -4.424   7.305
  235    HG3  GLU  28           1HG      GLU  28  -2.069  -5.124   7.099
  236    H    GLN  29           H        GLN  29  -1.382  -3.804   5.351
  237    HA   GLN  29           HA       GLN  29   1.217  -5.080   5.700
  238    HB2  GLN  29           2HB      GLN  29   0.654  -6.378   3.731
  239    HB3  GLN  29           1HB      GLN  29  -0.718  -6.370   4.832
  240    HG2  GLN  29           2HG      GLN  29  -1.657  -4.480   3.422
  241    HG3  GLN  29           1HG      GLN  29  -0.399  -4.861   2.252
  242   HE21  GLN  29          1HE2      GLN  29  -3.315  -5.966   3.782
  243   HE22  GLN  29          2HE2      GLN  29  -3.648  -7.233   2.666
  244    H    LEU  30           H        LEU  30  -0.099  -2.320   4.110
  245    HA   LEU  30           HA       LEU  30   2.127  -2.146   2.217
  246    HB2  LEU  30           2HB      LEU  30  -0.300  -0.376   2.539
  247    HB3  LEU  30           1HB      LEU  30   0.920  -0.204   1.287
  248    HG   LEU  30           HG       LEU  30  -1.047  -2.475   1.629
  249   HD11  LEU  30          1HD1      LEU  30  -1.967  -0.476   0.589
  250   HD12  LEU  30          2HD1      LEU  30  -1.818  -1.781  -0.589
  251   HD13  LEU  30          3HD1      LEU  30  -0.649  -0.461  -0.585
  252   HD21  LEU  30          3HD2      LEU  30  -0.038  -3.467  -0.378
  253   HD22  LEU  30          1HD2      LEU  30   1.101  -3.415   0.968
  254   HD23  LEU  30          2HD2      LEU  30   1.230  -2.243  -0.345
  255    H    ARG  31           H        ARG  31   1.271  -0.875   5.317
  256    HA   ARG  31           HA       ARG  31   3.626   0.877   5.134
  257    HB2  ARG  31           2HB      ARG  31   2.446   2.596   6.512
  258    HB3  ARG  31           1HB      ARG  31   1.819   2.391   4.889
  259    HG2  ARG  31           2HG      ARG  31  -0.093   2.627   6.174
  260    HG3  ARG  31           1HG      ARG  31   0.039   0.884   5.987
  261    HD2  ARG  31           2HD      ARG  31   0.841   0.614   8.207
  262    HD3  ARG  31           1HD      ARG  31   1.132   2.342   8.387
  263    HE   ARG  31           HE       ARG  31  -1.597   1.992   7.917
  264   HH11  ARG  31          1HH1      ARG  31   0.723   1.200  10.351
  265   HH12  ARG  31          2HH1      ARG  31  -0.439   1.269  11.627
  266   HH21  ARG  31          1HH2      ARG  31  -3.057   2.100   9.561
  267   HH22  ARG  31          2HH2      ARG  31  -2.557   1.793  11.192
  268    HA   PRO  32           HA       PRO  32   3.415  -1.554   9.260
  269    HB2  PRO  32           2HB      PRO  32   4.656  -3.861   8.781
  270    HB3  PRO  32           1HB      PRO  32   2.968  -3.637   8.302
  271    HG2  PRO  32           2HG      PRO  32   5.451  -3.423   6.621
  272    HG3  PRO  32           1HG      PRO  32   3.938  -4.284   6.267
  273    HD2  PRO  32           2HD      PRO  32   4.515  -1.778   5.314
  274    HD3  PRO  32           1HD      PRO  32   2.864  -2.369   5.590
  275    H    LEU  33           H        LEU  33   5.390   0.277   7.853
  276    HA   LEU  33           HA       LEU  33   8.026  -0.663   8.493
  277    HB2  LEU  33           2HB      LEU  33   6.966   2.029   7.627
  278    HB3  LEU  33           1HB      LEU  33   8.666   1.707   7.888
  279    HG   LEU  33           HG       LEU  33   8.685   0.108   6.041
  280   HD11  LEU  33          1HD1      LEU  33   6.725  -0.139   4.569
  281   HD12  LEU  33          2HD1      LEU  33   5.755   0.762   5.736
  282   HD13  LEU  33          3HD1      LEU  33   6.450  -0.797   6.181
  283   HD21  LEU  33          3HD2      LEU  33   9.117   2.446   5.546
  284   HD22  LEU  33          1HD2      LEU  33   7.395   2.736   5.307
  285   HD23  LEU  33          2HD2      LEU  33   8.276   1.676   4.203
  286    HA   PRO  34           HA       PRO  34   8.564   0.499  12.703
  287    HB2  PRO  34           2HB      PRO  34  10.884   2.044  12.637
  288    HB3  PRO  34           1HB      PRO  34  10.831   0.280  12.675
  289    HG2  PRO  34           2HG      PRO  34  11.173   2.115  10.335
  290    HG3  PRO  34           1HG      PRO  34  11.986   0.577  10.685
  291    HD2  PRO  34           2HD      PRO  34  10.005   0.707   8.896
  292    HD3  PRO  34           1HD      PRO  34  10.161  -0.691   9.981
  293    H    ALA  35           H        ALA  35   9.200   3.296  10.575
  294    HA   ALA  35           HA       ALA  35   7.168   4.888  11.822
  295    HB1  ALA  35           3HB      ALA  35   8.916   5.149  13.517
  296    HB2  ALA  35           1HB      ALA  35   8.617   6.673  12.679
  297    HB3  ALA  35           2HB      ALA  35  10.042   5.710  12.281
  298    H    HIS  36           H        HIS  36   6.338   6.143  10.214
  299    HA   HIS  36           HA       HIS  36   7.848   7.593   8.332
  300    HB2  HIS  36           2HB      HIS  36   7.690   6.297   6.331
  301    HB3  HIS  36           1HB      HIS  36   8.364   5.228   7.558
  302    HD1  HIS  36           HD1      HIS  36   6.106   5.038   4.919
  303    HD2  HIS  36           HD2      HIS  36   5.891   3.843   8.896
  304    HE1  HIS  36           HE1      HIS  36   4.306   3.299   5.002
  305    HE2  HIS  36           HE2      HIS  36   4.092   2.695   7.438
  306    H    ASP  37           H        ASP  37   6.557   8.519   6.593
  307    HA   ASP  37           HA       ASP  37   3.744   8.847   7.214
  308    HB2  ASP  37           2HB      ASP  37   5.078  10.784   6.523
  309    HB3  ASP  37           1HB      ASP  37   5.498   9.981   5.015
  310    H    TYR  38           H        TYR  38   2.027   8.329   5.701
  311    HA   TYR  38           HA       TYR  38   2.763   6.622   3.435
  312    HB2  TYR  38           2HB      TYR  38   0.969   4.992   3.996
  313    HB3  TYR  38           1HB      TYR  38   2.294   5.008   5.149
  314    HD1  TYR  38           HD1      TYR  38  -1.233   6.009   4.620
  315    HD2  TYR  38           HD2      TYR  38   1.916   5.535   7.452
  316    HE1  TYR  38           HE1      TYR  38  -2.853   6.238   6.451
  317    HE2  TYR  38           HE2      TYR  38   0.298   5.767   9.290
  318    HH   TYR  38           HH       TYR  38  -3.064   5.589   8.797
  319    H    PHE  39           H        PHE  39   1.043   6.321   1.856
  320    HA   PHE  39           HA       PHE  39  -0.391   8.840   1.534
  321    HB2  PHE  39           2HB      PHE  39   0.700   6.775  -0.292
  322    HB3  PHE  39           1HB      PHE  39  -0.765   7.585  -0.835
  323    HD1  PHE  39           HD1      PHE  39  -0.782   9.973  -1.262
  324    HD2  PHE  39           HD2      PHE  39   2.808   7.962  -0.162
  325    HE1  PHE  39           HE1      PHE  39   0.523  11.899  -2.032
  326    HE2  PHE  39           HE2      PHE  39   4.124   9.895  -0.935
  327    HZ   PHE  39           HZ       PHE  39   2.984  11.866  -1.871
  328    H    GLU  40           H        GLU  40  -2.376   8.429  -0.069
  329    HA   GLU  40           HA       GLU  40  -4.500   7.470   1.487
  330    HB2  GLU  40           2HB      GLU  40  -5.815   7.739  -0.678
  331    HB3  GLU  40           1HB      GLU  40  -4.968   9.162  -0.089
  332    HG2  GLU  40           2HG      GLU  40  -3.219   8.871  -1.706
  333    HG3  GLU  40           1HG      GLU  40  -3.894   7.331  -2.233
  334    H    PHE  41           H        PHE  41  -5.691   5.630   1.507
  335    HA   PHE  41           HA       PHE  41  -4.933   3.429  -0.322
  336    HB2  PHE  41           2HB      PHE  41  -5.731   3.218   2.596
  337    HB3  PHE  41           1HB      PHE  41  -5.485   1.848   1.518
  338    HD1  PHE  41           HD1      PHE  41  -3.165   1.596   0.440
  339    HD2  PHE  41           HD2      PHE  41  -3.928   4.109   3.793
  340    HE1  PHE  41           HE1      PHE  41  -0.772   1.566   1.002
  341    HE2  PHE  41           HE2      PHE  41  -1.533   4.077   4.357
  342    HZ   PHE  41           HZ       PHE  41   0.049   2.807   2.960
  343    H    PHE  42           H        PHE  42  -6.663   1.976  -0.932
  344    HA   PHE  42           HA       PHE  42  -9.143   3.463  -1.235
  345    HB2  PHE  42           2HB      PHE  42  -9.727   1.812  -2.932
  346    HB3  PHE  42           1HB      PHE  42  -8.114   2.450  -3.213
  347    HD1  PHE  42           HD1      PHE  42 -10.046  -0.511  -2.172
  348    HD2  PHE  42           HD2      PHE  42  -6.172   1.035  -3.065
  349    HE1  PHE  42           HE1      PHE  42  -9.158  -2.803  -2.291
  350    HE2  PHE  42           HE2      PHE  42  -5.287  -1.255  -3.181
  351    HZ   PHE  42           HZ       PHE  42  -6.777  -3.178  -2.795
  352    H    ALA  43           H        ALA  43 -11.216   2.212  -1.257
  353    HA   ALA  43           HA       ALA  43 -11.447  -0.067   0.519
  354    HB1  ALA  43           3HB      ALA  43 -13.020   0.990   2.053
  355    HB2  ALA  43           1HB      ALA  43 -12.836   2.530   1.211
  356    HB3  ALA  43           2HB      ALA  43 -11.472   1.833   2.085
  357    H    ALA  44           H        ALA  44 -12.635  -1.372  -0.776
  358    HA   ALA  44           HA       ALA  44 -15.073  -0.292  -2.032
  359    HB1  ALA  44           3HB      ALA  44 -13.001  -1.956  -3.468
  360    HB2  ALA  44           1HB      ALA  44 -13.332  -0.243  -3.736
  361    HB3  ALA  44           2HB      ALA  44 -14.557  -1.451  -4.130
  362    H    ASP  45           H        ASP  45 -16.122  -2.389  -3.276
  363    HA   ASP  45           HA       ASP  45 -16.385  -4.444  -1.176
  364    HB2  ASP  45           2HB      ASP  45 -18.334  -3.673  -3.367
  365    HB3  ASP  45           1HB      ASP  45 -18.601  -4.922  -2.153
  366    H    LEU  46           H        LEU  46 -15.057  -6.093  -1.650
  367    HA   LEU  46           HA       LEU  46 -14.178  -6.938  -4.138
  368    HB2  LEU  46           2HB      LEU  46 -13.540  -9.041  -3.077
  369    HB3  LEU  46           1HB      LEU  46 -13.096  -7.659  -2.103
  370    HG   LEU  46           HG       LEU  46 -15.483  -9.448  -1.553
  371   HD11  LEU  46          1HD1      LEU  46 -13.422 -10.689  -1.272
  372   HD12  LEU  46          2HD1      LEU  46 -14.131 -10.333   0.304
  373   HD13  LEU  46          3HD1      LEU  46 -12.749  -9.403  -0.272
  374   HD21  LEU  46          3HD2      LEU  46 -15.520  -8.357   0.646
  375   HD22  LEU  46          1HD2      LEU  46 -15.773  -7.191  -0.652
  376   HD23  LEU  46          2HD2      LEU  46 -14.204  -7.293   0.147
  377    H    SER  47           H        SER  47 -15.401  -7.481  -5.818
  378    HA   SER  47           HA       SER  47 -17.269  -9.690  -5.636
  379    HB2  SER  47           2HB      SER  47 -18.677  -7.744  -5.015
  380    HB3  SER  47           1HB      SER  47 -18.244  -6.960  -6.531
  381    HG   SER  47           HG       SER  47 -20.288  -8.062  -6.571
  382    H    LEU  48           H        LEU  48 -18.461  -9.695  -8.022
  383    HA   LEU  48           HA       LEU  48 -16.201 -10.107  -9.816
  384    HB2  LEU  48           2HB      LEU  48 -19.129 -10.814 -10.077
  385    HB3  LEU  48           1HB      LEU  48 -17.929 -11.162 -11.304
  386    HG   LEU  48           HG       LEU  48 -16.708 -12.566  -9.591
  387   HD11  LEU  48          1HD1      LEU  48 -17.998 -13.355  -7.652
  388   HD12  LEU  48          2HD1      LEU  48 -19.260 -12.181  -8.021
  389   HD13  LEU  48          3HD1      LEU  48 -17.650 -11.630  -7.558
  390   HD21  LEU  48          3HD2      LEU  48 -18.200 -14.482  -9.848
  391   HD22  LEU  48          1HD2      LEU  48 -18.106 -13.549 -11.341
  392   HD23  LEU  48          2HD2      LEU  48 -19.523 -13.405 -10.300
  393    H    TYR  49           H        TYR  49 -17.989  -7.468  -9.188
  394    HA   TYR  49           HA       TYR  49 -18.612  -6.686 -11.926
  395    HB2  TYR  49           2HB      TYR  49 -19.062  -5.240  -9.304
  396    HB3  TYR  49           1HB      TYR  49 -19.624  -4.686 -10.876
  397    HD1  TYR  49           HD2      TYR  49 -21.414  -5.921 -12.062
  398    HD2  TYR  49           HD1      TYR  49 -20.214  -6.978  -8.119
  399    HE1  TYR  49           HE2      TYR  49 -23.484  -7.218 -11.782
  400    HE2  TYR  49           HE1      TYR  49 -22.278  -8.274  -7.831
  401    HH   TYR  49           HH       TYR  49 -24.319  -9.086 -10.411
  402    HA   PRO  50           HA       PRO  50 -14.599  -4.562 -11.999
  403    HB2  PRO  50           2HB      PRO  50 -14.314  -4.446 -14.658
  404    HB3  PRO  50           1HB      PRO  50 -14.168  -5.980 -13.791
  405    HG2  PRO  50           2HG      PRO  50 -16.489  -4.905 -15.357
  406    HG3  PRO  50           1HG      PRO  50 -15.830  -6.551 -15.322
  407    HD2  PRO  50           2HD      PRO  50 -18.040  -5.709 -13.876
  408    HD3  PRO  50           1HD      PRO  50 -17.044  -7.117 -13.464
  409    H    HIS  51           H        HIS  51 -16.227  -2.784 -11.097
  410    HA   HIS  51           HA       HIS  51 -16.968  -0.767 -13.062
  411    HB2  HIS  51           2HB      HIS  51 -17.280  -0.916 -10.063
  412    HB3  HIS  51           1HB      HIS  51 -17.724   0.513 -10.990
  413    HD1  HIS  51           HD1      HIS  51 -20.178   0.556 -11.255
  414    HD2  HIS  51           HD2      HIS  51 -18.682  -3.305 -11.539
  415    HE1  HIS  51           HE1      HIS  51 -22.169  -0.901 -11.697
  416    HE2  HIS  51           HE2      HIS  51 -21.215  -3.200 -12.037
  417    H    LEU  52           H        LEU  52 -14.380  -1.267 -10.751
  418    HA   LEU  52           HA       LEU  52 -12.930   1.022 -11.758
  419    HB2  LEU  52           2HB      LEU  52 -14.353   2.147 -10.157
  420    HB3  LEU  52           1HB      LEU  52 -13.961   0.971  -8.918
  421    HG   LEU  52           HG       LEU  52 -11.604   1.784  -8.941
  422   HD11  LEU  52          1HD1      LEU  52 -11.070   3.899 -10.025
  423   HD12  LEU  52          2HD1      LEU  52 -12.683   3.957 -10.738
  424   HD13  LEU  52          3HD1      LEU  52 -11.552   2.687 -11.213
  425   HD21  LEU  52          3HD2      LEU  52 -13.216   2.599  -7.285
  426   HD22  LEU  52          1HD2      LEU  52 -13.676   3.908  -8.374
  427   HD23  LEU  52          2HD2      LEU  52 -12.042   3.843  -7.713
  428    H    TYR  53           H        TYR  53 -10.772   0.626 -11.682
  429    HA   TYR  53           HA       TYR  53  -9.759  -1.564 -10.046
  430    HB2  TYR  53           2HB      TYR  53  -8.952  -1.305 -12.376
  431    HB3  TYR  53           1HB      TYR  53  -8.283   0.270 -11.963
  432    HD1  TYR  53           HD2      TYR  53  -8.083  -3.323 -10.951
  433    HD2  TYR  53           HD1      TYR  53  -6.043   0.406 -11.277
  434    HE1  TYR  53           HE2      TYR  53  -5.990  -4.416 -10.274
  435    HE2  TYR  53           HE1      TYR  53  -3.944  -0.683 -10.599
  436    HH   TYR  53           HH       TYR  53  -3.653  -4.137 -10.357
  437    H    SER  54           H        SER  54  -9.825  -0.894  -7.949
  438    HA   SER  54           HA       SER  54  -9.062   1.751  -7.127
  439    HB2  SER  54           2HB      SER  54  -9.668  -0.708  -5.462
  440    HB3  SER  54           1HB      SER  54  -9.541   0.943  -4.855
  441    HG   SER  54           HG       SER  54 -11.718  -0.042  -5.481
  442    H    ARG  55           H        ARG  55  -6.989   2.376  -7.017
  443    HA   ARG  55           HA       ARG  55  -4.958   0.410  -6.167
  444    HB2  ARG  55           2HB      ARG  55  -3.316   2.029  -7.267
  445    HB3  ARG  55           1HB      ARG  55  -4.372   1.112  -8.327
  446    HG2  ARG  55           2HG      ARG  55  -4.217   3.348  -9.155
  447    HG3  ARG  55           1HG      ARG  55  -5.842   3.106  -8.517
  448    HD2  ARG  55           2HD      ARG  55  -5.222   4.285  -6.468
  449    HD3  ARG  55           1HD      ARG  55  -3.580   4.497  -7.076
  450    HE   ARG  55           HE       ARG  55  -5.142   5.646  -8.986
  451   HH11  ARG  55          1HH1      ARG  55  -4.878   6.049  -5.574
  452   HH12  ARG  55          2HH1      ARG  55  -5.265   7.731  -5.627
  453   HH21  ARG  55          1HH2      ARG  55  -5.640   7.820  -9.035
  454   HH22  ARG  55          2HH2      ARG  55  -5.690   8.717  -7.556
  455    H    ALA  56           H        ALA  56  -2.952   1.525  -5.146
  456    HA   ALA  56           HA       ALA  56  -3.635   3.759  -3.379
  457    HB1  ALA  56           3HB      ALA  56  -2.680   1.094  -2.320
  458    HB2  ALA  56           1HB      ALA  56  -4.300   1.760  -2.127
  459    HB3  ALA  56           2HB      ALA  56  -2.924   2.560  -1.368
  460    H    TYR  57           H        TYR  57  -1.584   4.305  -1.960
  461    HA   TYR  57           HA       TYR  57   0.893   3.769  -3.462
  462    HB2  TYR  57           2HB      TYR  57  -0.105   6.540  -2.748
  463    HB3  TYR  57           1HB      TYR  57   1.505   6.185  -3.369
  464    HD1  TYR  57           HD2      TYR  57   1.715   5.192  -5.695
  465    HD2  TYR  57           HD1      TYR  57  -1.938   6.810  -4.220
  466    HE1  TYR  57           HE2      TYR  57   0.872   5.378  -7.995
  467    HE2  TYR  57           HE1      TYR  57  -2.788   6.999  -6.517
  468    HH   TYR  57           HH       TYR  57  -1.236   5.501  -9.171
  469    H    ILE  58           H        ILE  58   2.870   4.392  -2.294
  470    HA   ILE  58           HA       ILE  58   2.555   4.388   0.647
  471    HB   ILE  58           HB       ILE  58   4.610   2.781  -0.906
  472   HG12  ILE  58          2HG1      ILE  58   2.163   1.795   0.598
  473   HG13  ILE  58          1HG1      ILE  58   2.331   1.841  -1.153
  474   HG21  ILE  58          1HG2      ILE  58   5.184   1.779   1.251
  475   HG22  ILE  58          2HG2      ILE  58   4.001   2.809   2.058
  476   HG23  ILE  58          3HG2      ILE  58   5.418   3.527   1.288
  477   HD11  ILE  58          3HD1      ILE  58   4.168   0.234  -1.017
  478   HD12  ILE  58          1HD1      ILE  58   2.689  -0.398  -0.296
  479   HD13  ILE  58          2HD1      ILE  58   3.993   0.185   0.737
  480    H    ASN  59           H        ASN  59   4.321   5.362   1.838
  481    HA   ASN  59           HA       ASN  59   6.294   6.852   0.236
  482    HB2  ASN  59           2HB      ASN  59   4.545   8.422   0.912
  483    HB3  ASN  59           1HB      ASN  59   4.728   7.938   2.595
  484   HD21  ASN  59          1HD2      ASN  59   5.143  10.145   3.079
  485   HD22  ASN  59          2HD2      ASN  59   6.692  10.839   2.769
  486    H    PHE  60           H        PHE  60   8.345   6.994   1.074
  487    HA   PHE  60           HA       PHE  60   8.889   5.432   3.528
  488    HB2  PHE  60           2HB      PHE  60  10.310   5.574   0.892
  489    HB3  PHE  60           1HB      PHE  60  11.247   5.237   2.343
  490    HD1  PHE  60           HD2      PHE  60   8.388   4.019   0.300
  491    HD2  PHE  60           HD1      PHE  60  11.272   3.102   3.294
  492    HE1  PHE  60           HE2      PHE  60   7.780   1.636   0.159
  493    HE2  PHE  60           HE1      PHE  60  10.675   0.731   3.163
  494    HZ   PHE  60           HZ       PHE  60   8.923  -0.016   1.593
  495    H    ARG  61           H        ARG  61  10.890   6.027   4.703
  496    HA   ARG  61           HA       ARG  61  11.414   8.944   4.571
  497    HB2  ARG  61           2HB      ARG  61  11.290   7.153   7.005
  498    HB3  ARG  61           1HB      ARG  61  11.814   8.829   7.035
  499    HG2  ARG  61           2HG      ARG  61   9.077   7.936   6.138
  500    HG3  ARG  61           1HG      ARG  61   9.467   8.431   7.781
  501    HD2  ARG  61           2HD      ARG  61   8.539  10.340   6.781
  502    HD3  ARG  61           1HD      ARG  61  10.277  10.626   6.765
  503    HE   ARG  61           HE       ARG  61   9.855   9.559   4.335
  504   HH11  ARG  61          1HH1      ARG  61   8.230  12.062   6.031
  505   HH12  ARG  61          2HH1      ARG  61   7.833  12.933   4.590
  506   HH21  ARG  61          1HH2      ARG  61   9.316  10.659   2.485
  507   HH22  ARG  61          2HH2      ARG  61   8.446  12.148   2.599
  508    H    ASN  62           H        ASN  62  12.851   5.817   5.528
  509    HA   ASN  62           HA       ASN  62  15.530   7.052   5.503
  510    HB2  ASN  62           2HB      ASN  62  14.694   5.875   7.567
  511    HB3  ASN  62           1HB      ASN  62  14.675   4.380   6.649
  512   HD21  ASN  62          1HD2      ASN  62  16.193   3.320   7.823
  513   HD22  ASN  62          2HD2      ASN  62  17.850   3.799   7.900
  514    HA   PRO  63           HA       PRO  63  16.524   4.926   1.629
  515    HB2  PRO  63           2HB      PRO  63  19.265   4.706   2.108
  516    HB3  PRO  63           1HB      PRO  63  18.462   6.090   1.360
  517    HG2  PRO  63           2HG      PRO  63  19.322   5.706   4.204
  518    HG3  PRO  63           1HG      PRO  63  19.404   7.160   3.191
  519    HD2  PRO  63           2HD      PRO  63  17.505   6.892   5.057
  520    HD3  PRO  63           1HD      PRO  63  17.144   7.653   3.493
  521    H    ASP  64           H        ASP  64  18.075   3.780   4.644
  522    HA   ASP  64           HA       ASP  64  18.496   1.112   3.851
  523    HB2  ASP  64           2HB      ASP  64  17.909   2.110   6.653
  524    HB3  ASP  64           1HB      ASP  64  18.785   0.644   6.214
  525    H    ASP  65           H        ASP  65  15.787   2.646   5.524
  526    HA   ASP  65           HA       ASP  65  14.106   0.471   5.937
  527    HB2  ASP  65           2HB      ASP  65  13.724   2.643   6.931
  528    HB3  ASP  65           1HB      ASP  65  13.522   3.384   5.352
  529    H    ILE  66           H        ILE  66  14.482   2.522   3.063
  530    HA   ILE  66           HA       ILE  66  12.451   1.541   1.446
  531    HB   ILE  66           HB       ILE  66  15.210   2.473   0.628
  532   HG12  ILE  66          2HG1      ILE  66  12.546   3.929   0.728
  533   HG13  ILE  66          1HG1      ILE  66  13.887   4.156   1.846
  534   HG21  ILE  66          1HG2      ILE  66  14.237   2.860  -1.609
  535   HG22  ILE  66          2HG2      ILE  66  12.751   2.070  -1.084
  536   HG23  ILE  66          3HG2      ILE  66  14.254   1.153  -1.171
  537   HD11  ILE  66          3HD1      ILE  66  13.787   5.949   0.221
  538   HD12  ILE  66          1HD1      ILE  66  13.918   4.787  -1.098
  539   HD13  ILE  66          2HD1      ILE  66  15.265   5.011   0.019
  540    H    LEU  67           H        LEU  67  15.874   0.457   1.253
  541    HA   LEU  67           HA       LEU  67  15.229  -1.732  -0.436
  542    HB2  LEU  67           2HB      LEU  67  17.584  -2.463  -0.011
  543    HB3  LEU  67           1HB      LEU  67  17.399  -0.834  -0.623
  544    HG   LEU  67           HG       LEU  67  17.633  -0.084   1.841
  545   HD11  LEU  67          1HD1      LEU  67  17.368  -2.261   2.897
  546   HD12  LEU  67          2HD1      LEU  67  18.947  -1.571   3.268
  547   HD13  LEU  67          3HD1      LEU  67  18.808  -2.856   2.067
  548   HD21  LEU  67          3HD2      LEU  67  19.312   0.325   0.121
  549   HD22  LEU  67          1HD2      LEU  67  19.993  -1.280   0.389
  550   HD23  LEU  67          2HD2      LEU  67  20.072  -0.064   1.665
  551    H    LEU  68           H        LEU  68  15.169  -1.390   2.985
  552    HA   LEU  68           HA       LEU  68  15.411  -4.125   3.712
  553    HB2  LEU  68           2HB      LEU  68  15.735  -2.437   5.374
  554    HB3  LEU  68           1HB      LEU  68  14.152  -1.750   5.077
  555    HG   LEU  68           HG       LEU  68  13.090  -3.755   6.034
  556   HD11  LEU  68          1HD1      LEU  68  15.919  -4.650   6.616
  557   HD12  LEU  68          2HD1      LEU  68  14.801  -5.407   5.484
  558   HD13  LEU  68          3HD1      LEU  68  14.450  -5.426   7.209
  559   HD21  LEU  68          3HD2      LEU  68  15.169  -2.503   7.835
  560   HD22  LEU  68          1HD2      LEU  68  13.727  -3.370   8.367
  561   HD23  LEU  68          2HD2      LEU  68  13.566  -1.852   7.487
  562    H    PHE  69           H        PHE  69  12.451  -2.097   3.713
  563    HA   PHE  69           HA       PHE  69  10.779  -4.404   3.915
  564    HB2  PHE  69           2HB      PHE  69  10.312  -1.466   3.728
  565    HB3  PHE  69           1HB      PHE  69   8.957  -2.550   3.414
  566    HD1  PHE  69           HD1      PHE  69  11.454  -1.527   5.943
  567    HD2  PHE  69           HD2      PHE  69   7.893  -3.727   5.170
  568    HE1  PHE  69           HE1      PHE  69  11.107  -1.815   8.364
  569    HE2  PHE  69           HE2      PHE  69   7.538  -4.016   7.585
  570    HZ   PHE  69           HZ       PHE  69   9.147  -3.058   9.185
  571    H    ARG  70           H        ARG  70  11.686  -2.319   1.179
  572    HA   ARG  70           HA       ARG  70   9.814  -3.269  -0.673
  573    HB2  ARG  70           2HB      ARG  70  11.460  -1.378  -1.034
  574    HB3  ARG  70           1HB      ARG  70  12.692  -2.592  -1.345
  575    HG2  ARG  70           2HG      ARG  70  10.144  -2.593  -2.927
  576    HG3  ARG  70           1HG      ARG  70  11.438  -1.469  -3.330
  577    HD2  ARG  70           2HD      ARG  70  12.899  -3.173  -3.961
  578    HD3  ARG  70           1HD      ARG  70  12.022  -4.401  -3.049
  579    HE   ARG  70           HE       ARG  70  10.257  -4.233  -4.752
  580   HH11  ARG  70          1HH1      ARG  70  13.387  -3.036  -5.589
  581   HH12  ARG  70          2HH1      ARG  70  13.154  -3.336  -7.276
  582   HH21  ARG  70          1HH2      ARG  70   9.993  -4.616  -6.896
  583   HH22  ARG  70          2HH2      ARG  70  11.239  -4.163  -8.015
  584    H    ASP  71           H        ASP  71  12.885  -4.670   0.374
  585    HA   ASP  71           HA       ASP  71  13.042  -6.771  -1.489
  586    HB2  ASP  71           2HB      ASP  71  14.962  -6.173  -0.156
  587    HB3  ASP  71           1HB      ASP  71  14.105  -6.542   1.336
  588    H    ARG  72           H        ARG  72  11.685  -6.794   1.831
  589    HA   ARG  72           HA       ARG  72  10.866  -9.543   1.595
  590    HB2  ARG  72           2HB      ARG  72   9.953  -9.271   3.841
  591    HB3  ARG  72           1HB      ARG  72  11.584  -8.631   3.745
  592    HG2  ARG  72           2HG      ARG  72  10.662  -6.349   3.580
  593    HG3  ARG  72           1HG      ARG  72   9.037  -7.015   3.740
  594    HD2  ARG  72           2HD      ARG  72  11.255  -7.154   5.790
  595    HD3  ARG  72           1HD      ARG  72   9.798  -6.165   5.884
  596    HE   ARG  72           HE       ARG  72   9.509  -9.076   5.743
  597   HH11  ARG  72          1HH1      ARG  72   9.261  -6.173   7.589
  598   HH12  ARG  72          2HH1      ARG  72   8.384  -6.936   8.867
  599   HH21  ARG  72          1HH2      ARG  72   8.419 -10.045   7.423
  600   HH22  ARG  72          2HH2      ARG  72   7.932  -9.090   8.784
  601    H    PHE  73           H        PHE  73   9.455  -6.663   0.533
  602    HA   PHE  73           HA       PHE  73   6.776  -7.916   0.488
  603    HB2  PHE  73           2HB      PHE  73   7.619  -5.062   0.821
  604    HB3  PHE  73           1HB      PHE  73   6.067  -5.425   0.084
  605    HD1  PHE  73           HD1      PHE  73   4.306  -6.541   1.368
  606    HD2  PHE  73           HD2      PHE  73   7.987  -5.400   3.186
  607    HE1  PHE  73           HE1      PHE  73   3.291  -6.808   3.591
  608    HE2  PHE  73           HE2      PHE  73   6.975  -5.670   5.410
  609    HZ   PHE  73           HZ       PHE  73   4.625  -6.377   5.614
  610    H    ASP  74           H        ASP  74   9.282  -7.502  -1.509
  611    HA   ASP  74           HA       ASP  74   8.053  -6.372  -3.815
  612    HB2  ASP  74           2HB      ASP  74  10.494  -6.421  -3.554
  613    HB3  ASP  74           1HB      ASP  74  10.475  -8.180  -3.633
  614    H    GLY  75           H        GLY  75   6.029  -7.487  -3.918
  615    HA2  GLY  75           2HA      GLY  75   4.745  -8.792  -5.337
  616    HA3  GLY  75           1HA      GLY  75   6.196  -9.634  -5.845
  617    H    TYR  76           H        TYR  76   4.275  -9.303  -2.820
  618    HA   TYR  76           HA       TYR  76   4.447 -12.245  -2.556
  619    HB2  TYR  76           2HB      TYR  76   4.675 -12.071  -0.282
  620    HB3  TYR  76           1HB      TYR  76   5.364 -10.515  -0.721
  621    HD1  TYR  76           HD1      TYR  76   3.823  -8.454  -0.616
  622    HD2  TYR  76           HD2      TYR  76   2.814 -12.206   1.138
  623    HE1  TYR  76           HE1      TYR  76   2.163  -7.338   0.821
  624    HE2  TYR  76           HE2      TYR  76   1.159 -11.094   2.571
  625    HH   TYR  76           HH       TYR  76   0.073  -7.961   2.041
  626    H    ILE  77           H        ILE  77   2.567 -13.398  -1.903
  627    HA   ILE  77           HA       ILE  77   0.098 -12.147  -2.869
  628    HB   ILE  77           HB       ILE  77   0.688 -15.055  -2.258
  629   HG12  ILE  77          2HG1      ILE  77   1.971 -14.190  -4.183
  630   HG13  ILE  77          1HG1      ILE  77   0.757 -15.359  -4.691
  631   HG21  ILE  77          1HG2      ILE  77  -1.678 -14.585  -1.996
  632   HG22  ILE  77          2HG2      ILE  77  -1.416 -15.513  -3.472
  633   HG23  ILE  77          3HG2      ILE  77  -1.721 -13.780  -3.564
  634   HD11  ILE  77          3HD1      ILE  77   0.883 -13.478  -6.216
  635   HD12  ILE  77          1HD1      ILE  77   0.518 -12.366  -4.899
  636   HD13  ILE  77          2HD1      ILE  77  -0.689 -13.542  -5.424
  637    H    PHE  78           H        PHE  78  -1.078 -11.140  -1.316
  638    HA   PHE  78           HA       PHE  78  -1.456 -12.464   1.286
  639    HB2  PHE  78           2HB      PHE  78  -0.979 -10.064   1.380
  640    HB3  PHE  78           1HB      PHE  78  -2.341  -9.728   0.316
  641    HD1  PHE  78           HD1      PHE  78  -1.507 -11.217   3.627
  642    HD2  PHE  78           HD2      PHE  78  -4.444  -9.267   1.232
  643    HE1  PHE  78           HE1      PHE  78  -2.977 -11.022   5.589
  644    HE2  PHE  78           HE2      PHE  78  -5.915  -9.070   3.194
  645    HZ   PHE  78           HZ       PHE  78  -5.182  -9.950   5.374
  646    H    LEU  79           H        LEU  79  -3.227 -13.654   1.691
  647    HA   LEU  79           HA       LEU  79  -5.397 -13.652  -0.283
  648    HB2  LEU  79           2HB      LEU  79  -4.626 -15.605   1.882
  649    HB3  LEU  79           1HB      LEU  79  -6.084 -15.764   0.921
  650    HG   LEU  79           HG       LEU  79  -3.305 -15.703  -0.270
  651   HD11  LEU  79          1HD1      LEU  79  -3.527 -18.127  -0.531
  652   HD12  LEU  79          2HD1      LEU  79  -5.050 -18.088   0.359
  653   HD13  LEU  79          3HD1      LEU  79  -3.543 -17.662   1.172
  654   HD21  LEU  79          3HD2      LEU  79  -4.413 -16.570  -2.264
  655   HD22  LEU  79          1HD2      LEU  79  -5.100 -15.016  -1.786
  656   HD23  LEU  79          2HD2      LEU  79  -5.971 -16.510  -1.436
  657    H    ASP  80           H        ASP  80  -7.299 -12.738   0.108
  658    HA   ASP  80           HA       ASP  80  -8.005 -11.467   2.529
  659    HB2  ASP  80           2HB      ASP  80  -8.888 -10.978   0.180
  660    HB3  ASP  80           1HB      ASP  80  -9.933 -12.376   0.374
  661    H    SER  81           H        SER  81  -9.819 -12.025   3.969
  662    HA   SER  81           HA       SER  81  -9.787 -14.639   4.968
  663    HB2  SER  81           2HB      SER  81 -11.951 -12.539   5.260
  664    HB3  SER  81           1HB      SER  81 -11.820 -13.996   6.244
  665    HG   SER  81           HG       SER  81  -9.461 -12.761   6.301
  666    H    LYS  82           H        LYS  82 -11.779 -13.192   2.467
  667    HA   LYS  82           HA       LYS  82 -13.626 -15.358   2.195
  668    HB2  LYS  82           2HB      LYS  82 -12.766 -13.291   0.151
  669    HB3  LYS  82           1HB      LYS  82 -14.181 -14.329   0.026
  670    HG2  LYS  82           2HG      LYS  82 -13.756 -12.276   2.195
  671    HG3  LYS  82           1HG      LYS  82 -14.685 -12.004   0.722
  672    HD2  LYS  82           2HD      LYS  82 -16.182 -13.881   1.374
  673    HD3  LYS  82           1HD      LYS  82 -15.293 -14.018   2.892
  674    HE2  LYS  82           2HE      LYS  82 -15.949 -11.782   3.533
  675    HE3  LYS  82           1HE      LYS  82 -16.706 -11.517   1.961
  676    HZ1  LYS  82           3HZ      LYS  82 -18.277 -13.300   2.491
  677    HZ2  LYS  82           1HZ      LYS  82 -18.360 -12.032   3.605
  678    HZ3  LYS  82           2HZ      LYS  82 -17.575 -13.470   4.020
  679    H    GLY  83           H        GLY  83 -10.517 -14.557   0.730
  680    HA2  GLY  83           2HA      GLY  83  -9.091 -16.501   0.143
  681    HA3  GLY  83           1HA      GLY  83 -10.503 -17.187  -0.639
  682    H    LEU  84           H        LEU  84  -9.112 -13.897  -0.786
  683    HA   LEU  84           HA       LEU  84  -8.893 -14.220  -3.716
  684    HB2  LEU  84           2HB      LEU  84  -9.385 -11.707  -2.113
  685    HB3  LEU  84           1HB      LEU  84  -9.128 -11.751  -3.848
  686    HG   LEU  84           HG       LEU  84 -11.458 -12.974  -2.355
  687   HD11  LEU  84          1HD1      LEU  84 -12.787 -11.303  -3.545
  688   HD12  LEU  84          2HD1      LEU  84 -11.318 -10.640  -4.265
  689   HD13  LEU  84          3HD1      LEU  84 -11.567 -10.544  -2.520
  690   HD21  LEU  84          3HD2      LEU  84 -10.871 -12.944  -5.321
  691   HD22  LEU  84          1HD2      LEU  84 -12.357 -13.526  -4.567
  692   HD23  LEU  84          2HD2      LEU  84 -10.833 -14.360  -4.269
  693    H    GLU  85           H        GLU  85  -6.969 -13.892  -4.686
  694    HA   GLU  85           HA       GLU  85  -4.610 -13.525  -3.090
  695    HB2  GLU  85           2HB      GLU  85  -4.894 -13.643  -6.102
  696    HB3  GLU  85           1HB      GLU  85  -3.388 -13.758  -5.205
  697    HG2  GLU  85           2HG      GLU  85  -4.166 -15.849  -4.182
  698    HG3  GLU  85           1HG      GLU  85  -5.666 -15.732  -5.107
  699    H    TYR  86           H        TYR  86  -3.702 -11.622  -2.565
  700    HA   TYR  86           HA       TYR  86  -3.977  -9.342  -4.424
  701    HB2  TYR  86           2HB      TYR  86  -3.339  -9.270  -1.461
  702    HB3  TYR  86           1HB      TYR  86  -3.511  -7.871  -2.516
  703    HD1  TYR  86           HD1      TYR  86  -5.855  -7.746  -3.786
  704    HD2  TYR  86           HD2      TYR  86  -5.165  -9.893  -0.173
  705    HE1  TYR  86           HE1      TYR  86  -8.260  -7.650  -3.276
  706    HE2  TYR  86           HE2      TYR  86  -7.561  -9.796   0.346
  707    HH   TYR  86           HH       TYR  86  -9.534  -8.656  -0.182
  708    HA   PRO  87           HA       PRO  87   0.433 -10.528  -4.788
  709    HB2  PRO  87           2HB      PRO  87   0.762  -9.698  -7.346
  710    HB3  PRO  87           1HB      PRO  87   0.001 -11.238  -6.939
  711    HG2  PRO  87           2HG      PRO  87  -1.267  -8.652  -7.731
  712    HG3  PRO  87           1HG      PRO  87  -1.704 -10.304  -8.200
  713    HD2  PRO  87           2HD      PRO  87  -3.003  -8.852  -6.257
  714    HD3  PRO  87           1HD      PRO  87  -2.969 -10.626  -6.312
  715    H    ALA  88           H        ALA  88   0.617  -8.724  -3.166
  716    HA   ALA  88           HA       ALA  88   0.850  -6.019  -4.001
  717    HB1  ALA  88           3HB      ALA  88   0.282  -6.659  -1.706
  718    HB2  ALA  88           1HB      ALA  88   1.682  -5.588  -1.754
  719    HB3  ALA  88           2HB      ALA  88   1.903  -7.317  -1.485
  720    H    VAL  89           H        VAL  89   2.341  -5.500  -5.490
  721    HA   VAL  89           HA       VAL  89   5.128  -6.400  -5.136
  722    HB   VAL  89           HB       VAL  89   3.789  -5.105  -7.528
  723   HG11  VAL  89          1HG1      VAL  89   6.616  -6.126  -7.206
  724   HG12  VAL  89          2HG1      VAL  89   6.121  -4.448  -7.430
  725   HG13  VAL  89          3HG1      VAL  89   5.890  -5.616  -8.730
  726   HG21  VAL  89          3HG2      VAL  89   3.064  -7.414  -7.163
  727   HG22  VAL  89          1HG2      VAL  89   4.747  -7.945  -7.114
  728   HG23  VAL  89          2HG2      VAL  89   4.070  -7.289  -8.605
  729    H    VAL  90           H        VAL  90   6.215  -4.992  -3.812
  730    HA   VAL  90           HA       VAL  90   5.715  -2.132  -3.956
  731    HB   VAL  90           HB       VAL  90   7.754  -3.657  -2.314
  732   HG11  VAL  90          1HG1      VAL  90   6.837  -0.789  -2.076
  733   HG12  VAL  90          2HG1      VAL  90   8.409  -1.324  -2.672
  734   HG13  VAL  90          3HG1      VAL  90   7.957  -1.615  -0.992
  735   HG21  VAL  90          3HG2      VAL  90   5.446  -4.247  -1.744
  736   HG22  VAL  90          1HG2      VAL  90   5.057  -2.539  -1.529
  737   HG23  VAL  90          2HG2      VAL  90   6.208  -3.328  -0.446
  738    H    GLU  91           H        GLU  91   6.736  -0.799  -5.329
  739    HA   GLU  91           HA       GLU  91   9.522  -1.243  -6.067
  740    HB2  GLU  91           2HB      GLU  91   9.083  -1.082  -8.481
  741    HB3  GLU  91           1HB      GLU  91   8.327  -2.505  -7.778
  742    HG2  GLU  91           2HG      GLU  91   6.166  -1.439  -7.809
  743    HG3  GLU  91           1HG      GLU  91   6.882   0.076  -8.362
  744    H    PHE  92           H        PHE  92  10.360   0.634  -7.452
  745    HA   PHE  92           HA       PHE  92   9.645   3.025  -6.022
  746    HB2  PHE  92           2HB      PHE  92  11.535   4.076  -7.207
  747    HB3  PHE  92           1HB      PHE  92  11.989   2.564  -6.435
  748    HD1  PHE  92           HD1      PHE  92  12.340   0.530  -7.820
  749    HD2  PHE  92           HD2      PHE  92  11.725   4.369  -9.565
  750    HE1  PHE  92           HE1      PHE  92  13.278  -0.288  -9.944
  751    HE2  PHE  92           HE2      PHE  92  12.657   3.553 -11.689
  752    HZ   PHE  92           HZ       PHE  92  13.437   1.226 -11.881
  753    H    ALA  93           H        ALA  93   9.159   5.071  -6.948
  754    HA   ALA  93           HA       ALA  93   7.455   4.866  -9.360
  755    HB1  ALA  93           3HB      ALA  93   7.092   6.646  -6.942
  756    HB2  ALA  93           1HB      ALA  93   6.190   5.167  -7.277
  757    HB3  ALA  93           2HB      ALA  93   6.020   6.564  -8.341
  758    HA   PRO  94           HA       PRO  94   9.541   8.231 -11.453
  759    HB2  PRO  94           2HB      PRO  94   6.906   9.653 -11.461
  760    HB3  PRO  94           1HB      PRO  94   8.017   9.337 -12.799
  761    HG2  PRO  94           2HG      PRO  94   5.795   7.901 -12.536
  762    HG3  PRO  94           1HG      PRO  94   7.314   7.126 -13.033
  763    HD2  PRO  94           2HD      PRO  94   5.941   7.079 -10.374
  764    HD3  PRO  94           1HD      PRO  94   6.846   5.793 -11.200
  765    H    PHE  95           H        PHE  95  10.887   9.432 -10.244
  766    HA   PHE  95           HA       PHE  95  10.236  10.724  -7.817
  767    HB2  PHE  95           2HB      PHE  95  12.567  11.403  -9.631
  768    HB3  PHE  95           1HB      PHE  95  12.474  11.618  -7.886
  769    HD1  PHE  95           HD2      PHE  95  12.589   9.644  -6.387
  770    HD2  PHE  95           HD1      PHE  95  13.148   9.295 -10.597
  771    HE1  PHE  95           HE2      PHE  95  13.580   7.418  -6.072
  772    HE2  PHE  95           HE1      PHE  95  14.140   7.069 -10.281
  773    HZ   PHE  95           HZ       PHE  95  14.358   6.126  -8.017
  774    H    GLN  96           H        GLN  96  10.022  11.698 -11.115
  775    HA   GLN  96           HA       GLN  96   8.529  14.064 -10.423
  776    HB2  GLN  96           2HB      GLN  96  11.041  14.701 -10.415
  777    HB3  GLN  96           1HB      GLN  96  10.975  14.476 -12.156
  778    HG2  GLN  96           2HG      GLN  96  10.725  16.795 -11.710
  779    HG3  GLN  96           1HG      GLN  96   9.157  16.189 -12.235
  780   HE21  GLN  96          1HE2      GLN  96   7.463  16.089 -10.732
  781   HE22  GLN  96          2HE2      GLN  96   7.539  16.909  -9.216
  782    H    LYS  97           H        LYS  97   7.727  15.155 -12.499
  783    HA   LYS  97           HA       LYS  97   6.865  15.163 -14.602
  784    HB2  LYS  97           2HB      LYS  97   9.036  14.268 -15.391
  785    HB3  LYS  97           1HB      LYS  97   8.465  12.636 -15.090
  786    HG2  LYS  97           2HG      LYS  97   8.321  13.140 -17.444
  787    HG3  LYS  97           1HG      LYS  97   6.701  12.944 -16.777
  788    HD2  LYS  97           2HD      LYS  97   6.802  14.844 -18.317
  789    HD3  LYS  97           1HD      LYS  97   6.440  15.377 -16.675
  790    HE2  LYS  97           2HE      LYS  97   8.753  16.060 -16.355
  791    HE3  LYS  97           1HE      LYS  97   9.177  15.449 -17.955
  792    HZ1  LYS  97           3HZ      LYS  97   7.245  17.640 -17.436
  793    HZ2  LYS  97           1HZ      LYS  97   7.763  17.094 -18.948
  794    HZ3  LYS  97           2HZ      LYS  97   8.852  17.862 -17.910
  Start of MODEL    3
    1    H1   MET   1           1H       MET   1  24.910   3.225  16.368
    2    H2   MET   1           2H       MET   1  25.165   4.496  15.286
    3    H3   MET   1           3H       MET   1  23.826   3.488  15.100
    4    HA   MET   1           HA       MET   1  22.930   4.234  17.198
    5    HB2  MET   1           2HB      MET   1  23.968   6.303  18.219
    6    HB3  MET   1           1HB      MET   1  24.871   4.811  18.419
    7    HG2  MET   1           2HG      MET   1  26.399   6.581  17.929
    8    HG3  MET   1           1HG      MET   1  26.341   5.485  16.551
    9    HE1  MET   1           3HE      MET   1  23.723   8.273  17.590
   10    HE2  MET   1           1HE      MET   1  24.332   9.645  16.661
   11    HE3  MET   1           2HE      MET   1  25.293   8.978  17.980
   12    H    GLY   2           H        GLY   2  24.081   5.754  14.287
   13    HA2  GLY   2           2HA      GLY   2  21.963   6.479  13.025
   14    HA3  GLY   2           1HA      GLY   2  21.778   7.608  14.355
   15    H    HIS   3           H        HIS   3  22.430   7.682  11.297
   16    HA   HIS   3           HA       HIS   3  24.542   9.738  11.522
   17    HB2  HIS   3           2HB      HIS   3  23.843   7.989   9.147
   18    HB3  HIS   3           1HB      HIS   3  25.030   9.288   9.123
   19    HD1  HIS   3           HD1      HIS   3  24.525   5.772  10.232
   20    HD2  HIS   3           HD2      HIS   3  27.465   8.702  10.461
   21    HE1  HIS   3           HE1      HIS   3  26.608   4.580  10.964
   22    HE2  HIS   3           HE2      HIS   3  28.349   6.378  11.179
   23    H    HIS   4           H        HIS   4  24.081  11.768  10.848
   24    HA   HIS   4           HA       HIS   4  21.415  12.368   9.827
   25    HB2  HIS   4           2HB      HIS   4  22.246  13.770  11.625
   26    HB3  HIS   4           1HB      HIS   4  23.702  14.152  10.711
   27    HD1  HIS   4           HD1      HIS   4  19.977  14.820  10.700
   28    HD2  HIS   4           HD2      HIS   4  23.466  16.296   8.991
   29    HE1  HIS   4           HE1      HIS   4  19.312  16.941   9.538
   30    HE2  HIS   4           HE2      HIS   4  21.395  17.700   8.352
   31    H    HIS   5           H        HIS   5  20.981  12.667   7.723
   32    HA   HIS   5           HA       HIS   5  21.184  13.001   5.490
   33    HB2  HIS   5           2HB      HIS   5  22.076  15.193   6.155
   34    HB3  HIS   5           1HB      HIS   5  23.695  14.513   6.261
   35    HD1  HIS   5           HD1      HIS   5  24.912  13.990   4.021
   36    HD2  HIS   5           HD2      HIS   5  21.191  15.789   3.574
   37    HE1  HIS   5           HE1      HIS   5  24.825  14.777   1.638
   38    HE2  HIS   5           HE2      HIS   5  22.571  15.861   1.389
   39    H    HIS   6           H        HIS   6  21.501  10.699   5.285
   40    HA   HIS   6           HA       HIS   6  24.255   9.933   4.534
   41    HB2  HIS   6           2HB      HIS   6  23.219   8.643   6.413
   42    HB3  HIS   6           1HB      HIS   6  21.974   8.089   5.302
   43    HD1  HIS   6           HD1      HIS   6  22.467   5.692   4.890
   44    HD2  HIS   6           HD2      HIS   6  25.916   8.009   4.811
   45    HE1  HIS   6           HE1      HIS   6  24.319   4.123   4.258
   46    HE2  HIS   6           HE2      HIS   6  26.411   5.505   4.394
   47    H    HIS   7           H        HIS   7  20.852   9.691   3.545
   48    HA   HIS   7           HA       HIS   7  21.682   9.690   0.746
   49    HB2  HIS   7           2HB      HIS   7  19.994   7.488   1.956
   50    HB3  HIS   7           1HB      HIS   7  19.991   7.844   0.235
   51    HD1  HIS   7           HD1      HIS   7  21.176   5.326   2.123
   52    HD2  HIS   7           HD2      HIS   7  23.161   7.988  -0.378
   53    HE1  HIS   7           HE1      HIS   7  23.320   4.186   1.494
   54    HE2  HIS   7           HE2      HIS   7  24.515   5.810  -0.011
   55    H    HIS   8           H        HIS   8  19.886  10.173  -0.737
   56    HA   HIS   8           HA       HIS   8  17.851  11.832   0.569
   57    HB2  HIS   8           2HB      HIS   8  17.397  12.705  -1.724
   58    HB3  HIS   8           1HB      HIS   8  19.047  12.969  -1.183
   59    HD1  HIS   8           HD1      HIS   8  20.928  11.614  -2.410
   60    HD2  HIS   8           HD2      HIS   8  17.114  11.107  -3.993
   61    HE1  HIS   8           HE1      HIS   8  21.266  10.550  -4.657
   62    HE2  HIS   8           HE2      HIS   8  18.963  10.363  -5.645
   63    H    SER   9           H        SER   9  16.051  10.789   1.130
   64    HA   SER   9           HA       SER   9  15.267   8.326  -0.169
   65    HB2  SER   9           2HB      SER   9  15.124   8.552   2.282
   66    HB3  SER   9           1HB      SER   9  13.916   9.822   2.095
   67    HG   SER   9           HG       SER   9  13.160   7.572   2.478
   68    H    HIS  10           H        HIS  10  12.946   7.913  -0.674
   69    HA   HIS  10           HA       HIS  10  11.331  10.113  -1.576
   70    HB2  HIS  10           2HB      HIS  10  11.319   9.461  -3.973
   71    HB3  HIS  10           1HB      HIS  10  12.888  10.052  -3.441
   72    HD1  HIS  10           HD1      HIS  10  11.192   7.072  -4.847
   73    HD2  HIS  10           HD2      HIS  10  14.917   8.058  -3.281
   74    HE1  HIS  10           HE1      HIS  10  12.715   5.183  -5.489
   75    HE2  HIS  10           HE2      HIS  10  14.985   5.884  -4.681
   76    H    MET  11           H        MET  11   9.286   9.356  -2.587
   77    HA   MET  11           HA       MET  11   8.096   7.307  -1.074
   78    HB2  MET  11           2HB      MET  11   6.119   7.667  -2.533
   79    HB3  MET  11           1HB      MET  11   6.794   9.164  -1.900
   80    HG2  MET  11           2HG      MET  11   7.887   9.600  -4.022
   81    HG3  MET  11           1HG      MET  11   7.291   8.071  -4.662
   82    HE1  MET  11           3HE      MET  11   6.892  10.857  -6.164
   83    HE2  MET  11           1HE      MET  11   5.217  10.682  -6.690
   84    HE3  MET  11           2HE      MET  11   6.314   9.304  -6.771
   85    H    VAL  12           H        VAL  12   6.900   5.433  -1.892
   86    HA   VAL  12           HA       VAL  12   7.989   4.095  -4.273
   87    HB   VAL  12           HB       VAL  12   7.950   2.884  -1.489
   88   HG11  VAL  12          1HG1      VAL  12   8.544   1.524  -4.118
   89   HG12  VAL  12          2HG1      VAL  12   7.148   1.232  -3.080
   90   HG13  VAL  12          3HG1      VAL  12   8.766   0.813  -2.518
   91   HG21  VAL  12          3HG2      VAL  12  10.236   3.356  -3.413
   92   HG22  VAL  12          1HG2      VAL  12  10.358   2.562  -1.841
   93   HG23  VAL  12          2HG2      VAL  12   9.913   4.266  -1.936
   94    H    VAL  13           H        VAL  13   6.451   2.681  -5.274
   95    HA   VAL  13           HA       VAL  13   3.741   2.995  -4.140
   96    HB   VAL  13           HB       VAL  13   2.849   2.891  -6.399
   97   HG11  VAL  13          1HG1      VAL  13   3.466   5.073  -5.481
   98   HG12  VAL  13          2HG1      VAL  13   3.691   5.034  -7.229
   99   HG13  VAL  13          3HG1      VAL  13   5.087   4.909  -6.158
  100   HG21  VAL  13          3HG2      VAL  13   5.723   2.720  -7.328
  101   HG22  VAL  13          1HG2      VAL  13   4.309   2.904  -8.367
  102   HG23  VAL  13          2HG2      VAL  13   4.527   1.429  -7.427
  103    H    ILE  14           H        ILE  14   2.292   1.322  -4.108
  104    HA   ILE  14           HA       ILE  14   3.394  -1.384  -4.437
  105    HB   ILE  14           HB       ILE  14   2.471  -0.837  -2.231
  106   HG12  ILE  14          2HG1      ILE  14   0.757  -2.720  -2.083
  107   HG13  ILE  14          1HG1      ILE  14   0.916  -2.884  -3.828
  108   HG21  ILE  14          1HG2      ILE  14  -0.147  -0.394  -3.664
  109   HG22  ILE  14          2HG2      ILE  14   0.833   0.834  -2.860
  110   HG23  ILE  14          3HG2      ILE  14   0.067  -0.444  -1.913
  111   HD11  ILE  14          3HD1      ILE  14   2.267  -4.511  -2.630
  112   HD12  ILE  14          1HD1      ILE  14   3.137  -3.210  -1.818
  113   HD13  ILE  14          2HD1      ILE  14   3.278  -3.411  -3.566
  114    H    ARG  15           H        ARG  15   2.482  -2.864  -5.835
  115    HA   ARG  15           HA       ARG  15   0.468  -1.789  -7.717
  116    HB2  ARG  15           2HB      ARG  15   2.728  -3.740  -8.223
  117    HB3  ARG  15           1HB      ARG  15   1.531  -3.265  -9.417
  118    HG2  ARG  15           2HG      ARG  15   3.515  -1.421  -8.090
  119    HG3  ARG  15           1HG      ARG  15   3.650  -2.085  -9.720
  120    HD2  ARG  15           2HD      ARG  15   1.426  -0.976 -10.216
  121    HD3  ARG  15           1HD      ARG  15   1.598  -0.138  -8.672
  122    HE   ARG  15           HE       ARG  15   3.935   0.290 -10.090
  123   HH11  ARG  15          1HH1      ARG  15   0.594   1.045 -10.421
  124   HH12  ARG  15          2HH1      ARG  15   0.896   2.458 -11.368
  125   HH21  ARG  15          1HH2      ARG  15   4.311   2.101 -11.312
  126   HH22  ARG  15          2HH2      ARG  15   2.970   3.056 -11.857
  127    H    ARG  16           H        ARG  16  -0.860  -3.392  -8.857
  128    HA   ARG  16           HA       ARG  16  -2.121  -5.262  -9.133
  129    HB2  ARG  16           2HB      ARG  16  -0.145  -6.525  -7.219
  130    HB3  ARG  16           1HB      ARG  16  -1.342  -7.404  -8.159
  131    HG2  ARG  16           2HG      ARG  16   0.638  -5.629  -9.539
  132    HG3  ARG  16           1HG      ARG  16   1.107  -7.248  -9.014
  133    HD2  ARG  16           2HD      ARG  16  -1.368  -6.806 -10.666
  134    HD3  ARG  16           1HD      ARG  16   0.223  -6.935 -11.421
  135    HE   ARG  16           HE       ARG  16   0.220  -9.125  -9.940
  136   HH11  ARG  16          1HH1      ARG  16  -2.284  -7.861 -11.937
  137   HH12  ARG  16          2HH1      ARG  16  -2.910  -9.425 -12.320
  138   HH21  ARG  16          1HH2      ARG  16  -0.573 -11.122 -10.468
  139   HH22  ARG  16          2HH2      ARG  16  -1.948 -11.249 -11.509
  140    H    LEU  17           H        LEU  17  -3.106  -3.372  -7.358
  141    HA   LEU  17           HA       LEU  17  -4.371  -4.991  -5.242
  142    HB2  LEU  17           2HB      LEU  17  -4.038  -2.016  -5.564
  143    HB3  LEU  17           1HB      LEU  17  -5.217  -2.687  -4.457
  144    HG   LEU  17           HG       LEU  17  -3.271  -2.094  -3.201
  145   HD11  LEU  17          1HD1      LEU  17  -2.653  -4.231  -2.196
  146   HD12  LEU  17          2HD1      LEU  17  -3.347  -5.087  -3.574
  147   HD13  LEU  17          3HD1      LEU  17  -4.386  -4.141  -2.505
  148   HD21  LEU  17          3HD2      LEU  17  -1.633  -2.054  -5.003
  149   HD22  LEU  17          1HD2      LEU  17  -1.670  -3.817  -5.092
  150   HD23  LEU  17          2HD2      LEU  17  -1.058  -3.017  -3.643
  151    HA   PRO  18           HA       PRO  18  -8.050  -4.591  -7.962
  152    HB2  PRO  18           2HB      PRO  18  -8.999  -7.074  -7.583
  153    HB3  PRO  18           1HB      PRO  18  -7.653  -6.772  -8.691
  154    HG2  PRO  18           2HG      PRO  18  -7.594  -7.807  -5.878
  155    HG3  PRO  18           1HG      PRO  18  -6.682  -8.364  -7.294
  156    HD2  PRO  18           2HD      PRO  18  -5.669  -6.672  -5.368
  157    HD3  PRO  18           1HD      PRO  18  -5.071  -6.753  -7.036
  158    HA   PRO  19           HA       PRO  19 -11.051  -3.636  -4.786
  159    HB2  PRO  19           2HB      PRO  19 -13.064  -5.257  -6.273
  160    HB3  PRO  19           1HB      PRO  19 -13.127  -3.562  -5.776
  161    HG2  PRO  19           2HG      PRO  19 -12.704  -4.210  -8.327
  162    HG3  PRO  19           1HG      PRO  19 -11.842  -2.847  -7.582
  163    HD2  PRO  19           2HD      PRO  19 -10.862  -5.623  -8.173
  164    HD3  PRO  19           1HD      PRO  19 -10.022  -4.068  -8.361
  165    H    GLY  20           H        GLY  20 -11.029  -4.558  -2.816
  166    HA2  GLY  20           2HA      GLY  20 -12.219  -7.163  -2.386
  167    HA3  GLY  20           1HA      GLY  20 -10.492  -7.105  -2.080
  168    H    LEU  21           H        LEU  21 -10.079  -6.945   0.031
  169    HA   LEU  21           HA       LEU  21 -11.925  -6.013   1.952
  170    HB2  LEU  21           2HB      LEU  21 -10.192  -6.233   3.582
  171    HB3  LEU  21           1HB      LEU  21 -10.081  -7.581   2.470
  172    HG   LEU  21           HG       LEU  21  -8.277  -5.151   2.426
  173   HD11  LEU  21          1HD1      LEU  21  -7.948  -6.477   4.447
  174   HD12  LEU  21          2HD1      LEU  21  -6.572  -6.625   3.357
  175   HD13  LEU  21          3HD1      LEU  21  -7.748  -7.934   3.469
  176   HD21  LEU  21          3HD2      LEU  21  -6.863  -6.548   0.945
  177   HD22  LEU  21          1HD2      LEU  21  -8.425  -6.153   0.229
  178   HD23  LEU  21          2HD2      LEU  21  -8.145  -7.759   0.903
  179    H    THR  22           H        THR  22 -11.666  -4.186   3.412
  180    HA   THR  22           HA       THR  22 -11.293  -1.753   1.890
  181    HB   THR  22           HB       THR  22 -12.215  -2.142   4.755
  182    HG1  THR  22           HG1      THR  22 -13.457  -2.502   2.366
  183   HG21  THR  22          3HG2      THR  22 -13.107   0.139   4.580
  184   HG22  THR  22          1HG2      THR  22 -12.396   0.299   2.972
  185   HG23  THR  22          2HG2      THR  22 -11.355   0.128   4.386
  186    H    LYS  23           H        LYS  23  -9.973   0.016   2.519
  187    HA   LYS  23           HA       LYS  23  -7.346  -0.358   2.933
  188    HB2  LYS  23           2HB      LYS  23  -7.184   1.971   3.738
  189    HB3  LYS  23           1HB      LYS  23  -8.234   1.807   2.338
  190    HG2  LYS  23           2HG      LYS  23 -10.186   2.120   3.623
  191    HG3  LYS  23           1HG      LYS  23  -9.325   1.870   5.143
  192    HD2  LYS  23           2HD      LYS  23  -8.887   4.203   3.263
  193    HD3  LYS  23           1HD      LYS  23  -9.874   4.252   4.726
  194    HE2  LYS  23           2HE      LYS  23  -7.871   3.621   6.045
  195    HE3  LYS  23           1HE      LYS  23  -6.908   3.707   4.572
  196    HZ1  LYS  23           3HZ      LYS  23  -6.769   5.724   5.917
  197    HZ2  LYS  23           1HZ      LYS  23  -8.431   5.969   5.739
  198    HZ3  LYS  23           2HZ      LYS  23  -7.418   6.037   4.388
  199    H    GLU  24           H        GLU  24  -9.712  -0.152   5.538
  200    HA   GLU  24           HA       GLU  24  -8.142   0.254   7.757
  201    HB2  GLU  24           2HB      GLU  24 -10.469  -1.671   7.584
  202    HB3  GLU  24           1HB      GLU  24  -9.881  -0.867   9.035
  203    HG2  GLU  24           2HG      GLU  24 -10.572   1.275   8.205
  204    HG3  GLU  24           1HG      GLU  24 -10.986   0.586   6.636
  205    H    GLN  25           H        GLN  25  -8.892  -2.914   6.280
  206    HA   GLN  25           HA       GLN  25  -6.801  -4.192   7.931
  207    HB2  GLN  25           2HB      GLN  25  -8.857  -5.482   6.108
  208    HB3  GLN  25           1HB      GLN  25  -7.809  -6.306   7.258
  209    HG2  GLN  25           2HG      GLN  25  -8.959  -5.259   9.117
  210    HG3  GLN  25           1HG      GLN  25  -9.947  -4.313   8.003
  211   HE21  GLN  25          1HE2      GLN  25 -11.585  -5.339   6.844
  212   HE22  GLN  25          2HE2      GLN  25 -12.186  -6.893   7.291
  213    H    LEU  26           H        LEU  26  -6.923  -2.639   5.097
  214    HA   LEU  26           HA       LEU  26  -5.314  -4.545   3.550
  215    HB2  LEU  26           2HB      LEU  26  -7.151  -3.788   2.312
  216    HB3  LEU  26           1HB      LEU  26  -6.954  -2.134   2.830
  217    HG   LEU  26           HG       LEU  26  -4.846  -2.041   1.436
  218   HD11  LEU  26          1HD1      LEU  26  -5.855  -4.701   0.422
  219   HD12  LEU  26          2HD1      LEU  26  -4.366  -4.422   1.326
  220   HD13  LEU  26          3HD1      LEU  26  -4.550  -3.753  -0.295
  221   HD21  LEU  26          3HD2      LEU  26  -7.414  -2.677  -0.025
  222   HD22  LEU  26          1HD2      LEU  26  -6.036  -1.792  -0.682
  223   HD23  LEU  26          2HD2      LEU  26  -6.969  -1.108   0.650
  224    H    GLU  27           H        GLU  27  -5.072  -1.467   5.183
  225    HA   GLU  27           HA       GLU  27  -2.602  -0.712   3.885
  226    HB2  GLU  27           2HB      GLU  27  -2.607   1.206   5.370
  227    HB3  GLU  27           1HB      GLU  27  -4.208   0.988   4.682
  228    HG2  GLU  27           2HG      GLU  27  -5.004   0.004   6.749
  229    HG3  GLU  27           1HG      GLU  27  -3.388   0.096   7.445
  230    H    GLU  28           H        GLU  28  -3.527  -2.366   6.819
  231    HA   GLU  28           HA       GLU  28  -1.312  -1.943   8.425
  232    HB2  GLU  28           2HB      GLU  28  -1.943  -4.109   9.532
  233    HB3  GLU  28           1HB      GLU  28  -3.252  -2.954   9.358
  234    HG2  GLU  28           2HG      GLU  28  -4.157  -4.187   7.493
  235    HG3  GLU  28           1HG      GLU  28  -2.794  -5.304   7.530
  236    H    GLN  29           H        GLN  29  -1.627  -4.195   5.734
  237    HA   GLN  29           HA       GLN  29   0.996  -5.358   6.316
  238    HB2  GLN  29           2HB      GLN  29   0.571  -6.903   4.470
  239    HB3  GLN  29           1HB      GLN  29  -0.754  -6.920   5.621
  240    HG2  GLN  29           2HG      GLN  29  -0.945  -5.185   3.192
  241    HG3  GLN  29           1HG      GLN  29  -1.209  -6.919   3.044
  242   HE21  GLN  29          1HE2      GLN  29  -3.378  -6.632   2.501
  243   HE22  GLN  29          2HE2      GLN  29  -4.559  -6.164   3.668
  244    H    LEU  30           H        LEU  30  -0.310  -2.823   4.440
  245    HA   LEU  30           HA       LEU  30   1.822  -2.921   2.442
  246    HB2  LEU  30           2HB      LEU  30  -0.540  -1.055   2.713
  247    HB3  LEU  30           1HB      LEU  30   0.621  -1.014   1.400
  248    HG   LEU  30           HG       LEU  30  -1.298  -3.269   2.018
  249   HD11  LEU  30          1HD1      LEU  30  -2.375  -1.331   1.008
  250   HD12  LEU  30          2HD1      LEU  30  -2.318  -2.681  -0.124
  251   HD13  LEU  30          3HD1      LEU  30  -1.189  -1.336  -0.298
  252   HD21  LEU  30          3HD2      LEU  30   0.745  -3.047  -0.196
  253   HD22  LEU  30          1HD2      LEU  30  -0.457  -4.325  -0.019
  254   HD23  LEU  30          2HD2      LEU  30   0.823  -4.149   1.180
  255    H    ARG  31           H        ARG  31   1.133  -1.250   5.409
  256    HA   ARG  31           HA       ARG  31   3.501   0.431   4.917
  257    HB2  ARG  31           2HB      ARG  31   2.377   2.304   6.148
  258    HB3  ARG  31           1HB      ARG  31   1.700   1.922   4.577
  259    HG2  ARG  31           2HG      ARG  31  -0.159   2.318   5.930
  260    HG3  ARG  31           1HG      ARG  31  -0.059   0.564   5.845
  261    HD2  ARG  31           2HD      ARG  31   0.901   0.448   8.037
  262    HD3  ARG  31           1HD      ARG  31   1.081   2.200   8.109
  263    HE   ARG  31           HE       ARG  31  -1.586   1.875   7.809
  264   HH11  ARG  31          1HH1      ARG  31   0.702   0.499   9.988
  265   HH12  ARG  31          2HH1      ARG  31  -0.434   0.369  11.280
  266   HH21  ARG  31          1HH2      ARG  31  -3.029   1.731   9.468
  267   HH22  ARG  31          2HH2      ARG  31  -2.533   1.072  10.992
  268    HA   PRO  32           HA       PRO  32   3.487  -1.459   9.310
  269    HB2  PRO  32           2HB      PRO  32   4.798  -3.776   9.066
  270    HB3  PRO  32           1HB      PRO  32   3.078  -3.663   8.670
  271    HG2  PRO  32           2HG      PRO  32   5.447  -3.638   6.827
  272    HG3  PRO  32           1HG      PRO  32   3.925  -4.534   6.672
  273    HD2  PRO  32           2HD      PRO  32   4.441  -2.159   5.387
  274    HD3  PRO  32           1HD      PRO  32   2.811  -2.727   5.799
  275    H    LEU  33           H        LEU  33   5.254   0.414   7.911
  276    HA   LEU  33           HA       LEU  33   7.967  -0.433   8.642
  277    HB2  LEU  33           2HB      LEU  33   6.991   1.960   7.065
  278    HB3  LEU  33           1HB      LEU  33   8.674   1.629   7.421
  279    HG   LEU  33           HG       LEU  33   8.386  -0.554   6.146
  280   HD11  LEU  33          1HD1      LEU  33   6.565  -0.656   4.524
  281   HD12  LEU  33          2HD1      LEU  33   5.854   0.803   5.217
  282   HD13  LEU  33          3HD1      LEU  33   5.953  -0.675   6.176
  283   HD21  LEU  33          3HD2      LEU  33   9.569   1.358   5.227
  284   HD22  LEU  33          1HD2      LEU  33   8.049   2.053   4.666
  285   HD23  LEU  33          2HD2      LEU  33   8.637   0.542   3.973
  286    HA   PRO  34           HA       PRO  34   8.145   2.391  12.122
  287    HB2  PRO  34           2HB      PRO  34  10.790   2.971  12.229
  288    HB3  PRO  34           1HB      PRO  34  10.139   1.388  12.666
  289    HG2  PRO  34           2HG      PRO  34  11.480   2.249  10.135
  290    HG3  PRO  34           1HG      PRO  34  11.646   0.729  11.031
  291    HD2  PRO  34           2HD      PRO  34  10.086   1.028   8.786
  292    HD3  PRO  34           1HD      PRO  34   9.804  -0.199  10.035
  293    H    ALA  35           H        ALA  35  10.675   3.831  10.015
  294    HA   ALA  35           HA       ALA  35   9.469   6.461  10.457
  295    HB1  ALA  35           3HB      ALA  35  11.870   6.165  10.883
  296    HB2  ALA  35           1HB      ALA  35  11.572   7.361   9.621
  297    HB3  ALA  35           2HB      ALA  35  12.117   5.739   9.190
  298    H    HIS  36           H        HIS  36   7.851   6.922   9.032
  299    HA   HIS  36           HA       HIS  36   8.288   7.261   6.265
  300    HB2  HIS  36           2HB      HIS  36   7.133   5.393   5.293
  301    HB3  HIS  36           1HB      HIS  36   8.329   4.728   6.402
  302    HD1  HIS  36           HD1      HIS  36   4.922   4.311   5.496
  303    HD2  HIS  36           HD2      HIS  36   6.991   4.271   9.097
  304    HE1  HIS  36           HE1      HIS  36   3.447   3.073   7.110
  305    HE2  HIS  36           HE2      HIS  36   4.804   2.911   9.224
  306    H    ASP  37           H        ASP  37   6.082   7.338   5.041
  307    HA   ASP  37           HA       ASP  37   3.842   8.040   6.839
  308    HB2  ASP  37           2HB      ASP  37   4.444   9.163   4.083
  309    HB3  ASP  37           1HB      ASP  37   3.015   9.535   5.042
  310    H    TYR  38           H        TYR  38   1.677   7.833   5.460
  311    HA   TYR  38           HA       TYR  38   1.817   5.681   3.488
  312    HB2  TYR  38           2HB      TYR  38  -0.216   4.584   4.639
  313    HB3  TYR  38           1HB      TYR  38   1.381   4.303   5.316
  314    HD1  TYR  38           HD2      TYR  38   2.044   5.371   7.437
  315    HD2  TYR  38           HD1      TYR  38  -1.904   5.788   5.889
  316    HE1  TYR  38           HE2      TYR  38   1.263   6.120   9.645
  317    HE2  TYR  38           HE1      TYR  38  -2.689   6.531   8.094
  318    HH   TYR  38           HH       TYR  38  -0.535   7.346  10.649
  319    H    PHE  39           H        PHE  39   0.332   5.815   1.878
  320    HA   PHE  39           HA       PHE  39  -0.919   8.435   1.671
  321    HB2  PHE  39           2HB      PHE  39   0.556   6.873  -0.061
  322    HB3  PHE  39           1HB      PHE  39  -1.081   6.640  -0.657
  323    HD1  PHE  39           HD2      PHE  39   1.477   9.200   0.126
  324    HD2  PHE  39           HD1      PHE  39  -2.152   8.324  -1.933
  325    HE1  PHE  39           HE2      PHE  39   1.635  11.346  -1.069
  326    HE2  PHE  39           HE1      PHE  39  -1.993  10.464  -3.130
  327    HZ   PHE  39           HZ       PHE  39  -0.099  11.978  -2.703
  328    H    GLU  40           H        GLU  40  -2.891   8.025  -0.205
  329    HA   GLU  40           HA       GLU  40  -5.054   7.129   1.443
  330    HB2  GLU  40           2HB      GLU  40  -6.485   7.826  -0.482
  331    HB3  GLU  40           1HB      GLU  40  -5.408   9.086   0.104
  332    HG2  GLU  40           2HG      GLU  40  -3.891   8.682  -1.759
  333    HG3  GLU  40           1HG      GLU  40  -4.924   7.375  -2.334
  334    H    PHE  41           H        PHE  41  -5.154   4.960   1.733
  335    HA   PHE  41           HA       PHE  41  -5.015   3.099  -0.494
  336    HB2  PHE  41           2HB      PHE  41  -5.816   2.632   2.398
  337    HB3  PHE  41           1HB      PHE  41  -5.485   1.378   1.207
  338    HD1  PHE  41           HD1      PHE  41  -3.187   0.943   0.462
  339    HD2  PHE  41           HD2      PHE  41  -4.027   3.837   3.473
  340    HE1  PHE  41           HE1      PHE  41  -0.811   0.968   1.103
  341    HE2  PHE  41           HE2      PHE  41  -1.655   3.863   4.117
  342    HZ   PHE  41           HZ       PHE  41  -0.042   2.426   2.933
  343    H    PHE  42           H        PHE  42  -6.738   2.448  -1.691
  344    HA   PHE  42           HA       PHE  42  -9.170   3.814  -1.568
  345    HB2  PHE  42           2HB      PHE  42  -9.970   2.314  -3.301
  346    HB3  PHE  42           1HB      PHE  42  -8.299   2.752  -3.623
  347    HD1  PHE  42           HD2      PHE  42  -6.485   1.073  -3.149
  348    HD2  PHE  42           HD1      PHE  42 -10.622   0.058  -3.028
  349    HE1  PHE  42           HE2      PHE  42  -5.906  -1.306  -3.350
  350    HE2  PHE  42           HE1      PHE  42 -10.044  -2.328  -3.231
  351    HZ   PHE  42           HZ       PHE  42  -7.683  -3.009  -3.393
  352    H    ALA  43           H        ALA  43 -10.965   3.574  -0.409
  353    HA   ALA  43           HA       ALA  43 -11.289   1.168   1.243
  354    HB1  ALA  43           3HB      ALA  43 -12.685   3.840   1.443
  355    HB2  ALA  43           1HB      ALA  43 -11.302   3.322   2.404
  356    HB3  ALA  43           2HB      ALA  43 -12.849   2.491   2.570
  357    H    ALA  44           H        ALA  44 -12.255  -0.332  -0.057
  358    HA   ALA  44           HA       ALA  44 -14.975   0.264  -0.981
  359    HB1  ALA  44           3HB      ALA  44 -12.848  -1.013  -2.703
  360    HB2  ALA  44           1HB      ALA  44 -13.557   0.586  -2.929
  361    HB3  ALA  44           2HB      ALA  44 -14.553  -0.856  -3.131
  362    H    ASP  45           H        ASP  45 -15.899  -1.929  -1.944
  363    HA   ASP  45           HA       ASP  45 -15.516  -3.962   0.144
  364    HB2  ASP  45           2HB      ASP  45 -17.818  -3.359  -1.721
  365    HB3  ASP  45           1HB      ASP  45 -17.752  -4.806  -0.720
  366    H    LEU  46           H        LEU  46 -15.714  -6.231  -0.462
  367    HA   LEU  46           HA       LEU  46 -14.228  -6.894  -2.868
  368    HB2  LEU  46           2HB      LEU  46 -14.422  -9.247  -1.902
  369    HB3  LEU  46           1HB      LEU  46 -13.514  -8.075  -0.973
  370    HG   LEU  46           HG       LEU  46 -15.723  -7.743   0.360
  371   HD11  LEU  46          1HD1      LEU  46 -16.252 -10.472  -0.810
  372   HD12  LEU  46          2HD1      LEU  46 -17.178  -9.009  -1.141
  373   HD13  LEU  46          3HD1      LEU  46 -17.167  -9.693   0.482
  374   HD21  LEU  46          3HD2      LEU  46 -15.125  -9.564   1.881
  375   HD22  LEU  46          1HD2      LEU  46 -13.701  -8.697   1.303
  376   HD23  LEU  46          2HD2      LEU  46 -14.108 -10.275   0.627
  377    H    SER  47           H        SER  47 -16.881  -5.826  -3.203
  378    HA   SER  47           HA       SER  47 -18.840  -7.823  -3.649
  379    HB2  SER  47           2HB      SER  47 -18.667  -4.993  -4.728
  380    HB3  SER  47           1HB      SER  47 -20.107  -6.010  -4.755
  381    HG   SER  47           HG       SER  47 -19.563  -4.376  -2.904
  382    H    LEU  48           H        LEU  48 -19.720  -8.603  -5.604
  383    HA   LEU  48           HA       LEU  48 -17.970  -8.853  -7.870
  384    HB2  LEU  48           2HB      LEU  48 -20.870  -9.598  -7.444
  385    HB3  LEU  48           1HB      LEU  48 -20.030  -9.872  -8.958
  386    HG   LEU  48           HG       LEU  48 -20.101 -11.927  -7.697
  387   HD11  LEU  48          1HD1      LEU  48 -18.109 -11.498  -9.043
  388   HD12  LEU  48          2HD1      LEU  48 -17.740 -12.489  -7.633
  389   HD13  LEU  48          3HD1      LEU  48 -17.311 -10.777  -7.644
  390   HD21  LEU  48          3HD2      LEU  48 -18.673 -10.456  -5.476
  391   HD22  LEU  48          1HD2      LEU  48 -19.039 -12.182  -5.513
  392   HD23  LEU  48          2HD2      LEU  48 -20.349 -11.005  -5.446
  393    H    TYR  49           H        TYR  49 -18.763  -8.168 -10.128
  394    HA   TYR  49           HA       TYR  49 -19.011  -6.397 -11.543
  395    HB2  TYR  49           2HB      TYR  49 -21.383  -6.473 -10.883
  396    HB3  TYR  49           1HB      TYR  49 -21.042  -5.459  -9.489
  397    HD1  TYR  49           HD1      TYR  49 -20.563  -5.367 -13.212
  398    HD2  TYR  49           HD2      TYR  49 -21.597  -3.224  -9.674
  399    HE1  TYR  49           HE1      TYR  49 -21.063  -3.375 -14.563
  400    HE2  TYR  49           HE2      TYR  49 -22.093  -1.231 -11.020
  401    HH   TYR  49           HH       TYR  49 -21.668  -0.278 -13.133
  402    HA   PRO  50           HA       PRO  50 -15.879  -4.523  -8.848
  403    HB2  PRO  50           2HB      PRO  50 -13.957  -4.126 -10.693
  404    HB3  PRO  50           1HB      PRO  50 -14.360  -5.733 -10.078
  405    HG2  PRO  50           2HG      PRO  50 -15.245  -4.413 -12.627
  406    HG3  PRO  50           1HG      PRO  50 -14.630  -6.058 -12.381
  407    HD2  PRO  50           2HD      PRO  50 -17.282  -5.503 -12.581
  408    HD3  PRO  50           1HD      PRO  50 -16.655  -6.833 -11.583
  409    H    HIS  51           H        HIS  51 -14.678  -2.581  -8.608
  410    HA   HIS  51           HA       HIS  51 -16.084  -0.206  -9.436
  411    HB2  HIS  51           2HB      HIS  51 -15.171  -0.572  -7.146
  412    HB3  HIS  51           1HB      HIS  51 -13.543  -0.526  -7.805
  413    HD1  HIS  51           HD1      HIS  51 -12.555   1.788  -8.352
  414    HD2  HIS  51           HD2      HIS  51 -16.475   1.927  -6.966
  415    HE1  HIS  51           HE1      HIS  51 -13.007   4.204  -7.839
  416    HE2  HIS  51           HE2      HIS  51 -15.293   4.219  -6.799
  417    H    LEU  52           H        LEU  52 -14.421  -1.870 -11.395
  418    HA   LEU  52           HA       LEU  52 -13.175  -1.574 -13.251
  419    HB2  LEU  52           2HB      LEU  52 -14.594   0.391 -13.630
  420    HB3  LEU  52           1HB      LEU  52 -13.508   1.373 -12.666
  421    HG   LEU  52           HG       LEU  52 -11.715   1.021 -14.332
  422   HD11  LEU  52          1HD1      LEU  52 -12.236   0.015 -16.498
  423   HD12  LEU  52          2HD1      LEU  52 -13.842  -0.422 -15.914
  424   HD13  LEU  52          3HD1      LEU  52 -12.409  -1.150 -15.188
  425   HD21  LEU  52          3HD2      LEU  52 -12.663   2.430 -16.090
  426   HD22  LEU  52          1HD2      LEU  52 -13.155   2.987 -14.492
  427   HD23  LEU  52          2HD2      LEU  52 -14.290   2.089 -15.501
  428    H    TYR  53           H        TYR  53 -11.958   1.173 -11.291
  429    HA   TYR  53           HA       TYR  53  -9.276  -0.055 -11.440
  430    HB2  TYR  53           2HB      TYR  53  -8.368   2.274 -11.464
  431    HB3  TYR  53           1HB      TYR  53  -9.323   1.865 -12.883
  432    HD1  TYR  53           HD2      TYR  53  -9.392   3.743  -9.682
  433    HD2  TYR  53           HD1      TYR  53 -11.266   3.118 -13.454
  434    HE1  TYR  53           HE2      TYR  53 -10.780   5.737  -9.320
  435    HE2  TYR  53           HE1      TYR  53 -12.657   5.113 -13.098
  436    HH   TYR  53           HH       TYR  53 -13.457   6.518 -11.355
  437    H    SER  54           H        SER  54  -7.795   0.418  -9.734
  438    HA   SER  54           HA       SER  54  -8.452   1.798  -7.350
  439    HB2  SER  54           2HB      SER  54  -8.661  -0.138  -5.806
  440    HB3  SER  54           1HB      SER  54  -9.997  -0.067  -6.954
  441    HG   SER  54           HG       SER  54  -7.841  -1.872  -6.818
  442    H    ARG  55           H        ARG  55  -6.596   2.143  -6.138
  443    HA   ARG  55           HA       ARG  55  -4.322   0.354  -6.354
  444    HB2  ARG  55           2HB      ARG  55  -2.816   1.750  -7.460
  445    HB3  ARG  55           1HB      ARG  55  -4.294   1.956  -8.382
  446    HG2  ARG  55           2HG      ARG  55  -3.158   3.873  -6.345
  447    HG3  ARG  55           1HG      ARG  55  -3.181   4.081  -8.092
  448    HD2  ARG  55           2HD      ARG  55  -5.088   5.213  -7.816
  449    HD3  ARG  55           1HD      ARG  55  -5.852   3.672  -7.436
  450    HE   ARG  55           HE       ARG  55  -5.076   4.278  -5.037
  451   HH11  ARG  55          1HH1      ARG  55  -6.279   6.466  -7.407
  452   HH12  ARG  55          2HH1      ARG  55  -6.838   7.609  -6.234
  453   HH21  ARG  55          1HH2      ARG  55  -5.796   5.752  -3.529
  454   HH22  ARG  55          2HH2      ARG  55  -6.554   7.215  -4.054
  455    H    ALA  56           H        ALA  56  -2.337   1.412  -5.168
  456    HA   ALA  56           HA       ALA  56  -3.103   3.285  -3.060
  457    HB1  ALA  56           3HB      ALA  56  -1.968   0.557  -2.422
  458    HB2  ALA  56           1HB      ALA  56  -3.623   1.083  -2.113
  459    HB3  ALA  56           2HB      ALA  56  -2.281   1.850  -1.263
  460    H    TYR  57           H        TYR  57  -1.183   4.076  -1.823
  461    HA   TYR  57           HA       TYR  57   1.360   3.782  -3.299
  462    HB2  TYR  57           2HB      TYR  57   0.249   6.425  -2.311
  463    HB3  TYR  57           1HB      TYR  57   1.769   6.185  -3.162
  464    HD1  TYR  57           HD1      TYR  57  -1.879   6.373  -3.494
  465    HD2  TYR  57           HD2      TYR  57   1.796   5.811  -5.573
  466    HE1  TYR  57           HE1      TYR  57  -3.026   6.783  -5.628
  467    HE2  TYR  57           HE2      TYR  57   0.658   6.221  -7.710
  468    HH   TYR  57           HH       TYR  57  -2.441   7.562  -7.896
  469    H    ILE  58           H        ILE  58   3.274   4.195  -2.061
  470    HA   ILE  58           HA       ILE  58   2.895   4.400   0.870
  471    HB   ILE  58           HB       ILE  58   5.069   2.792  -0.504
  472   HG12  ILE  58          2HG1      ILE  58   2.571   1.756   0.876
  473   HG13  ILE  58          1HG1      ILE  58   2.805   1.801  -0.869
  474   HG21  ILE  58          1HG2      ILE  58   5.481   1.886   1.741
  475   HG22  ILE  58          2HG2      ILE  58   4.221   2.933   2.397
  476   HG23  ILE  58          3HG2      ILE  58   5.682   3.638   1.705
  477   HD11  ILE  58          3HD1      ILE  58   4.695   0.265  -0.647
  478   HD12  ILE  58          1HD1      ILE  58   3.208  -0.420   0.008
  479   HD13  ILE  58          2HD1      ILE  58   4.440   0.211   1.099
  480    H    ASN  59           H        ASN  59   4.507   5.593   2.008
  481    HA   ASN  59           HA       ASN  59   6.419   7.074   0.317
  482    HB2  ASN  59           2HB      ASN  59   4.486   8.516   0.867
  483    HB3  ASN  59           1HB      ASN  59   4.796   8.259   2.582
  484   HD21  ASN  59          1HD2      ASN  59   5.197  10.423   2.991
  485   HD22  ASN  59          2HD2      ASN  59   6.601  11.238   2.412
  486    H    PHE  60           H        PHE  60   8.450   7.122   1.029
  487    HA   PHE  60           HA       PHE  60   9.053   5.965   3.669
  488    HB2  PHE  60           2HB      PHE  60  10.624   6.147   1.099
  489    HB3  PHE  60           1HB      PHE  60  11.407   5.766   2.628
  490    HD1  PHE  60           HD2      PHE  60   8.445   4.645   0.618
  491    HD2  PHE  60           HD1      PHE  60  11.703   3.560   3.138
  492    HE1  PHE  60           HE2      PHE  60   7.875   2.270   0.332
  493    HE2  PHE  60           HE1      PHE  60  11.136   1.189   2.857
  494    HZ   PHE  60           HZ       PHE  60   9.221   0.536   1.449
  495    H    ARG  61           H        ARG  61  10.234   7.041   5.181
  496    HA   ARG  61           HA       ARG  61  11.189   9.752   4.508
  497    HB2  ARG  61           2HB      ARG  61  10.549   8.557   7.219
  498    HB3  ARG  61           1HB      ARG  61  11.154  10.185   6.951
  499    HG2  ARG  61           2HG      ARG  61   8.540   9.146   5.857
  500    HG3  ARG  61           1HG      ARG  61   8.704  10.053   7.360
  501    HD2  ARG  61           2HD      ARG  61   8.003  11.538   5.583
  502    HD3  ARG  61           1HD      ARG  61   9.640  11.953   6.088
  503    HE   ARG  61           HE       ARG  61   9.490  10.187   3.811
  504   HH11  ARG  61          1HH1      ARG  61   9.511  13.478   4.823
  505   HH12  ARG  61          2HH1      ARG  61  10.180  14.034   3.329
  506   HH21  ARG  61          1HH2      ARG  61  10.333  10.917   1.910
  507   HH22  ARG  61          2HH2      ARG  61  10.632  12.610   1.698
  508    H    ASN  62           H        ASN  62  12.129   6.661   5.893
  509    HA   ASN  62           HA       ASN  62  14.922   7.554   6.113
  510    HB2  ASN  62           2HB      ASN  62  13.909   6.375   8.051
  511    HB3  ASN  62           1HB      ASN  62  13.654   4.959   7.037
  512   HD21  ASN  62          1HD2      ASN  62  14.963   3.689   8.361
  513   HD22  ASN  62          2HD2      ASN  62  16.684   3.849   8.367
  514    HA   PRO  63           HA       PRO  63  15.543   5.567   2.090
  515    HB2  PRO  63           2HB      PRO  63  18.225   6.079   1.931
  516    HB3  PRO  63           1HB      PRO  63  16.977   7.276   1.561
  517    HG2  PRO  63           2HG      PRO  63  18.563   6.911   4.084
  518    HG3  PRO  63           1HG      PRO  63  18.161   8.409   3.223
  519    HD2  PRO  63           2HD      PRO  63  16.806   7.619   5.417
  520    HD3  PRO  63           1HD      PRO  63  16.008   8.476   4.082
  521    H    ASP  64           H        ASP  64  16.939   4.698   5.112
  522    HA   ASP  64           HA       ASP  64  18.504   2.480   4.168
  523    HB2  ASP  64           2HB      ASP  64  19.154   3.600   6.202
  524    HB3  ASP  64           1HB      ASP  64  17.582   3.297   6.927
  525    H    ASP  65           H        ASP  65  15.205   2.869   5.394
  526    HA   ASP  65           HA       ASP  65  14.744   0.045   5.663
  527    HB2  ASP  65           2HB      ASP  65  12.805   2.370   5.642
  528    HB3  ASP  65           1HB      ASP  65  12.363   0.704   6.006
  529    H    ILE  66           H        ILE  66  14.811   2.132   2.980
  530    HA   ILE  66           HA       ILE  66  12.804   1.096   1.320
  531    HB   ILE  66           HB       ILE  66  15.518   2.168   0.504
  532   HG12  ILE  66          2HG1      ILE  66  12.818   3.525   0.794
  533   HG13  ILE  66          1HG1      ILE  66  14.238   3.801   1.797
  534   HG21  ILE  66          1HG2      ILE  66  14.471   2.588  -1.691
  535   HG22  ILE  66          2HG2      ILE  66  13.010   1.769  -1.138
  536   HG23  ILE  66          3HG2      ILE  66  14.518   0.869  -1.298
  537   HD11  ILE  66          3HD1      ILE  66  13.948   5.608   0.235
  538   HD12  ILE  66          1HD1      ILE  66  13.948   4.481  -1.122
  539   HD13  ILE  66          2HD1      ILE  66  15.413   4.709  -0.162
  540    H    LEU  67           H        LEU  67  16.263   0.173   1.379
  541    HA   LEU  67           HA       LEU  67  15.917  -2.054  -0.359
  542    HB2  LEU  67           2HB      LEU  67  18.251  -2.658   0.405
  543    HB3  LEU  67           1HB      LEU  67  18.052  -1.081  -0.333
  544    HG   LEU  67           HG       LEU  67  17.956  -0.136   2.050
  545   HD11  LEU  67          1HD1      LEU  67  17.554  -2.182   3.279
  546   HD12  LEU  67          2HD1      LEU  67  19.087  -1.471   3.782
  547   HD13  LEU  67          3HD1      LEU  67  19.075  -2.865   2.699
  548   HD21  LEU  67          3HD2      LEU  67  19.873   0.166   0.585
  549   HD22  LEU  67          1HD2      LEU  67  20.519  -1.402   1.072
  550   HD23  LEU  67          2HD2      LEU  67  20.397  -0.090   2.249
  551    H    LEU  68           H        LEU  68  15.123  -1.678   2.878
  552    HA   LEU  68           HA       LEU  68  15.518  -4.437   3.676
  553    HB2  LEU  68           2HB      LEU  68  15.802  -2.793   5.381
  554    HB3  LEU  68           1HB      LEU  68  14.265  -2.040   5.007
  555    HG   LEU  68           HG       LEU  68  13.077  -4.021   5.874
  556   HD11  LEU  68          1HD1      LEU  68  15.832  -5.011   6.619
  557   HD12  LEU  68          2HD1      LEU  68  14.750  -5.727   5.424
  558   HD13  LEU  68          3HD1      LEU  68  14.307  -5.734   7.130
  559   HD21  LEU  68          3HD2      LEU  68  13.564  -3.654   8.243
  560   HD22  LEU  68          1HD2      LEU  68  13.519  -2.132   7.353
  561   HD23  LEU  68          2HD2      LEU  68  15.069  -2.837   7.815
  562    H    PHE  69           H        PHE  69  12.616  -2.340   3.502
  563    HA   PHE  69           HA       PHE  69  10.860  -4.565   3.774
  564    HB2  PHE  69           2HB      PHE  69  10.532  -1.632   3.405
  565    HB3  PHE  69           1HB      PHE  69   9.140  -2.664   3.081
  566    HD1  PHE  69           HD1      PHE  69  11.550  -1.585   5.669
  567    HD2  PHE  69           HD2      PHE  69   7.959  -3.725   4.844
  568    HE1  PHE  69           HE1      PHE  69  11.067  -1.713   8.079
  569    HE2  PHE  69           HE2      PHE  69   7.475  -3.851   7.246
  570    HZ   PHE  69           HZ       PHE  69   9.029  -2.843   8.871
  571    H    ARG  70           H        ARG  70  11.648  -2.508   0.927
  572    HA   ARG  70           HA       ARG  70   9.835  -3.668  -0.858
  573    HB2  ARG  70           2HB      ARG  70  11.249  -1.691  -1.422
  574    HB3  ARG  70           1HB      ARG  70  12.650  -2.757  -1.532
  575    HG2  ARG  70           2HG      ARG  70  11.163  -4.060  -3.251
  576    HG3  ARG  70           1HG      ARG  70  10.284  -2.537  -3.350
  577    HD2  ARG  70           2HD      ARG  70  12.335  -1.384  -3.998
  578    HD3  ARG  70           1HD      ARG  70  13.242  -2.890  -3.850
  579    HE   ARG  70           HE       ARG  70  11.622  -2.087  -6.053
  580   HH11  ARG  70          1HH1      ARG  70  12.804  -4.856  -4.349
  581   HH12  ARG  70          2HH1      ARG  70  12.437  -5.934  -5.650
  582   HH21  ARG  70          1HH2      ARG  70  11.164  -3.503  -7.694
  583   HH22  ARG  70          2HH2      ARG  70  11.503  -5.186  -7.498
  584    H    ASP  71           H        ASP  71  13.110  -4.664  -0.002
  585    HA   ASP  71           HA       ASP  71  13.505  -6.747  -1.776
  586    HB2  ASP  71           2HB      ASP  71  15.291  -5.872  -0.419
  587    HB3  ASP  71           1HB      ASP  71  14.479  -6.371   1.061
  588    H    ARG  72           H        ARG  72  11.844  -6.821   1.360
  589    HA   ARG  72           HA       ARG  72  11.391  -9.695   1.127
  590    HB2  ARG  72           2HB      ARG  72  10.368  -9.483   3.387
  591    HB3  ARG  72           1HB      ARG  72  12.037  -8.938   3.308
  592    HG2  ARG  72           2HG      ARG  72  11.448  -6.690   3.542
  593    HG3  ARG  72           1HG      ARG  72   9.777  -6.979   3.055
  594    HD2  ARG  72           2HD      ARG  72  11.046  -7.939   5.630
  595    HD3  ARG  72           1HD      ARG  72   9.968  -6.542   5.474
  596    HE   ARG  72           HE       ARG  72   8.816  -8.954   4.446
  597   HH11  ARG  72          1HH1      ARG  72   9.361  -7.219   7.381
  598   HH12  ARG  72          2HH1      ARG  72   7.997  -7.937   8.161
  599   HH21  ARG  72          1HH2      ARG  72   7.088  -9.843   5.458
  600   HH22  ARG  72          2HH2      ARG  72   6.719  -9.386   7.088
  601    H    PHE  73           H        PHE  73   9.708  -6.860   0.235
  602    HA   PHE  73           HA       PHE  73   7.109  -8.229   0.467
  603    HB2  PHE  73           2HB      PHE  73   7.879  -5.357   0.579
  604    HB3  PHE  73           1HB      PHE  73   6.296  -5.752  -0.082
  605    HD1  PHE  73           HD1      PHE  73   4.688  -7.072   1.317
  606    HD2  PHE  73           HD2      PHE  73   8.259  -5.395   2.929
  607    HE1  PHE  73           HE1      PHE  73   3.754  -7.268   3.581
  608    HE2  PHE  73           HE2      PHE  73   7.327  -5.594   5.195
  609    HZ   PHE  73           HZ       PHE  73   5.074  -6.530   5.526
  610    H    ASP  74           H        ASP  74   9.351  -7.150  -1.954
  611    HA   ASP  74           HA       ASP  74   7.449  -6.705  -4.024
  612    HB2  ASP  74           2HB      ASP  74   9.786  -5.867  -4.134
  613    HB3  ASP  74           1HB      ASP  74  10.350  -7.523  -4.345
  614    H    GLY  75           H        GLY  75   5.992  -8.277  -4.328
  615    HA2  GLY  75           2HA      GLY  75   5.376 -10.217  -5.593
  616    HA3  GLY  75           1HA      GLY  75   6.943 -10.923  -5.230
  617    H    TYR  76           H        TYR  76   4.814  -9.368  -2.900
  618    HA   TYR  76           HA       TYR  76   4.759 -11.839  -1.333
  619    HB2  TYR  76           2HB      TYR  76   5.414 -10.165   0.089
  620    HB3  TYR  76           1HB      TYR  76   4.515  -8.926  -0.770
  621    HD1  TYR  76           HD2      TYR  76   3.906 -11.907   1.441
  622    HD2  TYR  76           HD1      TYR  76   2.666  -8.022   0.227
  623    HE1  TYR  76           HE2      TYR  76   2.205 -11.900   3.215
  624    HE2  TYR  76           HE1      TYR  76   0.971  -7.999   1.985
  625    HH   TYR  76           HH       TYR  76  -0.302  -9.624   3.347
  626    H    ILE  77           H        ILE  77   3.098 -13.180  -1.639
  627    HA   ILE  77           HA       ILE  77   0.592 -12.283  -2.769
  628    HB   ILE  77           HB       ILE  77   1.393 -15.028  -1.774
  629   HG12  ILE  77          2HG1      ILE  77   2.745 -14.199  -3.694
  630   HG13  ILE  77          1HG1      ILE  77   1.763 -15.598  -4.112
  631   HG21  ILE  77          1HG2      ILE  77  -1.020 -14.806  -1.760
  632   HG22  ILE  77          2HG2      ILE  77  -0.530 -15.845  -3.098
  633   HG23  ILE  77          3HG2      ILE  77  -1.005 -14.175  -3.409
  634   HD11  ILE  77          3HD1      ILE  77   1.778 -13.927  -5.881
  635   HD12  ILE  77          1HD1      ILE  77   1.110 -12.735  -4.767
  636   HD13  ILE  77          2HD1      ILE  77   0.159 -14.148  -5.218
  637    H    PHE  78           H        PHE  78  -0.737 -11.186  -1.458
  638    HA   PHE  78           HA       PHE  78  -1.289 -12.202   1.248
  639    HB2  PHE  78           2HB      PHE  78  -0.799  -9.840   1.183
  640    HB3  PHE  78           1HB      PHE  78  -1.972  -9.578  -0.104
  641    HD1  PHE  78           HD1      PHE  78  -1.673 -10.592   3.466
  642    HD2  PHE  78           HD2      PHE  78  -4.189  -9.041   0.396
  643    HE1  PHE  78           HE1      PHE  78  -3.406 -10.099   5.138
  644    HE2  PHE  78           HE2      PHE  78  -5.923  -8.549   2.065
  645    HZ   PHE  78           HZ       PHE  78  -5.533  -9.073   4.441
  646    H    LEU  79           H        LEU  79  -3.380 -12.811   1.902
  647    HA   LEU  79           HA       LEU  79  -5.339 -13.141  -0.285
  648    HB2  LEU  79           2HB      LEU  79  -4.599 -15.032   1.938
  649    HB3  LEU  79           1HB      LEU  79  -6.086 -15.203   1.022
  650    HG   LEU  79           HG       LEU  79  -3.365 -15.186  -0.293
  651   HD11  LEU  79          1HD1      LEU  79  -3.452 -17.034   1.302
  652   HD12  LEU  79          2HD1      LEU  79  -3.513 -17.627  -0.358
  653   HD13  LEU  79          3HD1      LEU  79  -4.987 -17.568   0.612
  654   HD21  LEU  79          3HD2      LEU  79  -4.572 -16.261  -2.134
  655   HD22  LEU  79          1HD2      LEU  79  -5.236 -14.673  -1.759
  656   HD23  LEU  79          2HD2      LEU  79  -6.078 -16.128  -1.225
  657    H    ASP  80           H        ASP  80  -7.338 -12.404   0.023
  658    HA   ASP  80           HA       ASP  80  -8.152 -11.229   2.540
  659    HB2  ASP  80           2HB      ASP  80  -8.807 -10.077   0.541
  660    HB3  ASP  80           1HB      ASP  80  -9.512 -11.535  -0.149
  661    H    SER  81           H        SER  81 -10.415 -11.768   3.395
  662    HA   SER  81           HA       SER  81 -10.557 -14.411   4.298
  663    HB2  SER  81           2HB      SER  81 -12.791 -12.369   4.129
  664    HB3  SER  81           1HB      SER  81 -12.817 -13.836   5.112
  665    HG   SER  81           HG       SER  81 -11.638 -11.430   5.605
  666    H    LYS  82           H        LYS  82 -11.844 -13.009   1.370
  667    HA   LYS  82           HA       LYS  82 -13.518 -15.308   0.759
  668    HB2  LYS  82           2HB      LYS  82 -12.774 -12.871  -0.876
  669    HB3  LYS  82           1HB      LYS  82 -13.900 -14.113  -1.405
  670    HG2  LYS  82           2HG      LYS  82 -14.263 -12.419   1.062
  671    HG3  LYS  82           1HG      LYS  82 -14.999 -12.086  -0.507
  672    HD2  LYS  82           2HD      LYS  82 -16.203 -14.200  -0.420
  673    HD3  LYS  82           1HD      LYS  82 -15.423 -14.608   1.110
  674    HE2  LYS  82           2HE      LYS  82 -16.519 -12.737   2.200
  675    HE3  LYS  82           1HE      LYS  82 -17.226 -12.224   0.667
  676    HZ1  LYS  82           3HZ      LYS  82 -18.560 -14.161   0.594
  677    HZ2  LYS  82           1HZ      LYS  82 -18.739 -13.512   2.145
  678    HZ3  LYS  82           2HZ      LYS  82 -17.758 -14.867   1.904
  679    H    GLY  83           H        GLY  83 -10.307 -15.029   0.808
  680    HA2  GLY  83           2HA      GLY  83  -8.658 -16.386  -0.072
  681    HA3  GLY  83           1HA      GLY  83  -9.877 -17.169  -1.063
  682    H    LEU  84           H        LEU  84  -9.538 -13.712  -1.209
  683    HA   LEU  84           HA       LEU  84  -8.948 -13.809  -4.014
  684    HB2  LEU  84           2HB      LEU  84  -9.041 -11.458  -2.116
  685    HB3  LEU  84           1HB      LEU  84  -8.963 -11.344  -3.866
  686    HG   LEU  84           HG       LEU  84 -11.247 -12.538  -2.278
  687   HD11  LEU  84          1HD1      LEU  84 -11.159 -10.117  -2.066
  688   HD12  LEU  84          2HD1      LEU  84 -12.526 -10.601  -3.068
  689   HD13  LEU  84          3HD1      LEU  84 -11.070  -9.946  -3.820
  690   HD21  LEU  84          3HD2      LEU  84 -10.936 -12.135  -5.258
  691   HD22  LEU  84          1HD2      LEU  84 -12.414 -12.650  -4.444
  692   HD23  LEU  84          2HD2      LEU  84 -10.985 -13.680  -4.410
  693    H    GLU  85           H        GLU  85  -7.004 -13.908  -4.943
  694    HA   GLU  85           HA       GLU  85  -4.584 -13.742  -3.398
  695    HB2  GLU  85           2HB      GLU  85  -5.076 -14.232  -6.344
  696    HB3  GLU  85           1HB      GLU  85  -3.489 -14.292  -5.590
  697    HG2  GLU  85           2HG      GLU  85  -4.198 -16.146  -4.184
  698    HG3  GLU  85           1HG      GLU  85  -5.822 -16.060  -4.864
  699    H    TYR  86           H        TYR  86  -3.627 -11.870  -2.938
  700    HA   TYR  86           HA       TYR  86  -3.582  -9.705  -4.951
  701    HB2  TYR  86           2HB      TYR  86  -3.002  -9.513  -1.979
  702    HB3  TYR  86           1HB      TYR  86  -3.084  -8.172  -3.115
  703    HD1  TYR  86           HD1      TYR  86  -5.284  -7.466  -4.039
  704    HD2  TYR  86           HD2      TYR  86  -4.979 -10.464  -1.037
  705    HE1  TYR  86           HE1      TYR  86  -7.675  -7.195  -3.531
  706    HE2  TYR  86           HE2      TYR  86  -7.360 -10.201  -0.528
  707    HH   TYR  86           HH       TYR  86  -9.504  -8.558  -2.524
  708    HA   PRO  87           HA       PRO  87   0.797 -10.983  -4.970
  709    HB2  PRO  87           2HB      PRO  87   1.124 -10.100  -7.637
  710    HB3  PRO  87           1HB      PRO  87   0.861 -11.757  -7.093
  711    HG2  PRO  87           2HG      PRO  87  -0.924 -10.165  -8.595
  712    HG3  PRO  87           1HG      PRO  87  -1.273 -11.733  -7.851
  713    HD2  PRO  87           2HD      PRO  87  -1.962  -8.996  -6.924
  714    HD3  PRO  87           1HD      PRO  87  -2.794 -10.537  -6.623
  715    H    ALA  88           H        ALA  88   1.192  -9.248  -3.474
  716    HA   ALA  88           HA       ALA  88   1.236  -6.526  -4.174
  717    HB1  ALA  88           3HB      ALA  88   2.703  -7.942  -1.948
  718    HB2  ALA  88           1HB      ALA  88   1.073  -7.274  -1.866
  719    HB3  ALA  88           2HB      ALA  88   2.458  -6.201  -2.064
  720    H    VAL  89           H        VAL  89   2.408  -6.130  -6.040
  721    HA   VAL  89           HA       VAL  89   5.278  -6.699  -6.086
  722    HB   VAL  89           HB       VAL  89   3.534  -5.291  -8.132
  723   HG11  VAL  89          1HG1      VAL  89   6.403  -6.220  -8.361
  724   HG12  VAL  89          2HG1      VAL  89   5.860  -4.544  -8.270
  725   HG13  VAL  89          3HG1      VAL  89   5.431  -5.535  -9.663
  726   HG21  VAL  89          3HG2      VAL  89   2.955  -7.649  -7.886
  727   HG22  VAL  89          1HG2      VAL  89   4.646  -8.105  -8.102
  728   HG23  VAL  89          2HG2      VAL  89   3.753  -7.365  -9.432
  729    H    VAL  90           H        VAL  90   6.751  -5.277  -5.343
  730    HA   VAL  90           HA       VAL  90   5.845  -2.528  -4.747
  731    HB   VAL  90           HB       VAL  90   8.124  -4.047  -3.455
  732   HG11  VAL  90          1HG1      VAL  90   6.824  -1.425  -2.698
  733   HG12  VAL  90          2HG1      VAL  90   8.423  -1.618  -3.415
  734   HG13  VAL  90          3HG1      VAL  90   8.101  -2.244  -1.798
  735   HG21  VAL  90          3HG2      VAL  90   5.968  -5.079  -2.917
  736   HG22  VAL  90          1HG2      VAL  90   5.340  -3.515  -2.396
  737   HG23  VAL  90          2HG2      VAL  90   6.655  -4.279  -1.503
  738    H    GLU  91           H        GLU  91   6.514  -1.163  -6.317
  739    HA   GLU  91           HA       GLU  91   9.339  -1.334  -7.180
  740    HB2  GLU  91           2HB      GLU  91   8.709  -0.260  -9.270
  741    HB3  GLU  91           1HB      GLU  91   7.747  -1.713  -9.038
  742    HG2  GLU  91           2HG      GLU  91   5.813  -0.465  -8.492
  743    HG3  GLU  91           1HG      GLU  91   6.736   1.023  -8.303
  744    H    PHE  92           H        PHE  92  10.580   0.549  -7.154
  745    HA   PHE  92           HA       PHE  92   9.766   2.544  -5.275
  746    HB2  PHE  92           2HB      PHE  92  11.933   3.533  -5.588
  747    HB3  PHE  92           1HB      PHE  92  12.138   1.786  -5.580
  748    HD1  PHE  92           HD1      PHE  92  12.247   0.623  -7.881
  749    HD2  PHE  92           HD2      PHE  92  12.831   4.802  -7.320
  750    HE1  PHE  92           HE1      PHE  92  13.437   0.742 -10.031
  751    HE2  PHE  92           HE2      PHE  92  14.016   4.930  -9.473
  752    HZ   PHE  92           HZ       PHE  92  14.317   2.899 -10.832
  753    H    ALA  93           H        ALA  93   9.061   4.631  -5.603
  754    HA   ALA  93           HA       ALA  93   8.218   5.402  -8.256
  755    HB1  ALA  93           3HB      ALA  93   6.837   5.988  -6.324
  756    HB2  ALA  93           1HB      ALA  93   7.368   7.435  -7.181
  757    HB3  ALA  93           2HB      ALA  93   8.151   6.968  -5.671
  758    HA   PRO  94           HA       PRO  94  12.274   6.716  -9.313
  759    HB2  PRO  94           2HB      PRO  94  11.663   8.170 -11.565
  760    HB3  PRO  94           1HB      PRO  94  11.731   6.407 -11.506
  761    HG2  PRO  94           2HG      PRO  94   9.343   8.212 -11.290
  762    HG3  PRO  94           1HG      PRO  94   9.538   6.727 -12.246
  763    HD2  PRO  94           2HD      PRO  94   8.231   6.691  -9.913
  764    HD3  PRO  94           1HD      PRO  94   9.298   5.346 -10.378
  765    H    PHE  95           H        PHE  95  13.655   8.359  -8.989
  766    HA   PHE  95           HA       PHE  95  12.906  10.736  -7.670
  767    HB2  PHE  95           2HB      PHE  95  15.105   9.738  -7.390
  768    HB3  PHE  95           1HB      PHE  95  15.461   9.937  -9.100
  769    HD1  PHE  95           HD1      PHE  95  14.922  11.769  -5.923
  770    HD2  PHE  95           HD2      PHE  95  16.402  11.949  -9.915
  771    HE1  PHE  95           HE1      PHE  95  15.992  13.928  -5.431
  772    HE2  PHE  95           HE2      PHE  95  17.471  14.110  -9.423
  773    HZ   PHE  95           HZ       PHE  95  17.267  15.099  -7.177
  774    H    GLN  96           H        GLN  96  13.155  12.961  -8.423
  775    HA   GLN  96           HA       GLN  96  11.819  13.735 -10.662
  776    HB2  GLN  96           2HB      GLN  96  12.472  15.323  -8.943
  777    HB3  GLN  96           1HB      GLN  96  14.168  15.135  -9.359
  778    HG2  GLN  96           2HG      GLN  96  13.268  17.236 -10.202
  779    HG3  GLN  96           1HG      GLN  96  13.781  16.186 -11.522
  780   HE21  GLN  96          1HE2      GLN  96  12.238  15.353 -12.924
  781   HE22  GLN  96          2HE2      GLN  96  10.603  15.910 -12.945
  782    H    LYS  97           H        LYS  97  12.110  13.143 -12.719
  783    HA   LYS  97           HA       LYS  97  14.460  12.116 -13.827
  784    HB2  LYS  97           2HB      LYS  97  12.166  11.748 -14.718
  785    HB3  LYS  97           1HB      LYS  97  12.147  13.400 -15.305
  786    HG2  LYS  97           2HG      LYS  97  12.711  12.297 -17.224
  787    HG3  LYS  97           1HG      LYS  97  14.320  12.642 -16.590
  788    HD2  LYS  97           2HD      LYS  97  12.826  10.037 -16.194
  789    HD3  LYS  97           1HD      LYS  97  14.047  10.310 -17.434
  790    HE2  LYS  97           2HE      LYS  97  15.712  10.754 -15.668
  791    HE3  LYS  97           1HE      LYS  97  14.482  10.437 -14.445
  792    HZ1  LYS  97           3HZ      LYS  97  14.275   8.183 -15.306
  793    HZ2  LYS  97           1HZ      LYS  97  15.856   8.507 -14.802
  794    HZ3  LYS  97           2HZ      LYS  97  15.483   8.490 -16.448
  Start of MODEL    4
    1    H1   MET   1           1H       MET   1  30.345  15.392  -3.090
    2    H2   MET   1           2H       MET   1  31.824  14.601  -3.286
    3    H3   MET   1           3H       MET   1  30.384  13.718  -3.326
    4    HA   MET   1           HA       MET   1  31.273  15.745  -5.295
    5    HB2  MET   1           2HB      MET   1  30.907  12.748  -5.563
    6    HB3  MET   1           1HB      MET   1  31.345  13.841  -6.871
    7    HG2  MET   1           2HG      MET   1  33.413  14.422  -5.607
    8    HG3  MET   1           1HG      MET   1  32.987  13.183  -4.427
    9    HE1  MET   1           3HE      MET   1  31.690  10.962  -6.414
   10    HE2  MET   1           1HE      MET   1  32.759  10.575  -5.064
   11    HE3  MET   1           2HE      MET   1  33.102   9.935  -6.671
   12    H    GLY   2           H        GLY   2  29.700  16.701  -6.431
   13    HA2  GLY   2           2HA      GLY   2  27.668  16.902  -7.575
   14    HA3  GLY   2           1HA      GLY   2  27.150  15.370  -6.895
   15    H    HIS   3           H        HIS   3  26.788  18.719  -6.752
   16    HA   HIS   3           HA       HIS   3  25.950  18.855  -3.976
   17    HB2  HIS   3           2HB      HIS   3  26.021  20.871  -6.217
   18    HB3  HIS   3           1HB      HIS   3  25.286  21.235  -4.659
   19    HD1  HIS   3           HD1      HIS   3  26.818  21.812  -2.752
   20    HD2  HIS   3           HD2      HIS   3  28.878  20.462  -6.099
   21    HE1  HIS   3           HE1      HIS   3  29.240  22.235  -2.264
   22    HE2  HIS   3           HE2      HIS   3  30.476  21.277  -4.229
   23    H    HIS   4           H        HIS   4  24.481  17.465  -6.474
   24    HA   HIS   4           HA       HIS   4  21.795  18.194  -5.474
   25    HB2  HIS   4           2HB      HIS   4  22.504  17.136  -8.224
   26    HB3  HIS   4           1HB      HIS   4  20.887  17.544  -7.656
   27    HD1  HIS   4           HD1      HIS   4  20.841  20.229  -6.738
   28    HD2  HIS   4           HD2      HIS   4  23.550  19.145  -9.697
   29    HE1  HIS   4           HE1      HIS   4  21.500  22.371  -7.861
   30    HE2  HIS   4           HE2      HIS   4  23.091  21.694  -9.684
   31    H    HIS   5           H        HIS   5  20.195  16.262  -5.963
   32    HA   HIS   5           HA       HIS   5  21.187  14.065  -4.413
   33    HB2  HIS   5           2HB      HIS   5  18.543  14.336  -5.866
   34    HB3  HIS   5           1HB      HIS   5  18.929  13.131  -4.641
   35    HD1  HIS   5           HD1      HIS   5  19.760  14.376  -2.247
   36    HD2  HIS   5           HD2      HIS   5  17.253  16.466  -4.819
   37    HE1  HIS   5           HE1      HIS   5  18.715  16.176  -0.853
   38    HE2  HIS   5           HE2      HIS   5  17.353  17.531  -2.468
   39    H    HIS   6           H        HIS   6  22.885  13.170  -5.663
   40    HA   HIS   6           HA       HIS   6  22.417  12.104  -8.285
   41    HB2  HIS   6           2HB      HIS   6  24.679  12.751  -7.417
   42    HB3  HIS   6           1HB      HIS   6  24.621  11.361  -6.339
   43    HD1  HIS   6           HD1      HIS   6  24.944  12.261  -9.979
   44    HD2  HIS   6           HD2      HIS   6  25.198   8.909  -7.532
   45    HE1  HIS   6           HE1      HIS   6  25.910  10.451 -11.419
   46    HE2  HIS   6           HE2      HIS   6  26.142   8.461  -9.900
   47    H    HIS   7           H        HIS   7  22.324  10.805  -5.003
   48    HA   HIS   7           HA       HIS   7  21.551   8.154  -5.831
   49    HB2  HIS   7           2HB      HIS   7  21.373   9.548  -3.145
   50    HB3  HIS   7           1HB      HIS   7  20.969   7.855  -3.409
   51    HD1  HIS   7           HD1      HIS   7  23.255   8.790  -1.493
   52    HD2  HIS   7           HD2      HIS   7  23.792   7.529  -5.418
   53    HE1  HIS   7           HE1      HIS   7  25.639   8.026  -1.637
   54    HE2  HIS   7           HE2      HIS   7  25.877   7.081  -3.952
   55    H    HIS   8           H        HIS   8  19.412   7.209  -5.462
   56    HA   HIS   8           HA       HIS   8  17.345   8.954  -6.415
   57    HB2  HIS   8           2HB      HIS   8  15.916   6.997  -6.479
   58    HB3  HIS   8           1HB      HIS   8  17.500   6.581  -7.119
   59    HD1  HIS   8           HD1      HIS   8  15.433   6.153  -3.971
   60    HD2  HIS   8           HD2      HIS   8  18.700   4.441  -5.892
   61    HE1  HIS   8           HE1      HIS   8  15.949   4.061  -2.685
   62    HE2  HIS   8           HE2      HIS   8  18.038   3.151  -3.750
   63    H    SER   9           H        SER   9  15.420   9.577  -5.418
   64    HA   SER   9           HA       SER   9  15.672  10.056  -2.567
   65    HB2  SER   9           2HB      SER   9  13.531  10.915  -4.536
   66    HB3  SER   9           1HB      SER   9  13.647  11.462  -2.863
   67    HG   SER   9           HG       SER   9  15.720  11.797  -4.774
   68    H    HIS  10           H        HIS  10  13.358  10.019  -1.393
   69    HA   HIS  10           HA       HIS  10  12.521   7.223  -1.439
   70    HB2  HIS  10           2HB      HIS  10  11.316   7.844   0.697
   71    HB3  HIS  10           1HB      HIS  10  13.066   7.989   0.741
   72    HD1  HIS  10           HD1      HIS  10  13.947  10.141   1.608
   73    HD2  HIS  10           HD2      HIS  10   9.993  10.483   0.374
   74    HE1  HIS  10           HE1      HIS  10  13.230  12.447   2.283
   75    HE2  HIS  10           HE2      HIS  10  10.856  12.653   1.483
   76    H    MET  11           H        MET  11  10.942   6.729  -2.826
   77    HA   MET  11           HA       MET  11   8.317   7.792  -2.490
   78    HB2  MET  11           2HB      MET  11   9.272   9.597  -3.880
   79    HB3  MET  11           1HB      MET  11   9.707   8.418  -5.111
   80    HG2  MET  11           2HG      MET  11   7.675   9.656  -5.684
   81    HG3  MET  11           1HG      MET  11   7.372   7.928  -5.516
   82    HE1  MET  11           3HE      MET  11   6.192  11.057  -2.322
   83    HE2  MET  11           1HE      MET  11   7.014  11.460  -3.829
   84    HE3  MET  11           2HE      MET  11   7.859  10.543  -2.582
   85    H    VAL  12           H        VAL  12   7.343   5.847  -2.426
   86    HA   VAL  12           HA       VAL  12   7.832   3.935  -4.619
   87    HB   VAL  12           HB       VAL  12   7.703   3.240  -1.669
   88   HG11  VAL  12          1HG1      VAL  12   8.004   1.420  -4.062
   89   HG12  VAL  12          2HG1      VAL  12   6.592   1.529  -3.010
   90   HG13  VAL  12          3HG1      VAL  12   8.121   0.927  -2.371
   91   HG21  VAL  12          3HG2      VAL  12  10.013   2.463  -1.972
   92   HG22  VAL  12          1HG2      VAL  12   9.859   4.184  -2.326
   93   HG23  VAL  12          2HG2      VAL  12   9.981   3.020  -3.645
   94    H    VAL  13           H        VAL  13   6.093   2.772  -5.323
   95    HA   VAL  13           HA       VAL  13   3.493   3.260  -4.006
   96    HB   VAL  13           HB       VAL  13   2.407   3.174  -6.197
   97   HG11  VAL  13          1HG1      VAL  13   3.082   5.352  -5.341
   98   HG12  VAL  13          2HG1      VAL  13   3.211   5.312  -7.100
   99   HG13  VAL  13          3HG1      VAL  13   4.663   5.184  -6.106
  100   HG21  VAL  13          3HG2      VAL  13   5.203   2.953  -7.333
  101   HG22  VAL  13          1HG2      VAL  13   3.735   3.218  -8.276
  102   HG23  VAL  13          2HG2      VAL  13   3.952   1.712  -7.385
  103    H    ILE  14           H        ILE  14   2.028   1.523  -3.912
  104    HA   ILE  14           HA       ILE  14   3.220  -1.123  -4.374
  105    HB   ILE  14           HB       ILE  14   2.167  -0.471  -2.138
  106   HG12  ILE  14          2HG1      ILE  14   0.988  -2.742  -1.927
  107   HG13  ILE  14          1HG1      ILE  14   1.378  -2.975  -3.626
  108   HG21  ILE  14          1HG2      ILE  14  -0.405  -0.901  -3.653
  109   HG22  ILE  14          2HG2      ILE  14   0.163   0.626  -2.979
  110   HG23  ILE  14          3HG2      ILE  14  -0.250  -0.713  -1.907
  111   HD11  ILE  14          3HD1      ILE  14   3.756  -2.759  -3.108
  112   HD12  ILE  14          1HD1      ILE  14   3.002  -4.055  -2.177
  113   HD13  ILE  14          2HD1      ILE  14   3.359  -2.513  -1.405
  114    H    ARG  15           H        ARG  15   2.627  -2.357  -6.084
  115    HA   ARG  15           HA       ARG  15   0.252  -1.507  -7.611
  116    HB2  ARG  15           2HB      ARG  15   3.004  -2.167  -8.636
  117    HB3  ARG  15           1HB      ARG  15   1.591  -2.188  -9.682
  118    HG2  ARG  15           2HG      ARG  15   2.488   0.214  -8.087
  119    HG3  ARG  15           1HG      ARG  15   2.896  -0.074  -9.780
  120    HD2  ARG  15           2HD      ARG  15   1.007   1.462  -9.602
  121    HD3  ARG  15           1HD      ARG  15   0.505  -0.051 -10.355
  122    HE   ARG  15           HE       ARG  15   0.038   0.426  -7.491
  123   HH11  ARG  15          1HH1      ARG  15  -1.197  -0.199 -10.649
  124   HH12  ARG  15          2HH1      ARG  15  -2.761  -0.652 -10.060
  125   HH21  ARG  15          1HH2      ARG  15  -1.964  -0.184  -6.761
  126   HH22  ARG  15          2HH2      ARG  15  -3.201  -0.615  -7.892
  127    H    ARG  16           H        ARG  16  -0.326  -3.129  -9.381
  128    HA   ARG  16           HA       ARG  16  -1.270  -5.111  -9.920
  129    HB2  ARG  16           2HB      ARG  16   1.131  -5.938  -8.513
  130    HB3  ARG  16           1HB      ARG  16  -0.175  -7.077  -8.228
  131    HG2  ARG  16           2HG      ARG  16   0.879  -6.214 -10.919
  132    HG3  ARG  16           1HG      ARG  16   1.164  -7.765 -10.125
  133    HD2  ARG  16           2HD      ARG  16  -1.336  -8.108 -10.141
  134    HD3  ARG  16           1HD      ARG  16  -1.455  -6.676 -11.165
  135    HE   ARG  16           HE       ARG  16   0.268  -8.860 -12.054
  136   HH11  ARG  16          1HH1      ARG  16  -2.676  -7.093 -12.423
  137   HH12  ARG  16          2HH1      ARG  16  -3.044  -7.829 -13.942
  138   HH21  ARG  16          1HH2      ARG  16  -0.215  -9.776 -14.006
  139   HH22  ARG  16          2HH2      ARG  16  -1.669  -9.332 -14.828
  140    H    LEU  17           H        LEU  17  -1.976  -3.457  -7.407
  141    HA   LEU  17           HA       LEU  17  -3.389  -5.346  -5.733
  142    HB2  LEU  17           2HB      LEU  17  -3.060  -2.366  -5.762
  143    HB3  LEU  17           1HB      LEU  17  -4.347  -3.073  -4.809
  144    HG   LEU  17           HG       LEU  17  -2.330  -2.577  -3.479
  145   HD11  LEU  17          1HD1      LEU  17  -2.208  -4.704  -2.314
  146   HD12  LEU  17          2HD1      LEU  17  -2.905  -5.534  -3.707
  147   HD13  LEU  17          3HD1      LEU  17  -3.868  -4.367  -2.799
  148   HD21  LEU  17          3HD2      LEU  17  -0.627  -2.956  -5.172
  149   HD22  LEU  17          1HD2      LEU  17  -1.011  -4.678  -5.204
  150   HD23  LEU  17          2HD2      LEU  17  -0.319  -3.953  -3.751
  151    HA   PRO  18           HA       PRO  18  -7.142  -4.888  -8.263
  152    HB2  PRO  18           2HB      PRO  18  -8.214  -7.275  -7.717
  153    HB3  PRO  18           1HB      PRO  18  -6.811  -7.135  -8.784
  154    HG2  PRO  18           2HG      PRO  18  -6.936  -7.981  -5.919
  155    HG3  PRO  18           1HG      PRO  18  -5.934  -8.621  -7.234
  156    HD2  PRO  18           2HD      PRO  18  -5.107  -6.770  -5.301
  157    HD3  PRO  18           1HD      PRO  18  -4.283  -7.098  -6.836
  158    HA   PRO  19           HA       PRO  19  -9.970  -3.433  -5.129
  159    HB2  PRO  19           2HB      PRO  19 -12.390  -3.982  -6.332
  160    HB3  PRO  19           1HB      PRO  19 -11.371  -2.598  -6.736
  161    HG2  PRO  19           2HG      PRO  19 -11.609  -5.241  -8.127
  162    HG3  PRO  19           1HG      PRO  19 -11.508  -3.614  -8.827
  163    HD2  PRO  19           2HD      PRO  19  -9.370  -5.246  -8.753
  164    HD3  PRO  19           1HD      PRO  19  -9.204  -3.493  -8.524
  165    H    GLY  20           H        GLY  20 -10.080  -4.587  -3.268
  166    HA2  GLY  20           2HA      GLY  20 -11.918  -6.851  -3.127
  167    HA3  GLY  20           1HA      GLY  20 -10.243  -7.196  -2.736
  168    H    LEU  21           H        LEU  21  -9.292  -5.780  -0.968
  169    HA   LEU  21           HA       LEU  21 -11.306  -5.569   1.167
  170    HB2  LEU  21           2HB      LEU  21  -9.643  -6.066   2.769
  171    HB3  LEU  21           1HB      LEU  21  -9.459  -7.223   1.467
  172    HG   LEU  21           HG       LEU  21  -7.688  -4.821   1.967
  173   HD11  LEU  21          1HD1      LEU  21  -7.433  -6.583   3.635
  174   HD12  LEU  21          2HD1      LEU  21  -6.001  -6.443   2.615
  175   HD13  LEU  21          3HD1      LEU  21  -7.146  -7.761   2.354
  176   HD21  LEU  21          3HD2      LEU  21  -6.199  -5.897   0.269
  177   HD22  LEU  21          1HD2      LEU  21  -7.695  -5.235  -0.385
  178   HD23  LEU  21          2HD2      LEU  21  -7.535  -6.975  -0.139
  179    H    THR  22           H        THR  22 -11.303  -3.880   2.651
  180    HA   THR  22           HA       THR  22 -10.564  -1.301   1.540
  181    HB   THR  22           HB       THR  22 -12.068  -2.017   4.078
  182    HG1  THR  22           HG1      THR  22 -12.805  -2.060   1.520
  183   HG21  THR  22          3HG2      THR  22 -11.737   0.669   2.725
  184   HG22  THR  22          1HG2      THR  22 -11.077   0.204   4.292
  185   HG23  THR  22          2HG2      THR  22 -12.823   0.333   4.074
  186    H    LYS  23           H        LYS  23  -9.404   0.338   2.753
  187    HA   LYS  23           HA       LYS  23  -6.909  -0.273   3.599
  188    HB2  LYS  23           2HB      LYS  23  -6.823   1.912   4.741
  189    HB3  LYS  23           1HB      LYS  23  -7.554   1.999   3.144
  190    HG2  LYS  23           2HG      LYS  23  -9.709   2.331   4.014
  191    HG3  LYS  23           1HG      LYS  23  -9.240   1.767   5.621
  192    HD2  LYS  23           2HD      LYS  23  -9.514   4.217   5.529
  193    HD3  LYS  23           1HD      LYS  23  -7.871   3.742   5.958
  194    HE2  LYS  23           2HE      LYS  23  -7.260   4.058   3.531
  195    HE3  LYS  23           1HE      LYS  23  -8.864   4.751   3.290
  196    HZ1  LYS  23           3HZ      LYS  23  -6.792   5.781   5.154
  197    HZ2  LYS  23           1HZ      LYS  23  -8.331   6.445   4.929
  198    HZ3  LYS  23           2HZ      LYS  23  -7.215   6.462   3.667
  199    H    GLU  24           H        GLU  24  -9.756  -0.275   5.710
  200    HA   GLU  24           HA       GLU  24  -8.631  -0.304   8.215
  201    HB2  GLU  24           2HB      GLU  24 -10.922  -2.071   7.327
  202    HB3  GLU  24           1HB      GLU  24 -10.578  -1.567   8.977
  203    HG2  GLU  24           2HG      GLU  24 -10.951   0.793   8.265
  204    HG3  GLU  24           1HG      GLU  24 -11.449   0.188   6.685
  205    H    GLN  25           H        GLN  25  -8.841  -2.997   5.951
  206    HA   GLN  25           HA       GLN  25  -7.071  -4.619   7.664
  207    HB2  GLN  25           2HB      GLN  25  -8.523  -5.360   5.106
  208    HB3  GLN  25           1HB      GLN  25  -7.549  -6.451   6.084
  209    HG2  GLN  25           2HG      GLN  25  -9.124  -6.227   7.931
  210    HG3  GLN  25           1HG      GLN  25 -10.089  -5.096   6.978
  211   HE21  GLN  25          1HE2      GLN  25 -11.357  -5.880   5.299
  212   HE22  GLN  25          2HE2      GLN  25 -11.678  -7.561   5.088
  213    H    LEU  26           H        LEU  26  -7.397  -3.469   4.330
  214    HA   LEU  26           HA       LEU  26  -5.206  -4.463   3.090
  215    HB2  LEU  26           2HB      LEU  26  -6.846  -3.274   1.880
  216    HB3  LEU  26           1HB      LEU  26  -6.585  -1.813   2.798
  217    HG   LEU  26           HG       LEU  26  -4.254  -1.741   1.739
  218   HD11  LEU  26          1HD1      LEU  26  -4.170  -4.056   0.980
  219   HD12  LEU  26          2HD1      LEU  26  -3.982  -2.937  -0.369
  220   HD13  LEU  26          3HD1      LEU  26  -5.522  -3.757  -0.114
  221   HD21  LEU  26          3HD2      LEU  26  -6.670  -1.449  -0.048
  222   HD22  LEU  26          1HD2      LEU  26  -5.091  -0.704  -0.305
  223   HD23  LEU  26          2HD2      LEU  26  -6.068  -0.240   1.088
  224    H    GLU  27           H        GLU  27  -5.126  -1.622   5.256
  225    HA   GLU  27           HA       GLU  27  -2.466  -0.932   4.352
  226    HB2  GLU  27           2HB      GLU  27  -2.576   0.963   5.777
  227    HB3  GLU  27           1HB      GLU  27  -4.158   0.783   5.037
  228    HG2  GLU  27           2HG      GLU  27  -4.974  -0.282   7.107
  229    HG3  GLU  27           1HG      GLU  27  -3.395  -0.012   7.842
  230    H    GLU  28           H        GLU  28  -3.726  -2.968   6.859
  231    HA   GLU  28           HA       GLU  28  -1.795  -2.590   8.864
  232    HB2  GLU  28           2HB      GLU  28  -2.545  -4.610   9.851
  233    HB3  GLU  28           1HB      GLU  28  -3.953  -3.913   9.066
  234    HG2  GLU  28           2HG      GLU  28  -3.663  -5.465   7.184
  235    HG3  GLU  28           1HG      GLU  28  -2.260  -6.165   7.985
  236    H    GLN  29           H        GLN  29  -1.626  -4.381   5.879
  237    HA   GLN  29           HA       GLN  29   1.000  -5.471   6.606
  238    HB2  GLN  29           2HB      GLN  29   0.839  -6.860   4.616
  239    HB3  GLN  29           1HB      GLN  29  -0.592  -7.053   5.613
  240    HG2  GLN  29           2HG      GLN  29  -0.643  -5.117   3.335
  241    HG3  GLN  29           1HG      GLN  29  -0.783  -6.841   3.012
  242   HE21  GLN  29          1HE2      GLN  29  -2.874  -6.653   2.257
  243   HE22  GLN  29          2HE2      GLN  29  -4.209  -6.334   3.299
  244    H    LEU  30           H        LEU  30  -0.419  -2.960   4.656
  245    HA   LEU  30           HA       LEU  30   1.894  -2.743   2.912
  246    HB2  LEU  30           2HB      LEU  30  -0.601  -1.059   3.124
  247    HB3  LEU  30           1HB      LEU  30   0.668  -0.793   1.942
  248    HG   LEU  30           HG       LEU  30  -1.147  -3.199   2.143
  249   HD11  LEU  30          1HD1      LEU  30  -2.182  -1.223   1.157
  250   HD12  LEU  30          2HD1      LEU  30  -1.936  -2.485  -0.048
  251   HD13  LEU  30          3HD1      LEU  30  -0.856  -1.091   0.000
  252   HD21  LEU  30          3HD2      LEU  30   1.147  -2.718   0.236
  253   HD22  LEU  30          1HD2      LEU  30  -0.013  -4.044   0.144
  254   HD23  LEU  30          2HD2      LEU  30   1.091  -3.935   1.512
  255    H    ARG  31           H        ARG  31   0.953  -1.353   5.940
  256    HA   ARG  31           HA       ARG  31   3.193   0.556   5.665
  257    HB2  ARG  31           2HB      ARG  31   1.903   2.224   6.987
  258    HB3  ARG  31           1HB      ARG  31   1.213   1.879   5.408
  259    HG2  ARG  31           2HG      ARG  31  -0.696   1.058   6.271
  260    HG3  ARG  31           1HG      ARG  31   0.137   0.211   7.575
  261    HD2  ARG  31           2HD      ARG  31  -0.405   3.183   7.509
  262    HD3  ARG  31           1HD      ARG  31  -1.373   1.994   8.385
  263    HE   ARG  31           HE       ARG  31   1.386   1.859   9.090
  264   HH11  ARG  31          1HH1      ARG  31  -1.537   3.568   9.689
  265   HH12  ARG  31          2HH1      ARG  31  -1.044   4.077  11.265
  266   HH21  ARG  31          1HH2      ARG  31   2.021   2.521  11.096
  267   HH22  ARG  31          2HH2      ARG  31   0.963   3.495  12.055
  268    HA   PRO  32           HA       PRO  32   3.353  -1.576   9.894
  269    HB2  PRO  32           2HB      PRO  32   4.931  -3.701   9.527
  270    HB3  PRO  32           1HB      PRO  32   3.206  -3.778   9.141
  271    HG2  PRO  32           2HG      PRO  32   5.544  -3.409   7.301
  272    HG3  PRO  32           1HG      PRO  32   4.105  -4.425   7.094
  273    HD2  PRO  32           2HD      PRO  32   4.427  -1.917   5.967
  274    HD3  PRO  32           1HD      PRO  32   2.858  -2.691   6.270
  275    H    LEU  33           H        LEU  33   5.023   0.356   8.172
  276    HA   LEU  33           HA       LEU  33   7.770  -0.117   8.787
  277    HB2  LEU  33           2HB      LEU  33   6.297   2.308   7.758
  278    HB3  LEU  33           1HB      LEU  33   8.029   2.290   8.017
  279    HG   LEU  33           HG       LEU  33   8.232   0.454   6.349
  280   HD11  LEU  33          1HD1      LEU  33   6.363  -0.038   4.858
  281   HD12  LEU  33          2HD1      LEU  33   5.302   0.975   5.840
  282   HD13  LEU  33          3HD1      LEU  33   5.996  -0.497   6.521
  283   HD21  LEU  33          3HD2      LEU  33   7.831   1.867   4.378
  284   HD22  LEU  33          1HD2      LEU  33   8.616   2.754   5.685
  285   HD23  LEU  33          2HD2      LEU  33   6.894   2.980   5.376
  286    HA   PRO  34           HA       PRO  34   7.670   1.159  13.032
  287    HB2  PRO  34           2HB      PRO  34  10.367   1.637  13.345
  288    HB3  PRO  34           1HB      PRO  34   9.633   0.030  13.368
  289    HG2  PRO  34           2HG      PRO  34  10.987   1.459  11.099
  290    HG3  PRO  34           1HG      PRO  34  11.164  -0.230  11.614
  291    HD2  PRO  34           2HD      PRO  34   9.633   0.411   9.523
  292    HD3  PRO  34           1HD      PRO  34   9.135  -0.862  10.657
  293    H    ALA  35           H        ALA  35   6.595   3.105  13.120
  294    HA   ALA  35           HA       ALA  35   6.293   5.328  13.501
  295    HB1  ALA  35           3HB      ALA  35   8.175   6.616  14.369
  296    HB2  ALA  35           1HB      ALA  35   9.294   5.365  13.826
  297    HB3  ALA  35           2HB      ALA  35   8.119   5.009  15.093
  298    H    HIS  36           H        HIS  36   6.745   4.407  10.720
  299    HA   HIS  36           HA       HIS  36   7.901   6.846   9.527
  300    HB2  HIS  36           2HB      HIS  36   7.355   4.146   8.276
  301    HB3  HIS  36           1HB      HIS  36   7.985   5.543   7.407
  302    HD1  HIS  36           HD1      HIS  36   9.683   2.971   7.538
  303    HD2  HIS  36           HD2      HIS  36  10.000   6.118  10.247
  304    HE1  HIS  36           HE1      HIS  36  11.953   2.752   8.575
  305    HE2  HIS  36           HE2      HIS  36  12.092   4.602  10.264
  306    H    ASP  37           H        ASP  37   6.734   6.984   7.097
  307    HA   ASP  37           HA       ASP  37   4.117   8.055   7.867
  308    HB2  ASP  37           2HB      ASP  37   6.116   9.357   6.800
  309    HB3  ASP  37           1HB      ASP  37   5.567   8.638   5.292
  310    H    TYR  38           H        TYR  38   2.466   8.141   5.997
  311    HA   TYR  38           HA       TYR  38   2.574   6.046   4.030
  312    HB2  TYR  38           2HB      TYR  38   0.618   4.785   4.768
  313    HB3  TYR  38           1HB      TYR  38   1.885   4.722   5.983
  314    HD1  TYR  38           HD2      TYR  38   1.603   5.891   8.138
  315    HD2  TYR  38           HD1      TYR  38  -1.505   5.875   5.222
  316    HE1  TYR  38           HE2      TYR  38  -0.005   6.605   9.852
  317    HE2  TYR  38           HE1      TYR  38  -3.119   6.585   6.935
  318    HH   TYR  38           HH       TYR  38  -3.434   6.652   9.258
  319    H    PHE  39           H        PHE  39   0.761   6.113   2.520
  320    HA   PHE  39           HA       PHE  39  -0.622   8.726   2.570
  321    HB2  PHE  39           2HB      PHE  39   1.252   7.737   0.677
  322    HB3  PHE  39           1HB      PHE  39  -0.313   7.739  -0.125
  323    HD1  PHE  39           HD2      PHE  39   2.299   9.806   1.394
  324    HD2  PHE  39           HD1      PHE  39  -1.496   9.823  -0.547
  325    HE1  PHE  39           HE2      PHE  39   2.513  12.224   0.998
  326    HE2  PHE  39           HE1      PHE  39  -1.284  12.241  -0.940
  327    HZ   PHE  39           HZ       PHE  39   0.718  13.448  -0.167
  328    H    GLU  40           H        GLU  40  -2.170   8.262   0.221
  329    HA   GLU  40           HA       GLU  40  -4.461   7.196   1.398
  330    HB2  GLU  40           2HB      GLU  40  -5.472   7.339  -0.870
  331    HB3  GLU  40           1HB      GLU  40  -4.653   8.809  -0.365
  332    HG2  GLU  40           2HG      GLU  40  -2.801   8.374  -1.802
  333    HG3  GLU  40           1HG      GLU  40  -3.376   6.745  -2.152
  334    H    PHE  41           H        PHE  41  -5.263   5.235   1.633
  335    HA   PHE  41           HA       PHE  41  -4.442   3.059  -0.196
  336    HB2  PHE  41           2HB      PHE  41  -5.488   2.843   2.648
  337    HB3  PHE  41           1HB      PHE  41  -5.075   1.486   1.609
  338    HD1  PHE  41           HD1      PHE  41  -2.661   1.216   0.877
  339    HD2  PHE  41           HD2      PHE  41  -3.849   3.896   3.974
  340    HE1  PHE  41           HE1      PHE  41  -0.351   1.268   1.715
  341    HE2  PHE  41           HE2      PHE  41  -1.534   3.950   4.810
  342    HZ   PHE  41           HZ       PHE  41   0.218   2.638   3.680
  343    H    PHE  42           H        PHE  42  -6.052   2.147  -1.421
  344    HA   PHE  42           HA       PHE  42  -8.489   3.485  -1.694
  345    HB2  PHE  42           2HB      PHE  42  -9.170   1.649  -3.207
  346    HB3  PHE  42           1HB      PHE  42  -7.572   2.287  -3.560
  347    HD1  PHE  42           HD1      PHE  42  -9.461  -0.612  -2.338
  348    HD2  PHE  42           HD2      PHE  42  -5.590   0.919  -3.263
  349    HE1  PHE  42           HE1      PHE  42  -8.553  -2.898  -2.318
  350    HE2  PHE  42           HE2      PHE  42  -4.681  -1.368  -3.238
  351    HZ   PHE  42           HZ       PHE  42  -6.161  -3.280  -2.768
  352    H    ALA  43           H        ALA  43 -10.621   3.000  -1.198
  353    HA   ALA  43           HA       ALA  43 -10.933   1.254   1.174
  354    HB1  ALA  43           3HB      ALA  43 -11.058   3.633   1.698
  355    HB2  ALA  43           1HB      ALA  43 -12.609   2.842   1.974
  356    HB3  ALA  43           2HB      ALA  43 -12.368   3.834   0.534
  357    H    ALA  44           H        ALA  44 -11.365   0.226  -1.449
  358    HA   ALA  44           HA       ALA  44 -14.259   0.104  -1.823
  359    HB1  ALA  44           3HB      ALA  44 -12.800   0.280  -3.793
  360    HB2  ALA  44           1HB      ALA  44 -13.758  -1.200  -3.824
  361    HB3  ALA  44           2HB      ALA  44 -12.054  -1.261  -3.375
  362    H    ASP  45           H        ASP  45 -15.330  -2.047  -2.071
  363    HA   ASP  45           HA       ASP  45 -14.188  -4.057  -0.228
  364    HB2  ASP  45           2HB      ASP  45 -16.491  -4.750   0.301
  365    HB3  ASP  45           1HB      ASP  45 -16.209  -3.061   0.700
  366    H    LEU  46           H        LEU  46 -14.925  -6.328  -0.673
  367    HA   LEU  46           HA       LEU  46 -13.992  -6.926  -3.296
  368    HB2  LEU  46           2HB      LEU  46 -13.904  -9.212  -2.604
  369    HB3  LEU  46           1HB      LEU  46 -13.307  -8.196  -1.306
  370    HG   LEU  46           HG       LEU  46 -16.106  -9.357  -1.362
  371   HD11  LEU  46          1HD1      LEU  46 -14.459 -11.159  -1.333
  372   HD12  LEU  46          2HD1      LEU  46 -15.299 -11.032   0.212
  373   HD13  LEU  46          3HD1      LEU  46 -13.654 -10.412   0.048
  374   HD21  LEU  46          3HD2      LEU  46 -16.093  -8.846   1.034
  375   HD22  LEU  46          1HD2      LEU  46 -15.863  -7.390   0.070
  376   HD23  LEU  46          2HD2      LEU  46 -14.484  -8.135   0.882
  377    H    SER  47           H        SER  47 -16.945  -5.927  -2.791
  378    HA   SER  47           HA       SER  47 -18.643  -7.894  -3.900
  379    HB2  SER  47           2HB      SER  47 -19.530  -5.863  -2.834
  380    HB3  SER  47           1HB      SER  47 -18.841  -4.874  -4.121
  381    HG   SER  47           HG       SER  47 -21.026  -5.270  -4.534
  382    H    LEU  48           H        LEU  48 -19.547  -7.940  -6.108
  383    HA   LEU  48           HA       LEU  48 -17.459  -8.018  -8.042
  384    HB2  LEU  48           2HB      LEU  48 -20.439  -8.417  -8.270
  385    HB3  LEU  48           1HB      LEU  48 -19.374  -8.518  -9.659
  386    HG   LEU  48           HG       LEU  48 -18.141 -10.376  -8.526
  387   HD11  LEU  48          1HD1      LEU  48 -18.695  -9.852  -6.207
  388   HD12  LEU  48          2HD1      LEU  48 -19.152 -11.505  -6.617
  389   HD13  LEU  48          3HD1      LEU  48 -20.387 -10.249  -6.515
  390   HD21  LEU  48          3HD2      LEU  48 -21.098 -10.826  -8.924
  391   HD22  LEU  48          1HD2      LEU  48 -19.853 -12.076  -8.916
  392   HD23  LEU  48          2HD2      LEU  48 -19.861 -10.849 -10.183
  393    H    TYR  49           H        TYR  49 -16.736  -5.793  -7.957
  394    HA   TYR  49           HA       TYR  49 -18.337  -4.031  -9.704
  395    HB2  TYR  49           2HB      TYR  49 -17.980  -3.120  -7.424
  396    HB3  TYR  49           1HB      TYR  49 -16.240  -3.209  -7.674
  397    HD1  TYR  49           HD1      TYR  49 -19.344  -1.511  -8.775
  398    HD2  TYR  49           HD2      TYR  49 -15.087  -1.523  -8.929
  399    HE1  TYR  49           HE1      TYR  49 -19.377   0.727  -9.787
  400    HE2  TYR  49           HE2      TYR  49 -15.117   0.717  -9.939
  401    HH   TYR  49           HH       TYR  49 -16.657   2.111 -11.244
  402    HA   PRO  50           HA       PRO  50 -14.802  -4.767 -12.389
  403    HB2  PRO  50           2HB      PRO  50 -16.046  -4.411 -14.699
  404    HB3  PRO  50           1HB      PRO  50 -16.487  -5.768 -13.654
  405    HG2  PRO  50           2HG      PRO  50 -17.902  -3.161 -14.071
  406    HG3  PRO  50           1HG      PRO  50 -18.582  -4.787 -13.881
  407    HD2  PRO  50           2HD      PRO  50 -18.319  -2.858 -11.849
  408    HD3  PRO  50           1HD      PRO  50 -18.648  -4.586 -11.611
  409    H    HIS  51           H        HIS  51 -13.621  -3.611 -14.089
  410    HA   HIS  51           HA       HIS  51 -12.682  -1.847 -15.170
  411    HB2  HIS  51           2HB      HIS  51 -15.272  -0.390 -14.580
  412    HB3  HIS  51           1HB      HIS  51 -14.058   0.096 -15.756
  413    HD1  HIS  51           HD1      HIS  51 -17.229  -1.152 -15.855
  414    HD2  HIS  51           HD2      HIS  51 -13.687  -2.536 -17.532
  415    HE1  HIS  51           HE1      HIS  51 -17.919  -2.609 -17.774
  416    HE2  HIS  51           HE2      HIS  51 -15.772  -3.578 -18.653
  417    H    LEU  52           H        LEU  52 -12.511  -2.112 -12.162
  418    HA   LEU  52           HA       LEU  52 -11.908   0.701 -11.494
  419    HB2  LEU  52           2HB      LEU  52 -13.578  -0.343 -10.046
  420    HB3  LEU  52           1HB      LEU  52 -12.453  -1.631  -9.656
  421    HG   LEU  52           HG       LEU  52 -10.972   0.005  -8.541
  422   HD11  LEU  52          1HD1      LEU  52 -13.170   1.994  -9.121
  423   HD12  LEU  52          2HD1      LEU  52 -11.561   1.988  -9.842
  424   HD13  LEU  52          3HD1      LEU  52 -11.750   2.279  -8.114
  425   HD21  LEU  52          3HD2      LEU  52 -12.634  -1.202  -7.228
  426   HD22  LEU  52          1HD2      LEU  52 -13.828   0.054  -7.555
  427   HD23  LEU  52          2HD2      LEU  52 -12.396   0.425  -6.593
  428    H    TYR  53           H        TYR  53  -9.811   1.212 -11.625
  429    HA   TYR  53           HA       TYR  53  -7.767  -0.794 -10.992
  430    HB2  TYR  53           2HB      TYR  53  -7.623   1.955 -12.236
  431    HB3  TYR  53           1HB      TYR  53  -6.183   1.088 -11.711
  432    HD1  TYR  53           HD2      TYR  53  -8.918   1.168 -14.175
  433    HD2  TYR  53           HD1      TYR  53  -5.376  -0.846 -12.930
  434    HE1  TYR  53           HE2      TYR  53  -8.830  -0.008 -16.333
  435    HE2  TYR  53           HE1      TYR  53  -5.282  -2.022 -15.085
  436    HH   TYR  53           HH       TYR  53  -7.127  -1.097 -17.763
  437    H    SER  54           H        SER  54  -7.633  -1.000  -8.820
  438    HA   SER  54           HA       SER  54  -7.716   1.338  -7.083
  439    HB2  SER  54           2HB      SER  54  -7.587  -0.394  -5.256
  440    HB3  SER  54           1HB      SER  54  -8.969  -0.567  -6.334
  441    HG   SER  54           HG       SER  54  -6.538  -2.042  -6.528
  442    H    ARG  55           H        ARG  55  -5.981   2.288  -6.141
  443    HA   ARG  55           HA       ARG  55  -3.428   0.840  -6.083
  444    HB2  ARG  55           2HB      ARG  55  -2.169   2.694  -6.988
  445    HB3  ARG  55           1HB      ARG  55  -3.404   2.209  -8.137
  446    HG2  ARG  55           2HG      ARG  55  -3.750   4.537  -6.257
  447    HG3  ARG  55           1HG      ARG  55  -3.025   4.695  -7.854
  448    HD2  ARG  55           2HD      ARG  55  -5.810   3.668  -7.283
  449    HD3  ARG  55           1HD      ARG  55  -5.414   5.290  -7.845
  450    HE   ARG  55           HE       ARG  55  -4.752   2.911  -9.452
  451   HH11  ARG  55          1HH1      ARG  55  -6.217   6.004  -9.136
  452   HH12  ARG  55          2HH1      ARG  55  -6.660   6.088 -10.801
  453   HH21  ARG  55          1HH2      ARG  55  -5.354   3.018 -11.588
  454   HH22  ARG  55          2HH2      ARG  55  -6.193   4.408 -12.173
  455    H    ALA  56           H        ALA  56  -1.849   1.683  -4.599
  456    HA   ALA  56           HA       ALA  56  -2.810   3.673  -2.666
  457    HB1  ALA  56           3HB      ALA  56  -1.674   0.996  -1.857
  458    HB2  ALA  56           1HB      ALA  56  -3.372   1.459  -1.755
  459    HB3  ALA  56           2HB      ALA  56  -2.170   2.295  -0.773
  460    H    TYR  57           H        TYR  57  -1.166   4.772  -1.519
  461    HA   TYR  57           HA       TYR  57   1.508   4.548  -2.773
  462    HB2  TYR  57           2HB      TYR  57   0.031   7.009  -1.808
  463    HB3  TYR  57           1HB      TYR  57   1.717   7.013  -2.312
  464    HD1  TYR  57           HD1      TYR  57  -1.734   6.291  -3.530
  465    HD2  TYR  57           HD2      TYR  57   2.278   7.255  -4.586
  466    HE1  TYR  57           HE1      TYR  57  -2.435   6.632  -5.860
  467    HE2  TYR  57           HE2      TYR  57   1.586   7.597  -6.919
  468    HH   TYR  57           HH       TYR  57  -1.682   7.830  -7.856
  469    H    ILE  58           H        ILE  58   3.326   4.581  -1.492
  470    HA   ILE  58           HA       ILE  58   2.904   4.706   1.437
  471    HB   ILE  58           HB       ILE  58   4.963   3.013  -0.011
  472   HG12  ILE  58          2HG1      ILE  58   2.401   2.163   1.380
  473   HG13  ILE  58          1HG1      ILE  58   2.653   2.181  -0.363
  474   HG21  ILE  58          1HG2      ILE  58   5.678   3.750   2.216
  475   HG22  ILE  58          2HG2      ILE  58   5.373   2.015   2.187
  476   HG23  ILE  58          3HG2      ILE  58   4.192   3.104   2.914
  477   HD11  ILE  58          3HD1      ILE  58   2.853  -0.061   0.517
  478   HD12  ILE  58          1HD1      ILE  58   4.118   0.459   1.629
  479   HD13  ILE  58          2HD1      ILE  58   4.407   0.486  -0.112
  480    H    ASN  59           H        ASN  59   3.793   6.511   2.238
  481    HA   ASN  59           HA       ASN  59   5.890   7.898   0.793
  482    HB2  ASN  59           2HB      ASN  59   3.970   9.133   1.749
  483    HB3  ASN  59           1HB      ASN  59   4.488   8.665   3.366
  484   HD21  ASN  59          1HD2      ASN  59   4.698  10.834   3.946
  485   HD22  ASN  59          2HD2      ASN  59   6.024  11.801   3.401
  486    H    PHE  60           H        PHE  60   7.635   6.444   1.066
  487    HA   PHE  60           HA       PHE  60   8.700   5.693   3.585
  488    HB2  PHE  60           2HB      PHE  60   9.781   5.763   0.785
  489    HB3  PHE  60           1HB      PHE  60  10.884   5.479   2.126
  490    HD1  PHE  60           HD2      PHE  60   7.928   4.150   0.343
  491    HD2  PHE  60           HD1      PHE  60  10.955   3.397   3.247
  492    HE1  PHE  60           HE2      PHE  60   7.342   1.759   0.341
  493    HE2  PHE  60           HE1      PHE  60  10.372   1.013   3.247
  494    HZ   PHE  60           HZ       PHE  60   8.563   0.184   1.793
  495    H    ARG  61           H        ARG  61  10.108   6.682   4.945
  496    HA   ARG  61           HA       ARG  61  10.822   9.467   4.450
  497    HB2  ARG  61           2HB      ARG  61  11.277   7.679   6.858
  498    HB3  ARG  61           1HB      ARG  61  11.669   9.391   6.794
  499    HG2  ARG  61           2HG      ARG  61   8.885   8.295   6.422
  500    HG3  ARG  61           1HG      ARG  61   9.538   8.838   7.970
  501    HD2  ARG  61           2HD      ARG  61   9.922  11.076   7.006
  502    HD3  ARG  61           1HD      ARG  61   9.221  10.528   5.482
  503    HE   ARG  61           HE       ARG  61   7.106  10.518   6.481
  504   HH11  ARG  61          1HH1      ARG  61   9.543  11.490   8.721
  505   HH12  ARG  61          2HH1      ARG  61   8.399  12.158   9.831
  506   HH21  ARG  61          1HH2      ARG  61   5.650  11.348   7.958
  507   HH22  ARG  61          2HH2      ARG  61   6.243  12.043   9.428
  508    H    ASN  62           H        ASN  62  12.322   6.316   4.540
  509    HA   ASN  62           HA       ASN  62  15.007   7.509   4.227
  510    HB2  ASN  62           2HB      ASN  62  14.811   6.620   6.450
  511    HB3  ASN  62           1HB      ASN  62  14.115   5.121   5.854
  512   HD21  ASN  62          1HD2      ASN  62  15.689   3.964   6.976
  513   HD22  ASN  62          2HD2      ASN  62  17.313   3.859   6.414
  514    HA   PRO  63           HA       PRO  63  15.019   5.081   0.407
  515    HB2  PRO  63           2HB      PRO  63  17.709   5.393  -0.110
  516    HB3  PRO  63           1HB      PRO  63  16.474   6.583  -0.530
  517    HG2  PRO  63           2HG      PRO  63  18.313   6.516   1.831
  518    HG3  PRO  63           1HG      PRO  63  17.837   7.894   0.820
  519    HD2  PRO  63           2HD      PRO  63  16.746   7.478   3.242
  520    HD3  PRO  63           1HD      PRO  63  15.792   8.135   1.894
  521    H    ASP  64           H        ASP  64  17.315   4.620   3.056
  522    HA   ASP  64           HA       ASP  64  18.142   1.993   2.296
  523    HB2  ASP  64           2HB      ASP  64  19.494   3.409   3.770
  524    HB3  ASP  64           1HB      ASP  64  18.219   3.402   4.976
  525    H    ASP  65           H        ASP  65  15.431   3.285   4.078
  526    HA   ASP  65           HA       ASP  65  14.542   0.848   5.260
  527    HB2  ASP  65           2HB      ASP  65  13.896   3.214   5.932
  528    HB3  ASP  65           1HB      ASP  65  12.835   3.240   4.531
  529    H    ILE  66           H        ILE  66  14.125   2.350   2.133
  530    HA   ILE  66           HA       ILE  66  11.971   0.870   1.115
  531    HB   ILE  66           HB       ILE  66  14.361   1.938  -0.408
  532   HG12  ILE  66          2HG1      ILE  66  11.652   3.198   0.122
  533   HG13  ILE  66          1HG1      ILE  66  13.164   3.678   0.884
  534   HG21  ILE  66          1HG2      ILE  66  12.849   1.909  -2.365
  535   HG22  ILE  66          2HG2      ILE  66  11.626   1.102  -1.385
  536   HG23  ILE  66          3HG2      ILE  66  13.155   0.295  -1.726
  537   HD11  ILE  66          3HD1      ILE  66  12.543   3.869  -2.057
  538   HD12  ILE  66          1HD1      ILE  66  14.044   4.371  -1.275
  539   HD13  ILE  66          2HD1      ILE  66  12.533   5.202  -0.901
  540    H    LEU  67           H        LEU  67  15.482   0.228   0.672
  541    HA   LEU  67           HA       LEU  67  15.077  -2.274  -0.589
  542    HB2  LEU  67           2HB      LEU  67  17.503  -2.653  -0.171
  543    HB3  LEU  67           1HB      LEU  67  17.125  -1.157  -0.998
  544    HG   LEU  67           HG       LEU  67  17.341  -0.042   1.331
  545   HD11  LEU  67          1HD1      LEU  67  17.358  -2.021   2.714
  546   HD12  LEU  67          2HD1      LEU  67  18.899  -1.180   2.865
  547   HD13  LEU  67          3HD1      LEU  67  18.783  -2.637   1.875
  548   HD21  LEU  67          3HD2      LEU  67  18.915   0.326  -0.482
  549   HD22  LEU  67          1HD2      LEU  67  19.766  -1.165  -0.075
  550   HD23  LEU  67          2HD2      LEU  67  19.769   0.190   1.055
  551    H    LEU  68           H        LEU  68  14.943  -1.367   2.702
  552    HA   LEU  68           HA       LEU  68  15.420  -3.958   3.834
  553    HB2  LEU  68           2HB      LEU  68  15.727  -2.070   5.254
  554    HB3  LEU  68           1HB      LEU  68  14.136  -1.436   4.877
  555    HG   LEU  68           HG       LEU  68  13.096  -3.301   6.113
  556   HD11  LEU  68          1HD1      LEU  68  15.930  -4.076   6.815
  557   HD12  LEU  68          2HD1      LEU  68  14.815  -4.997   5.807
  558   HD13  LEU  68          3HD1      LEU  68  14.465  -4.765   7.519
  559   HD21  LEU  68          3HD2      LEU  68  15.149  -1.761   7.704
  560   HD22  LEU  68          1HD2      LEU  68  13.723  -2.564   8.362
  561   HD23  LEU  68          2HD2      LEU  68  13.536  -1.199   7.262
  562    H    PHE  69           H        PHE  69  12.405  -2.049   3.533
  563    HA   PHE  69           HA       PHE  69  10.779  -4.310   4.169
  564    HB2  PHE  69           2HB      PHE  69  10.294  -1.452   3.515
  565    HB3  PHE  69           1HB      PHE  69   8.943  -2.565   3.308
  566    HD1  PHE  69           HD1      PHE  69  11.229  -1.012   5.742
  567    HD2  PHE  69           HD2      PHE  69   7.923  -3.651   5.200
  568    HE1  PHE  69           HE1      PHE  69  10.777  -0.941   8.154
  569    HE2  PHE  69           HE2      PHE  69   7.471  -3.577   7.613
  570    HZ   PHE  69           HZ       PHE  69   8.895  -2.224   9.096
  571    H    ARG  70           H        ARG  70  11.807  -2.896   1.107
  572    HA   ARG  70           HA       ARG  70   9.814  -3.986  -0.542
  573    HB2  ARG  70           2HB      ARG  70  11.545  -2.330  -1.296
  574    HB3  ARG  70           1HB      ARG  70  12.718  -3.642  -1.328
  575    HG2  ARG  70           2HG      ARG  70  11.165  -4.830  -2.934
  576    HG3  ARG  70           1HG      ARG  70  10.261  -3.322  -3.040
  577    HD2  ARG  70           2HD      ARG  70  13.148  -3.767  -3.791
  578    HD3  ARG  70           1HD      ARG  70  11.802  -3.488  -4.892
  579    HE   ARG  70           HE       ARG  70  12.956  -1.482  -3.069
  580   HH11  ARG  70          1HH1      ARG  70  11.068  -2.275  -5.829
  581   HH12  ARG  70          2HH1      ARG  70  11.159  -0.686  -6.494
  582   HH21  ARG  70          1HH2      ARG  70  13.047   0.567  -3.897
  583   HH22  ARG  70          2HH2      ARG  70  12.264   0.930  -5.389
  584    H    ASP  71           H        ASP  71  12.961  -5.374   0.400
  585    HA   ASP  71           HA       ASP  71  12.935  -7.677  -1.127
  586    HB2  ASP  71           2HB      ASP  71  14.881  -6.938   0.170
  587    HB3  ASP  71           1HB      ASP  71  14.048  -7.333   1.673
  588    H    ARG  72           H        ARG  72  11.661  -7.324   2.182
  589    HA   ARG  72           HA       ARG  72  10.730 -10.016   2.352
  590    HB2  ARG  72           2HB      ARG  72   9.527  -9.121   4.420
  591    HB3  ARG  72           1HB      ARG  72  11.280  -8.994   4.400
  592    HG2  ARG  72           2HG      ARG  72  11.089  -6.636   3.729
  593    HG3  ARG  72           1HG      ARG  72   9.333  -6.772   3.800
  594    HD2  ARG  72           2HD      ARG  72  11.161  -7.290   6.147
  595    HD3  ARG  72           1HD      ARG  72  10.401  -5.732   5.817
  596    HE   ARG  72           HE       ARG  72   8.520  -7.893   5.949
  597   HH11  ARG  72          1HH1      ARG  72  10.315  -5.632   7.848
  598   HH12  ARG  72          2HH1      ARG  72   9.175  -5.664   9.145
  599   HH21  ARG  72          1HH2      ARG  72   7.072  -7.903   7.619
  600   HH22  ARG  72          2HH2      ARG  72   7.362  -6.920   9.016
  601    H    PHE  73           H        PHE  73   9.291  -7.083   1.149
  602    HA   PHE  73           HA       PHE  73   6.625  -8.348   1.048
  603    HB2  PHE  73           2HB      PHE  73   7.568  -5.500   1.021
  604    HB3  PHE  73           1HB      PHE  73   5.992  -5.912   0.363
  605    HD1  PHE  73           HD1      PHE  73   4.267  -6.904   1.830
  606    HD2  PHE  73           HD2      PHE  73   7.943  -5.421   3.386
  607    HE1  PHE  73           HE1      PHE  73   3.282  -6.832   4.078
  608    HE2  PHE  73           HE2      PHE  73   6.965  -5.355   5.639
  609    HZ   PHE  73           HZ       PHE  73   4.632  -6.062   5.991
  610    H    ASP  74           H        ASP  74   9.189  -8.239  -0.864
  611    HA   ASP  74           HA       ASP  74   8.489  -7.076  -3.274
  612    HB2  ASP  74           2HB      ASP  74  10.749  -7.943  -2.627
  613    HB3  ASP  74           1HB      ASP  74  10.169  -9.572  -2.957
  614    H    GLY  75           H        GLY  75   6.306  -7.490  -3.774
  615    HA2  GLY  75           2HA      GLY  75   4.718  -8.447  -5.120
  616    HA3  GLY  75           1HA      GLY  75   6.002  -9.446  -5.776
  617    H    TYR  76           H        TYR  76   4.779  -9.392  -2.433
  618    HA   TYR  76           HA       TYR  76   4.455 -12.274  -2.527
  619    HB2  TYR  76           2HB      TYR  76   4.309 -12.226  -0.202
  620    HB3  TYR  76           1HB      TYR  76   5.338 -10.837  -0.534
  621    HD1  TYR  76           HD1      TYR  76   4.208  -8.522  -0.614
  622    HD2  TYR  76           HD2      TYR  76   2.353 -11.977   1.053
  623    HE1  TYR  76           HE1      TYR  76   2.657  -7.088   0.639
  624    HE2  TYR  76           HE2      TYR  76   0.802 -10.546   2.307
  625    HH   TYR  76           HH       TYR  76   0.493  -7.207   1.681
  626    H    ILE  77           H        ILE  77   2.453 -13.343  -1.791
  627    HA   ILE  77           HA       ILE  77   0.108 -12.034  -2.998
  628    HB   ILE  77           HB       ILE  77   0.557 -14.956  -2.352
  629   HG12  ILE  77          2HG1      ILE  77   2.027 -14.126  -4.159
  630   HG13  ILE  77          1HG1      ILE  77   0.831 -15.267  -4.768
  631   HG21  ILE  77          1HG2      ILE  77  -1.806 -14.366  -2.286
  632   HG22  ILE  77          2HG2      ILE  77  -1.455 -15.364  -3.698
  633   HG23  ILE  77          3HG2      ILE  77  -1.682 -13.623  -3.881
  634   HD11  ILE  77          3HD1      ILE  77  -0.495 -13.417  -5.635
  635   HD12  ILE  77          1HD1      ILE  77   1.147 -13.388  -6.277
  636   HD13  ILE  77          2HD1      ILE  77   0.681 -12.266  -4.998
  637    H    PHE  78           H        PHE  78  -1.001 -10.915  -1.456
  638    HA   PHE  78           HA       PHE  78  -1.504 -12.099   1.165
  639    HB2  PHE  78           2HB      PHE  78  -1.039  -9.648   0.918
  640    HB3  PHE  78           1HB      PHE  78  -2.548  -9.486   0.026
  641    HD1  PHE  78           HD1      PHE  78  -1.064 -10.207   3.319
  642    HD2  PHE  78           HD2      PHE  78  -4.665  -9.463   1.164
  643    HE1  PHE  78           HE1      PHE  78  -2.271  -9.901   5.442
  644    HE2  PHE  78           HE2      PHE  78  -5.872  -9.153   3.283
  645    HZ   PHE  78           HZ       PHE  78  -4.676  -9.370   5.426
  646    H    LEU  79           H        LEU  79  -3.339 -13.164   1.712
  647    HA   LEU  79           HA       LEU  79  -5.418 -13.416  -0.361
  648    HB2  LEU  79           2HB      LEU  79  -4.548 -15.259   1.862
  649    HB3  LEU  79           1HB      LEU  79  -6.034 -15.511   0.961
  650    HG   LEU  79           HG       LEU  79  -3.295 -15.397  -0.326
  651   HD11  LEU  79          1HD1      LEU  79  -3.411 -17.309   1.186
  652   HD12  LEU  79          2HD1      LEU  79  -3.454 -17.840  -0.496
  653   HD13  LEU  79          3HD1      LEU  79  -4.939 -17.808   0.459
  654   HD21  LEU  79          3HD2      LEU  79  -4.455 -16.400  -2.238
  655   HD22  LEU  79          1HD2      LEU  79  -5.137 -14.830  -1.821
  656   HD23  LEU  79          2HD2      LEU  79  -5.984 -16.309  -1.361
  657    H    ASP  80           H        ASP  80  -7.437 -12.716  -0.018
  658    HA   ASP  80           HA       ASP  80  -8.242 -11.509   2.457
  659    HB2  ASP  80           2HB      ASP  80  -9.067 -10.738   0.246
  660    HB3  ASP  80           1HB      ASP  80  -9.913 -12.264   0.040
  661    H    SER  81           H        SER  81 -10.269 -12.180   3.620
  662    HA   SER  81           HA       SER  81 -10.114 -14.755   4.669
  663    HB2  SER  81           2HB      SER  81 -12.535 -12.932   4.593
  664    HB3  SER  81           1HB      SER  81 -12.340 -14.322   5.660
  665    HG   SER  81           HG       SER  81 -11.117 -11.806   5.737
  666    H    LYS  82           H        LYS  82 -11.914 -13.611   1.877
  667    HA   LYS  82           HA       LYS  82 -13.456 -16.050   1.603
  668    HB2  LYS  82           2HB      LYS  82 -13.118 -13.728  -0.312
  669    HB3  LYS  82           1HB      LYS  82 -14.292 -15.028  -0.481
  670    HG2  LYS  82           2HG      LYS  82 -14.198 -12.949   1.701
  671    HG3  LYS  82           1HG      LYS  82 -15.379 -13.070   0.394
  672    HD2  LYS  82           2HD      LYS  82 -16.085 -15.276   1.303
  673    HD3  LYS  82           1HD      LYS  82 -14.973 -15.039   2.653
  674    HE2  LYS  82           2HE      LYS  82 -16.208 -12.963   3.239
  675    HE3  LYS  82           1HE      LYS  82 -17.364 -13.331   1.958
  676    HZ1  LYS  82           3HZ      LYS  82 -16.819 -14.944   4.387
  677    HZ2  LYS  82           1HZ      LYS  82 -17.809 -15.456   3.116
  678    HZ3  LYS  82           2HZ      LYS  82 -18.235 -14.098   4.023
  679    H    GLY  83           H        GLY  83 -10.305 -15.161   0.777
  680    HA2  GLY  83           2HA      GLY  83  -8.744 -16.653  -0.215
  681    HA3  GLY  83           1HA      GLY  83 -10.065 -17.458  -1.041
  682    H    LEU  84           H        LEU  84  -9.013 -14.047  -0.934
  683    HA   LEU  84           HA       LEU  84  -8.875 -14.067  -3.888
  684    HB2  LEU  84           2HB      LEU  84  -9.243 -11.710  -2.024
  685    HB3  LEU  84           1HB      LEU  84  -9.211 -11.635  -3.777
  686    HG   LEU  84           HG       LEU  84 -11.320 -13.020  -2.101
  687   HD11  LEU  84          1HD1      LEU  84 -11.448 -10.575  -2.011
  688   HD12  LEU  84          2HD1      LEU  84 -12.807 -11.265  -2.899
  689   HD13  LEU  84          3HD1      LEU  84 -11.474 -10.511  -3.775
  690   HD21  LEU  84          3HD2      LEU  84 -11.135 -12.681  -5.100
  691   HD22  LEU  84          1HD2      LEU  84 -12.505 -13.359  -4.218
  692   HD23  LEU  84          2HD2      LEU  84 -10.952 -14.194  -4.210
  693    H    GLU  85           H        GLU  85  -6.939 -13.787  -4.839
  694    HA   GLU  85           HA       GLU  85  -4.585 -13.431  -3.192
  695    HB2  GLU  85           2HB      GLU  85  -4.769 -13.765  -6.193
  696    HB3  GLU  85           1HB      GLU  85  -3.321 -13.934  -5.211
  697    HG2  GLU  85           2HG      GLU  85  -4.401 -15.854  -4.055
  698    HG3  GLU  85           1HG      GLU  85  -5.743 -15.728  -5.192
  699    H    TYR  86           H        TYR  86  -3.667 -11.526  -2.776
  700    HA   TYR  86           HA       TYR  86  -3.925  -9.329  -4.740
  701    HB2  TYR  86           2HB      TYR  86  -3.355  -9.044  -1.777
  702    HB3  TYR  86           1HB      TYR  86  -3.670  -7.746  -2.922
  703    HD1  TYR  86           HD1      TYR  86  -6.021  -7.827  -4.105
  704    HD2  TYR  86           HD2      TYR  86  -5.096  -9.858  -0.483
  705    HE1  TYR  86           HE1      TYR  86  -8.415  -7.933  -3.557
  706    HE2  TYR  86           HE2      TYR  86  -7.479  -9.969   0.072
  707    HH   TYR  86           HH       TYR  86  -9.556  -8.873  -0.454
  708    HA   PRO  87           HA       PRO  87   0.573 -10.245  -4.850
  709    HB2  PRO  87           2HB      PRO  87   0.966  -9.362  -7.387
  710    HB3  PRO  87           1HB      PRO  87   0.348 -10.976  -7.024
  711    HG2  PRO  87           2HG      PRO  87  -1.148  -8.518  -7.858
  712    HG3  PRO  87           1HG      PRO  87  -1.368 -10.197  -8.388
  713    HD2  PRO  87           2HD      PRO  87  -2.959  -8.991  -6.521
  714    HD3  PRO  87           1HD      PRO  87  -2.645 -10.737  -6.550
  715    H    ALA  88           H        ALA  88   1.213  -8.671  -3.384
  716    HA   ALA  88           HA       ALA  88   0.997  -5.854  -4.037
  717    HB1  ALA  88           3HB      ALA  88   1.926  -5.462  -1.829
  718    HB2  ALA  88           1HB      ALA  88   2.304  -7.177  -1.662
  719    HB3  ALA  88           2HB      ALA  88   0.624  -6.648  -1.746
  720    H    VAL  89           H        VAL  89   2.337  -5.543  -5.837
  721    HA   VAL  89           HA       VAL  89   5.162  -6.234  -5.666
  722    HB   VAL  89           HB       VAL  89   3.704  -4.709  -7.838
  723   HG11  VAL  89          1HG1      VAL  89   6.438  -6.002  -7.825
  724   HG12  VAL  89          2HG1      VAL  89   6.102  -4.270  -7.850
  725   HG13  VAL  89          3HG1      VAL  89   5.656  -5.276  -9.229
  726   HG21  VAL  89          3HG2      VAL  89   2.802  -6.965  -7.596
  727   HG22  VAL  89          1HG2      VAL  89   4.430  -7.640  -7.687
  728   HG23  VAL  89          2HG2      VAL  89   3.733  -6.825  -9.087
  729    H    VAL  90           H        VAL  90   6.655  -4.934  -4.818
  730    HA   VAL  90           HA       VAL  90   5.975  -2.156  -4.186
  731    HB   VAL  90           HB       VAL  90   8.386  -3.768  -3.305
  732   HG11  VAL  90          1HG1      VAL  90   7.243  -1.182  -2.236
  733   HG12  VAL  90          2HG1      VAL  90   8.724  -1.346  -3.180
  734   HG13  VAL  90          3HG1      VAL  90   8.623  -2.056  -1.570
  735   HG21  VAL  90          3HG2      VAL  90   6.324  -4.811  -2.506
  736   HG22  VAL  90          1HG2      VAL  90   5.787  -3.269  -1.839
  737   HG23  VAL  90          2HG2      VAL  90   7.210  -4.073  -1.173
  738    H    GLU  91           H        GLU  91   6.376  -0.840  -5.917
  739    HA   GLU  91           HA       GLU  91   9.112  -0.873  -7.029
  740    HB2  GLU  91           2HB      GLU  91   8.191  -0.262  -9.239
  741    HB3  GLU  91           1HB      GLU  91   7.655  -1.848  -8.700
  742    HG2  GLU  91           2HG      GLU  91   5.494  -0.916  -8.060
  743    HG3  GLU  91           1HG      GLU  91   6.029   0.689  -8.557
  744    H    PHE  92           H        PHE  92   9.814   1.197  -7.975
  745    HA   PHE  92           HA       PHE  92   9.021   3.370  -6.212
  746    HB2  PHE  92           2HB      PHE  92  10.989   4.527  -6.993
  747    HB3  PHE  92           1HB      PHE  92  11.426   2.858  -6.653
  748    HD1  PHE  92           HD1      PHE  92  11.768   1.268  -8.558
  749    HD2  PHE  92           HD2      PHE  92  11.249   5.448  -9.171
  750    HE1  PHE  92           HE1      PHE  92  12.716   1.054 -10.819
  751    HE2  PHE  92           HE2      PHE  92  12.193   5.240 -11.433
  752    HZ   PHE  92           HZ       PHE  92  12.928   3.038 -12.260
  753    H    ALA  93           H        ALA  93   8.874   5.624  -7.151
  754    HA   ALA  93           HA       ALA  93   7.230   5.604  -9.604
  755    HB1  ALA  93           3HB      ALA  93   6.112   6.475  -7.609
  756    HB2  ALA  93           1HB      ALA  93   6.318   7.738  -8.823
  757    HB3  ALA  93           2HB      ALA  93   7.380   7.685  -7.416
  758    HA   PRO  94           HA       PRO  94  10.438   7.520 -12.014
  759    HB2  PRO  94           2HB      PRO  94   8.193   9.123 -13.172
  760    HB3  PRO  94           1HB      PRO  94   9.435   8.168 -13.993
  761    HG2  PRO  94           2HG      PRO  94   6.957   7.238 -13.785
  762    HG3  PRO  94           1HG      PRO  94   8.346   6.152 -13.575
  763    HD2  PRO  94           2HD      PRO  94   6.542   7.346 -11.502
  764    HD3  PRO  94           1HD      PRO  94   7.270   5.728 -11.566
  765    H    PHE  95           H        PHE  95  11.809   9.024 -11.243
  766    HA   PHE  95           HA       PHE  95  10.986  11.243  -9.656
  767    HB2  PHE  95           2HB      PHE  95  13.159  10.107  -9.362
  768    HB3  PHE  95           1HB      PHE  95  13.676  10.688 -10.939
  769    HD1  PHE  95           HD1      PHE  95  12.568  11.855  -7.581
  770    HD2  PHE  95           HD2      PHE  95  14.749  12.761 -11.133
  771    HE1  PHE  95           HE1      PHE  95  13.445  13.894  -6.524
  772    HE2  PHE  95           HE2      PHE  95  15.625  14.801 -10.075
  773    HZ   PHE  95           HZ       PHE  95  14.972  15.372  -7.769
  774    H    GLN  96           H        GLN  96  10.741  13.389 -10.157
  775    HA   GLN  96           HA       GLN  96  10.519  14.014 -13.012
  776    HB2  GLN  96           2HB      GLN  96   8.516  14.339 -11.691
  777    HB3  GLN  96           1HB      GLN  96   9.380  15.369 -10.561
  778    HG2  GLN  96           2HG      GLN  96   7.930  16.629 -12.096
  779    HG3  GLN  96           1HG      GLN  96   9.625  17.087 -12.229
  780   HE21  GLN  96          1HE2      GLN  96  10.690  16.757 -14.143
  781   HE22  GLN  96          2HE2      GLN  96   9.916  16.188 -15.577
  782    H    LYS  97           H        LYS  97  12.026  15.173 -13.985
  783    HA   LYS  97           HA       LYS  97  14.092  16.653 -12.792
  784    HB2  LYS  97           2HB      LYS  97  14.345  15.930 -15.046
  785    HB3  LYS  97           1HB      LYS  97  12.853  16.708 -15.547
  786    HG2  LYS  97           2HG      LYS  97  14.745  17.925 -16.403
  787    HG3  LYS  97           1HG      LYS  97  13.903  18.909 -15.206
  788    HD2  LYS  97           2HD      LYS  97  15.599  18.310 -13.532
  789    HD3  LYS  97           1HD      LYS  97  16.432  17.317 -14.732
  790    HE2  LYS  97           2HE      LYS  97  16.815  19.307 -16.113
  791    HE3  LYS  97           1HE      LYS  97  15.976  20.299 -14.919
  792    HZ1  LYS  97           3HZ      LYS  97  18.506  18.805 -14.505
  793    HZ2  LYS  97           1HZ      LYS  97  17.678  19.651 -13.297
  794    HZ3  LYS  97           2HZ      LYS  97  18.332  20.481 -14.614
  Start of MODEL    5
    1    H1   MET   1           1H       MET   1   9.979  19.447  -2.074
    2    H2   MET   1           2H       MET   1   9.535  19.417  -3.704
    3    H3   MET   1           3H       MET   1   8.443  19.983  -2.544
    4    HA   MET   1           HA       MET   1   9.419  21.803  -3.786
    5    HB2  MET   1           2HB      MET   1  10.200  23.142  -1.860
    6    HB3  MET   1           1HB      MET   1   8.733  22.243  -1.503
    7    HG2  MET   1           2HG      MET   1   9.992  20.606  -0.247
    8    HG3  MET   1           1HG      MET   1  11.507  21.394  -0.689
    9    HE1  MET   1           3HE      MET   1   8.316  23.479   1.927
   10    HE2  MET   1           1HE      MET   1   8.062  21.906   1.171
   11    HE3  MET   1           2HE      MET   1   8.202  23.354   0.172
   12    H    GLY   2           H        GLY   2  11.536  23.327  -3.387
   13    HA2  GLY   2           2HA      GLY   2  13.842  23.550  -3.700
   14    HA3  GLY   2           1HA      GLY   2  14.007  21.801  -3.610
   15    H    HIS   3           H        HIS   3  13.854  24.510  -5.672
   16    HA   HIS   3           HA       HIS   3  12.712  23.346  -7.986
   17    HB2  HIS   3           2HB      HIS   3  14.581  25.720  -7.797
   18    HB3  HIS   3           1HB      HIS   3  13.563  25.317  -9.175
   19    HD1  HIS   3           HD1      HIS   3  13.581  27.324  -6.179
   20    HD2  HIS   3           HD2      HIS   3  10.677  25.385  -8.431
   21    HE1  HIS   3           HE1      HIS   3  11.403  28.370  -5.511
   22    HE2  HIS   3           HE2      HIS   3   9.649  27.072  -6.759
   23    H    HIS   4           H        HIS   4  13.891  21.303  -7.942
   24    HA   HIS   4           HA       HIS   4  15.613  21.031 -10.098
   25    HB2  HIS   4           2HB      HIS   4  17.730  20.334  -9.015
   26    HB3  HIS   4           1HB      HIS   4  17.371  22.030  -8.732
   27    HD1  HIS   4           HD1      HIS   4  18.374  19.031  -7.015
   28    HD2  HIS   4           HD2      HIS   4  16.235  22.445  -6.007
   29    HE1  HIS   4           HE1      HIS   4  18.427  19.140  -4.513
   30    HE2  HIS   4           HE2      HIS   4  17.306  21.316  -3.943
   31    H    HIS   5           H        HIS   5  16.243  18.744 -10.444
   32    HA   HIS   5           HA       HIS   5  14.099  17.078  -9.403
   33    HB2  HIS   5           2HB      HIS   5  16.153  16.591 -11.564
   34    HB3  HIS   5           1HB      HIS   5  14.882  15.450 -11.133
   35    HD1  HIS   5           HD1      HIS   5  15.524  18.509 -13.104
   36    HD2  HIS   5           HD2      HIS   5  12.228  16.353 -11.771
   37    HE1  HIS   5           HE1      HIS   5  13.574  19.364 -14.434
   38    HE2  HIS   5           HE2      HIS   5  11.601  18.013 -13.650
   39    H    HIS   6           H        HIS   6  17.629  17.172  -9.189
   40    HA   HIS   6           HA       HIS   6  17.914  14.578  -8.054
   41    HB2  HIS   6           2HB      HIS   6  19.775  15.785  -9.134
   42    HB3  HIS   6           1HB      HIS   6  19.771  16.958  -7.823
   43    HD1  HIS   6           HD1      HIS   6  20.461  13.294  -8.455
   44    HD2  HIS   6           HD2      HIS   6  21.273  16.233  -5.634
   45    HE1  HIS   6           HE1      HIS   6  22.102  12.266  -6.870
   46    HE2  HIS   6           HE2      HIS   6  22.726  14.117  -5.293
   47    H    HIS   7           H        HIS   7  16.893  14.048  -6.222
   48    HA   HIS   7           HA       HIS   7  17.585  15.528  -3.782
   49    HB2  HIS   7           2HB      HIS   7  14.767  14.704  -4.538
   50    HB3  HIS   7           1HB      HIS   7  15.241  15.157  -2.908
   51    HD1  HIS   7           HD1      HIS   7  15.543  17.657  -2.410
   52    HD2  HIS   7           HD2      HIS   7  14.563  16.845  -6.366
   53    HE1  HIS   7           HE1      HIS   7  14.866  19.856  -3.397
   54    HE2  HIS   7           HE2      HIS   7  14.099  19.310  -5.730
   55    H    HIS   8           H        HIS   8  16.556  14.105  -1.838
   56    HA   HIS   8           HA       HIS   8  16.904  11.236  -2.436
   57    HB2  HIS   8           2HB      HIS   8  17.989  12.812  -0.097
   58    HB3  HIS   8           1HB      HIS   8  17.803  11.062  -0.036
   59    HD1  HIS   8           HD1      HIS   8  19.687   9.715  -0.945
   60    HD2  HIS   8           HD2      HIS   8  19.854  13.673  -2.198
   61    HE1  HIS   8           HE1      HIS   8  21.842   9.927  -2.208
   62    HE2  HIS   8           HE2      HIS   8  21.871  12.293  -3.054
   63    H    SER   9           H        SER   9  16.109  10.046  -0.153
   64    HA   SER   9           HA       SER   9  14.273   9.360   1.018
   65    HB2  SER   9           2HB      SER   9  13.501  12.296   0.975
   66    HB3  SER   9           1HB      SER   9  12.794  11.066   2.023
   67    HG   SER   9           HG       SER   9  15.468  11.014   2.272
   68    H    HIS  10           H        HIS  10  14.202   9.380  -1.881
   69    HA   HIS  10           HA       HIS  10  11.724  10.254  -2.902
   70    HB2  HIS  10           2HB      HIS  10  12.212   8.699  -4.804
   71    HB3  HIS  10           1HB      HIS  10  13.534   9.793  -4.417
   72    HD1  HIS  10           HD1      HIS  10  12.549   6.235  -3.437
   73    HD2  HIS  10           HD2      HIS  10  15.910   8.497  -4.365
   74    HE1  HIS  10           HE1      HIS  10  14.476   4.630  -3.395
   75    HE2  HIS  10           HE2      HIS  10  16.456   5.976  -4.151
   76    H    MET  11           H        MET  11   9.724   9.398  -2.905
   77    HA   MET  11           HA       MET  11   9.075   7.220  -1.197
   78    HB2  MET  11           2HB      MET  11   6.776   7.565  -1.935
   79    HB3  MET  11           1HB      MET  11   7.547   9.103  -1.577
   80    HG2  MET  11           2HG      MET  11   7.886   9.499  -3.965
   81    HG3  MET  11           1HG      MET  11   7.132   7.948  -4.335
   82    HE1  MET  11           3HE      MET  11   4.429  10.496  -5.550
   83    HE2  MET  11           1HE      MET  11   5.428   9.109  -5.986
   84    HE3  MET  11           2HE      MET  11   6.180  10.670  -5.659
   85    H    VAL  12           H        VAL  12   7.911   5.275  -1.800
   86    HA   VAL  12           HA       VAL  12   8.411   4.279  -4.530
   87    HB   VAL  12           HB       VAL  12   8.943   2.711  -1.983
   88   HG11  VAL  12          1HG1      VAL  12   9.237   1.867  -4.870
   89   HG12  VAL  12          2HG1      VAL  12   8.011   1.289  -3.739
   90   HG13  VAL  12          3HG1      VAL  12   9.712   0.916  -3.460
   91   HG21  VAL  12          3HG2      VAL  12  10.848   3.742  -4.095
   92   HG22  VAL  12          1HG2      VAL  12  11.287   2.682  -2.753
   93   HG23  VAL  12          2HG2      VAL  12  10.714   4.317  -2.433
   94    H    VAL  13           H        VAL  13   6.713   3.094  -5.391
   95    HA   VAL  13           HA       VAL  13   4.254   3.185  -3.773
   96    HB   VAL  13           HB       VAL  13   3.023   3.152  -5.904
   97   HG11  VAL  13          1HG1      VAL  13   3.612   5.296  -4.917
   98   HG12  VAL  13          2HG1      VAL  13   3.661   5.399  -6.677
   99   HG13  VAL  13          3HG1      VAL  13   5.162   5.281  -5.758
  100   HG21  VAL  13          3HG2      VAL  13   4.237   3.416  -8.039
  101   HG22  VAL  13          1HG2      VAL  13   4.586   1.868  -7.265
  102   HG23  VAL  13          2HG2      VAL  13   5.763   3.179  -7.185
  103    H    ILE  14           H        ILE  14   2.601   1.552  -4.154
  104    HA   ILE  14           HA       ILE  14   3.753  -1.138  -4.476
  105    HB   ILE  14           HB       ILE  14   2.719  -0.584  -2.276
  106   HG12  ILE  14          2HG1      ILE  14   1.129  -2.607  -2.237
  107   HG13  ILE  14          1HG1      ILE  14   1.496  -2.785  -3.950
  108   HG21  ILE  14          1HG2      ILE  14   0.291  -0.374  -2.075
  109   HG22  ILE  14          2HG2      ILE  14   0.142  -0.399  -3.831
  110   HG23  ILE  14          3HG2      ILE  14   0.979   0.935  -3.038
  111   HD11  ILE  14          3HD1      ILE  14   3.476  -2.885  -1.685
  112   HD12  ILE  14          1HD1      ILE  14   3.867  -3.041  -3.399
  113   HD13  ILE  14          2HD1      ILE  14   2.861  -4.254  -2.607
  114    H    ARG  15           H        ARG  15   2.871  -2.579  -5.952
  115    HA   ARG  15           HA       ARG  15   0.842  -1.476  -7.802
  116    HB2  ARG  15           2HB      ARG  15   3.238  -1.585  -8.646
  117    HB3  ARG  15           1HB      ARG  15   3.115  -3.333  -8.550
  118    HG2  ARG  15           2HG      ARG  15   2.731  -2.742 -10.806
  119    HG3  ARG  15           1HG      ARG  15   1.159  -3.182 -10.133
  120    HD2  ARG  15           2HD      ARG  15   0.965  -1.183 -11.500
  121    HD3  ARG  15           1HD      ARG  15   0.646  -0.797  -9.808
  122    HE   ARG  15           HE       ARG  15   3.365  -0.369 -10.728
  123   HH11  ARG  15          1HH1      ARG  15   0.264   1.029 -10.195
  124   HH12  ARG  15          2HH1      ARG  15   0.884   2.633 -10.046
  125   HH21  ARG  15          1HH2      ARG  15   4.164   1.685 -10.565
  126   HH22  ARG  15          2HH2      ARG  15   3.088   3.002 -10.261
  127    H    ARG  16           H        ARG  16  -0.388  -3.088  -9.036
  128    HA   ARG  16           HA       ARG  16  -1.523  -5.016  -9.424
  129    HB2  ARG  16           2HB      ARG  16   0.397  -6.210  -7.420
  130    HB3  ARG  16           1HB      ARG  16  -0.834  -7.143  -8.260
  131    HG2  ARG  16           2HG      ARG  16   1.375  -5.600  -9.619
  132    HG3  ARG  16           1HG      ARG  16   1.421  -7.329  -9.265
  133    HD2  ARG  16           2HD      ARG  16  -0.601  -7.638 -10.655
  134    HD3  ARG  16           1HD      ARG  16  -0.576  -5.918 -11.045
  135    HE   ARG  16           HE       ARG  16   1.882  -7.250 -11.677
  136   HH11  ARG  16          1HH1      ARG  16  -1.313  -6.640 -12.818
  137   HH12  ARG  16          2HH1      ARG  16  -0.849  -6.724 -14.483
  138   HH21  ARG  16          1HH2      ARG  16   2.452  -7.380 -13.810
  139   HH22  ARG  16          2HH2      ARG  16   1.257  -7.124 -15.034
  140    H    LEU  17           H        LEU  17  -2.248  -3.047  -7.322
  141    HA   LEU  17           HA       LEU  17  -3.735  -4.634  -5.379
  142    HB2  LEU  17           2HB      LEU  17  -3.395  -1.668  -5.787
  143    HB3  LEU  17           1HB      LEU  17  -4.571  -2.313  -4.662
  144    HG   LEU  17           HG       LEU  17  -2.568  -1.653  -3.476
  145   HD11  LEU  17          1HD1      LEU  17  -2.759  -4.661  -3.599
  146   HD12  LEU  17          2HD1      LEU  17  -3.805  -3.602  -2.654
  147   HD13  LEU  17          3HD1      LEU  17  -2.085  -3.700  -2.281
  148   HD21  LEU  17          3HD2      LEU  17  -1.108  -3.589  -5.270
  149   HD22  LEU  17          1HD2      LEU  17  -0.421  -2.770  -3.868
  150   HD23  LEU  17          2HD2      LEU  17  -0.947  -1.832  -5.263
  151    HA   PRO  18           HA       PRO  18  -7.365  -4.275  -8.079
  152    HB2  PRO  18           2HB      PRO  18  -8.412  -6.672  -7.562
  153    HB3  PRO  18           1HB      PRO  18  -6.954  -6.519  -8.550
  154    HG2  PRO  18           2HG      PRO  18  -7.237  -7.406  -5.719
  155    HG3  PRO  18           1HG      PRO  18  -6.081  -7.936  -6.952
  156    HD2  PRO  18           2HD      PRO  18  -5.639  -6.015  -4.903
  157    HD3  PRO  18           1HD      PRO  18  -4.560  -6.397  -6.257
  158    HA   PRO  19           HA       PRO  19 -10.370  -2.840  -5.060
  159    HB2  PRO  19           2HB      PRO  19 -12.422  -3.859  -6.960
  160    HB3  PRO  19           1HB      PRO  19 -12.217  -2.236  -6.290
  161    HG2  PRO  19           2HG      PRO  19 -11.572  -2.750  -8.827
  162    HG3  PRO  19           1HG      PRO  19 -10.587  -1.655  -7.838
  163    HD2  PRO  19           2HD      PRO  19 -10.057  -4.504  -8.615
  164    HD3  PRO  19           1HD      PRO  19  -8.929  -3.134  -8.503
  165    H    GLY  20           H        GLY  20 -10.782  -3.962  -3.237
  166    HA2  GLY  20           2HA      GLY  20 -12.561  -6.215  -3.220
  167    HA3  GLY  20           1HA      GLY  20 -10.898  -6.693  -2.925
  168    H    LEU  21           H        LEU  21 -10.119  -4.401  -1.381
  169    HA   LEU  21           HA       LEU  21 -11.849  -4.659   0.980
  170    HB2  LEU  21           2HB      LEU  21 -10.023  -5.118   2.454
  171    HB3  LEU  21           1HB      LEU  21 -10.021  -6.307   1.170
  172    HG   LEU  21           HG       LEU  21  -8.127  -3.956   1.412
  173   HD11  LEU  21          1HD1      LEU  21  -7.703  -5.693   3.067
  174   HD12  LEU  21          2HD1      LEU  21  -6.429  -5.655   1.850
  175   HD13  LEU  21          3HD1      LEU  21  -7.663  -6.915   1.794
  176   HD21  LEU  21          3HD2      LEU  21  -6.888  -5.117  -0.433
  177   HD22  LEU  21          1HD2      LEU  21  -8.423  -4.404  -0.919
  178   HD23  LEU  21          2HD2      LEU  21  -8.304  -6.144  -0.664
  179    H    THR  22           H        THR  22 -11.329  -3.106   2.713
  180    HA   THR  22           HA       THR  22 -10.904  -0.461   1.550
  181    HB   THR  22           HB       THR  22 -11.955  -1.240   4.289
  182    HG1  THR  22           HG1      THR  22 -13.837  -1.406   3.336
  183   HG21  THR  22          3HG2      THR  22 -11.987   1.448   2.898
  184   HG22  THR  22          1HG2      THR  22 -10.972   1.018   4.275
  185   HG23  THR  22          2HG2      THR  22 -12.725   1.079   4.456
  186    H    LYS  23           H        LYS  23  -9.548   1.113   2.596
  187    HA   LYS  23           HA       LYS  23  -6.958   0.478   3.012
  188    HB2  LYS  23           2HB      LYS  23  -6.705   2.634   4.201
  189    HB3  LYS  23           1HB      LYS  23  -7.659   2.754   2.730
  190    HG2  LYS  23           2HG      LYS  23  -9.719   2.745   4.082
  191    HG3  LYS  23           1HG      LYS  23  -8.737   2.677   5.546
  192    HD2  LYS  23           2HD      LYS  23  -9.491   4.967   5.047
  193    HD3  LYS  23           1HD      LYS  23  -7.732   4.828   5.006
  194    HE2  LYS  23           2HE      LYS  23  -7.794   4.700   2.564
  195    HE3  LYS  23           1HE      LYS  23  -9.552   4.805   2.595
  196    HZ1  LYS  23           3HZ      LYS  23  -8.647   6.942   2.105
  197    HZ2  LYS  23           1HZ      LYS  23  -7.638   6.898   3.461
  198    HZ3  LYS  23           2HZ      LYS  23  -9.314   7.000   3.653
  199    H    GLU  24           H        GLU  24  -9.443   0.224   5.480
  200    HA   GLU  24           HA       GLU  24  -8.005   0.086   7.825
  201    HB2  GLU  24           2HB      GLU  24 -10.277  -1.764   7.063
  202    HB3  GLU  24           1HB      GLU  24  -9.779  -1.340   8.695
  203    HG2  GLU  24           2HG      GLU  24 -10.462   0.970   8.324
  204    HG3  GLU  24           1HG      GLU  24 -10.924   0.576   6.667
  205    H    GLN  25           H        GLN  25  -8.929  -2.788   5.932
  206    HA   GLN  25           HA       GLN  25  -6.860  -4.407   7.226
  207    HB2  GLN  25           2HB      GLN  25  -8.840  -5.236   5.088
  208    HB3  GLN  25           1HB      GLN  25  -7.977  -6.280   6.209
  209    HG2  GLN  25           2HG      GLN  25  -9.287  -5.533   8.048
  210    HG3  GLN  25           1HG      GLN  25  -9.992  -4.227   7.095
  211   HE21  GLN  25          1HE2      GLN  25 -11.578  -4.717   5.565
  212   HE22  GLN  25          2HE2      GLN  25 -12.422  -6.226   5.570
  213    H    LEU  26           H        LEU  26  -6.714  -2.278   4.854
  214    HA   LEU  26           HA       LEU  26  -5.142  -3.898   2.967
  215    HB2  LEU  26           2HB      LEU  26  -6.926  -2.722   1.918
  216    HB3  LEU  26           1HB      LEU  26  -6.521  -1.229   2.733
  217    HG   LEU  26           HG       LEU  26  -4.372  -1.202   1.398
  218   HD11  LEU  26          1HD1      LEU  26  -4.272  -3.564   0.826
  219   HD12  LEU  26          2HD1      LEU  26  -4.288  -2.573  -0.631
  220   HD13  LEU  26          3HD1      LEU  26  -5.753  -3.415  -0.122
  221   HD21  LEU  26          3HD2      LEU  26  -6.961  -1.130  -0.161
  222   HD22  LEU  26          1HD2      LEU  26  -5.444  -0.358  -0.629
  223   HD23  LEU  26          2HD2      LEU  26  -6.304   0.190   0.811
  224    H    GLU  27           H        GLU  27  -4.931  -1.171   5.169
  225    HA   GLU  27           HA       GLU  27  -2.364  -0.257   4.298
  226    HB2  GLU  27           2HB      GLU  27  -2.389   1.141   6.284
  227    HB3  GLU  27           1HB      GLU  27  -3.967   1.191   5.510
  228    HG2  GLU  27           2HG      GLU  27  -4.820  -0.419   7.158
  229    HG3  GLU  27           1HG      GLU  27  -3.240  -0.452   7.937
  230    H    GLU  28           H        GLU  28  -3.460  -2.668   6.581
  231    HA   GLU  28           HA       GLU  28  -1.204  -2.720   8.264
  232    HB2  GLU  28           2HB      GLU  28  -2.077  -4.870   9.074
  233    HB3  GLU  28           1HB      GLU  28  -3.326  -3.645   8.976
  234    HG2  GLU  28           2HG      GLU  28  -4.210  -4.636   6.968
  235    HG3  GLU  28           1HG      GLU  28  -2.883  -5.797   6.914
  236    H    GLN  29           H        GLN  29  -1.658  -4.072   5.103
  237    HA   GLN  29           HA       GLN  29   0.877  -5.556   5.410
  238    HB2  GLN  29           2HB      GLN  29   0.255  -6.940   3.526
  239    HB3  GLN  29           1HB      GLN  29  -1.012  -6.983   4.738
  240    HG2  GLN  29           2HG      GLN  29  -1.203  -5.132   2.381
  241    HG3  GLN  29           1HG      GLN  29  -1.654  -6.828   2.243
  242   HE21  GLN  29          1HE2      GLN  29  -3.813  -6.391   1.863
  243   HE22  GLN  29          2HE2      GLN  29  -4.868  -5.787   3.089
  244    H    LEU  30           H        LEU  30  -0.194  -2.658   4.305
  245    HA   LEU  30           HA       LEU  30   1.766  -2.566   2.098
  246    HB2  LEU  30           2HB      LEU  30  -0.527  -0.698   2.713
  247    HB3  LEU  30           1HB      LEU  30   0.631  -0.458   1.418
  248    HG   LEU  30           HG       LEU  30  -1.406  -2.673   1.652
  249   HD11  LEU  30          1HD1      LEU  30  -2.262  -1.726  -0.452
  250   HD12  LEU  30          2HD1      LEU  30  -1.065  -0.434  -0.343
  251   HD13  LEU  30          3HD1      LEU  30  -2.327  -0.574   0.881
  252   HD21  LEU  30          3HD2      LEU  30  -0.563  -3.489  -0.505
  253   HD22  LEU  30          1HD2      LEU  30   0.646  -3.620   0.771
  254   HD23  LEU  30          2HD2      LEU  30   0.760  -2.326  -0.421
  255    H    ARG  31           H        ARG  31   1.003  -1.165   5.227
  256    HA   ARG  31           HA       ARG  31   3.530   0.345   5.056
  257    HB2  ARG  31           2HB      ARG  31   2.522   2.177   6.359
  258    HB3  ARG  31           1HB      ARG  31   1.719   1.935   4.819
  259    HG2  ARG  31           2HG      ARG  31  -0.089   2.252   6.192
  260    HG3  ARG  31           1HG      ARG  31   0.045   0.497   6.259
  261    HD2  ARG  31           2HD      ARG  31   1.323   0.709   8.371
  262    HD3  ARG  31           1HD      ARG  31   1.106   2.455   8.301
  263    HE   ARG  31           HE       ARG  31  -1.403   1.768   8.326
  264   HH11  ARG  31          1HH1      ARG  31   1.177   0.288  10.071
  265   HH12  ARG  31          2HH1      ARG  31   0.160  -0.227  11.367
  266   HH21  ARG  31          1HH2      ARG  31  -2.701   1.144  10.003
  267   HH22  ARG  31          2HH2      ARG  31  -2.027   0.262  11.331
  268    HA   PRO  32           HA       PRO  32   2.895  -2.054   9.211
  269    HB2  PRO  32           2HB      PRO  32   4.014  -4.462   8.826
  270    HB3  PRO  32           1HB      PRO  32   2.340  -4.136   8.353
  271    HG2  PRO  32           2HG      PRO  32   4.813  -4.153   6.645
  272    HG3  PRO  32           1HG      PRO  32   3.237  -4.903   6.328
  273    HD2  PRO  32           2HD      PRO  32   3.978  -2.505   5.270
  274    HD3  PRO  32           1HD      PRO  32   2.290  -2.915   5.638
  275    H    LEU  33           H        LEU  33   5.162  -0.533   7.722
  276    HA   LEU  33           HA       LEU  33   7.608  -1.592   8.787
  277    HB2  LEU  33           2HB      LEU  33   6.963   1.120   7.610
  278    HB3  LEU  33           1HB      LEU  33   8.575   0.576   8.023
  279    HG   LEU  33           HG       LEU  33   8.309  -1.262   6.322
  280   HD11  LEU  33          1HD1      LEU  33   5.867  -1.317   6.195
  281   HD12  LEU  33          2HD1      LEU  33   6.589  -1.042   4.610
  282   HD13  LEU  33          3HD1      LEU  33   5.864   0.302   5.494
  283   HD21  LEU  33          3HD2      LEU  33   9.581   0.733   5.812
  284   HD22  LEU  33          1HD2      LEU  33   8.111   1.587   5.335
  285   HD23  LEU  33          2HD2      LEU  33   8.682   0.210   4.389
  286    HA   PRO  34           HA       PRO  34   7.639  -0.288  12.982
  287    HB2  PRO  34           2HB      PRO  34  10.089   1.212  12.863
  288    HB3  PRO  34           1HB      PRO  34   9.834  -0.422  13.478
  289    HG2  PRO  34           2HG      PRO  34  10.837   0.465  10.845
  290    HG3  PRO  34           1HG      PRO  34  11.105  -1.066  11.695
  291    HD2  PRO  34           2HD      PRO  34   9.518  -0.895   9.522
  292    HD3  PRO  34           1HD      PRO  34   9.168  -2.016  10.855
  293    H    ALA  35           H        ALA  35   8.771   2.398  10.858
  294    HA   ALA  35           HA       ALA  35   6.660   4.118  11.750
  295    HB1  ALA  35           3HB      ALA  35   9.435   4.766  12.748
  296    HB2  ALA  35           1HB      ALA  35   8.065   4.259  13.735
  297    HB3  ALA  35           2HB      ALA  35   8.015   5.806  12.892
  298    H    HIS  36           H        HIS  36   6.161   5.300  10.046
  299    HA   HIS  36           HA       HIS  36   7.817   7.200   8.871
  300    HB2  HIS  36           2HB      HIS  36   8.333   6.388   6.688
  301    HB3  HIS  36           1HB      HIS  36   8.882   5.146   7.807
  302    HD1  HIS  36           HD1      HIS  36   6.786   5.653   4.865
  303    HD2  HIS  36           HD2      HIS  36   7.032   2.875   7.941
  304    HE1  HIS  36           HE1      HIS  36   5.537   3.646   4.049
  305    HE2  HIS  36           HE2      HIS  36   5.882   1.916   5.835
  306    H    ASP  37           H        ASP  37   6.740   8.408   7.157
  307    HA   ASP  37           HA       ASP  37   3.945   8.583   7.486
  308    HB2  ASP  37           2HB      ASP  37   5.353  10.498   6.848
  309    HB3  ASP  37           1HB      ASP  37   5.696   9.735   5.297
  310    H    TYR  38           H        TYR  38   2.266   8.246   5.934
  311    HA   TYR  38           HA       TYR  38   2.850   6.364   3.759
  312    HB2  TYR  38           2HB      TYR  38   0.633   5.177   4.465
  313    HB3  TYR  38           1HB      TYR  38   2.131   4.787   5.296
  314    HD1  TYR  38           HD2      TYR  38   2.499   5.472   7.606
  315    HD2  TYR  38           HD1      TYR  38  -1.160   6.394   5.619
  316    HE1  TYR  38           HE2      TYR  38   1.458   5.988   9.772
  317    HE2  TYR  38           HE1      TYR  38  -2.205   6.910   7.785
  318    HH   TYR  38           HH       TYR  38  -0.434   7.330  10.645
  319    H    PHE  39           H        PHE  39   1.113   6.206   2.149
  320    HA   PHE  39           HA       PHE  39  -0.037   8.885   1.756
  321    HB2  PHE  39           2HB      PHE  39   1.608   7.465   0.132
  322    HB3  PHE  39           1HB      PHE  39   0.052   6.935  -0.490
  323    HD1  PHE  39           HD2      PHE  39   2.112   9.933   0.199
  324    HD2  PHE  39           HD1      PHE  39  -1.184   8.315  -1.957
  325    HE1  PHE  39           HE2      PHE  39   1.987  11.987  -1.150
  326    HE2  PHE  39           HE1      PHE  39  -1.311  10.366  -3.310
  327    HZ   PHE  39           HZ       PHE  39   0.272  12.205  -2.904
  328    H    GLU  40           H        GLU  40  -2.038   8.683   0.103
  329    HA   GLU  40           HA       GLU  40  -4.160   7.583   1.585
  330    HB2  GLU  40           2HB      GLU  40  -5.577   8.173  -0.380
  331    HB3  GLU  40           1HB      GLU  40  -4.567   9.490   0.199
  332    HG2  GLU  40           2HG      GLU  40  -2.995   9.113  -1.619
  333    HG3  GLU  40           1HG      GLU  40  -3.961   7.756  -2.195
  334    H    PHE  41           H        PHE  41  -5.293   5.735   1.482
  335    HA   PHE  41           HA       PHE  41  -4.557   3.714  -0.548
  336    HB2  PHE  41           2HB      PHE  41  -5.900   3.231   2.125
  337    HB3  PHE  41           1HB      PHE  41  -5.266   2.014   1.027
  338    HD1  PHE  41           HD1      PHE  41  -2.794   1.774   0.751
  339    HD2  PHE  41           HD2      PHE  41  -4.508   4.335   3.696
  340    HE1  PHE  41           HE1      PHE  41  -0.648   1.825   1.954
  341    HE2  PHE  41           HE2      PHE  41  -2.361   4.388   4.898
  342    HZ   PHE  41           HZ       PHE  41  -0.429   3.134   4.030
  343    H    PHE  42           H        PHE  42  -6.325   2.436  -1.464
  344    HA   PHE  42           HA       PHE  42  -8.681   4.055  -1.907
  345    HB2  PHE  42           2HB      PHE  42  -9.298   2.417  -3.599
  346    HB3  PHE  42           1HB      PHE  42  -7.614   2.883  -3.792
  347    HD1  PHE  42           HD2      PHE  42  -5.820   1.295  -3.319
  348    HD2  PHE  42           HD1      PHE  42  -9.911   0.168  -2.960
  349    HE1  PHE  42           HE2      PHE  42  -5.165  -1.075  -3.312
  350    HE2  PHE  42           HE1      PHE  42  -9.261  -2.205  -2.957
  351    HZ   PHE  42           HZ       PHE  42  -6.887  -2.829  -3.132
  352    H    ALA  43           H        ALA  43 -10.857   2.839  -2.043
  353    HA   ALA  43           HA       ALA  43 -11.216   0.953   0.186
  354    HB1  ALA  43           3HB      ALA  43 -11.710   3.194   1.054
  355    HB2  ALA  43           1HB      ALA  43 -13.155   2.185   1.003
  356    HB3  ALA  43           2HB      ALA  43 -12.903   3.426  -0.225
  357    H    ALA  44           H        ALA  44 -12.300  -0.777  -0.493
  358    HA   ALA  44           HA       ALA  44 -14.572  -0.538  -2.284
  359    HB1  ALA  44           3HB      ALA  44 -12.716  -0.700  -3.861
  360    HB2  ALA  44           1HB      ALA  44 -13.718  -2.151  -3.922
  361    HB3  ALA  44           2HB      ALA  44 -12.167  -2.183  -3.082
  362    H    ASP  45           H        ASP  45 -15.872  -2.460  -2.366
  363    HA   ASP  45           HA       ASP  45 -15.405  -4.262  -0.082
  364    HB2  ASP  45           2HB      ASP  45 -17.458  -2.928   0.055
  365    HB3  ASP  45           1HB      ASP  45 -17.979  -3.545  -1.509
  366    H    LEU  46           H        LEU  46 -14.885  -6.314  -0.492
  367    HA   LEU  46           HA       LEU  46 -14.759  -7.352  -3.132
  368    HB2  LEU  46           2HB      LEU  46 -13.947  -9.414  -2.152
  369    HB3  LEU  46           1HB      LEU  46 -13.138  -8.033  -1.450
  370    HG   LEU  46           HG       LEU  46 -15.346  -9.603  -0.084
  371   HD11  LEU  46          1HD1      LEU  46 -12.360  -9.675   0.348
  372   HD12  LEU  46          2HD1      LEU  46 -13.332 -10.952  -0.382
  373   HD13  LEU  46          3HD1      LEU  46 -13.567 -10.523   1.314
  374   HD21  LEU  46          3HD2      LEU  46 -14.629  -8.406   1.940
  375   HD22  LEU  46          1HD2      LEU  46 -15.234  -7.297   0.706
  376   HD23  LEU  46          2HD2      LEU  46 -13.497  -7.460   0.972
  377    H    SER  47           H        SER  47 -16.927  -7.096  -3.827
  378    HA   SER  47           HA       SER  47 -18.724  -9.278  -2.960
  379    HB2  SER  47           2HB      SER  47 -19.580  -7.028  -2.309
  380    HB3  SER  47           1HB      SER  47 -19.563  -6.555  -4.009
  381    HG   SER  47           HG       SER  47 -21.453  -7.879  -2.656
  382    H    LEU  48           H        LEU  48 -20.589  -9.300  -4.885
  383    HA   LEU  48           HA       LEU  48 -19.257 -10.596  -7.021
  384    HB2  LEU  48           2HB      LEU  48 -21.554 -11.121  -6.134
  385    HB3  LEU  48           1HB      LEU  48 -22.145  -9.698  -6.966
  386    HG   LEU  48           HG       LEU  48 -20.740 -11.894  -8.483
  387   HD11  LEU  48          1HD1      LEU  48 -22.920 -12.908  -8.949
  388   HD12  LEU  48          2HD1      LEU  48 -23.682 -11.800  -7.805
  389   HD13  LEU  48          3HD1      LEU  48 -22.512 -12.992  -7.235
  390   HD21  LEU  48          3HD2      LEU  48 -21.094  -9.799  -9.673
  391   HD22  LEU  48          1HD2      LEU  48 -22.813  -9.838  -9.281
  392   HD23  LEU  48          2HD2      LEU  48 -22.119 -11.064 -10.344
  393    H    TYR  49           H        TYR  49 -18.200  -9.674  -8.592
  394    HA   TYR  49           HA       TYR  49 -17.565  -8.340 -10.291
  395    HB2  TYR  49           2HB      TYR  49 -19.896  -8.684 -11.089
  396    HB3  TYR  49           1HB      TYR  49 -20.375  -7.219 -10.239
  397    HD1  TYR  49           HD1      TYR  49 -17.838  -8.354 -12.745
  398    HD2  TYR  49           HD2      TYR  49 -20.445  -5.234 -11.470
  399    HE1  TYR  49           HE1      TYR  49 -17.226  -7.036 -14.726
  400    HE2  TYR  49           HE2      TYR  49 -19.835  -3.911 -13.453
  401    HH   TYR  49           HH       TYR  49 -18.128  -5.245 -16.089
  402    HA   PRO  50           HA       PRO  50 -16.606  -4.837  -7.452
  403    HB2  PRO  50           2HB      PRO  50 -13.971  -4.715  -8.198
  404    HB3  PRO  50           1HB      PRO  50 -14.572  -5.768  -6.912
  405    HG2  PRO  50           2HG      PRO  50 -13.963  -6.427  -9.775
  406    HG3  PRO  50           1HG      PRO  50 -13.584  -7.353  -8.307
  407    HD2  PRO  50           2HD      PRO  50 -15.674  -7.988  -9.899
  408    HD3  PRO  50           1HD      PRO  50 -15.740  -8.205  -8.138
  409    H    HIS  51           H        HIS  51 -17.918  -3.498  -8.764
  410    HA   HIS  51           HA       HIS  51 -17.086  -2.569 -11.341
  411    HB2  HIS  51           2HB      HIS  51 -19.014  -0.965 -11.071
  412    HB3  HIS  51           1HB      HIS  51 -19.437  -2.664 -10.901
  413    HD1  HIS  51           HD1      HIS  51 -20.165  -3.480  -8.532
  414    HD2  HIS  51           HD2      HIS  51 -19.353   0.592  -8.768
  415    HE1  HIS  51           HE1      HIS  51 -21.043  -2.490  -6.401
  416    HE2  HIS  51           HE2      HIS  51 -20.460  -0.049  -6.522
  417    H    LEU  52           H        LEU  52 -14.873  -1.960 -10.478
  418    HA   LEU  52           HA       LEU  52 -14.563   0.846 -10.291
  419    HB2  LEU  52           2HB      LEU  52 -15.422   0.416  -7.996
  420    HB3  LEU  52           1HB      LEU  52 -14.082  -0.679  -7.717
  421    HG   LEU  52           HG       LEU  52 -12.506   1.231  -7.974
  422   HD11  LEU  52          1HD1      LEU  52 -13.886   2.656  -9.397
  423   HD12  LEU  52          2HD1      LEU  52 -13.368   3.515  -7.949
  424   HD13  LEU  52          3HD1      LEU  52 -15.019   2.903  -8.065
  425   HD21  LEU  52          3HD2      LEU  52 -12.987   2.267  -5.821
  426   HD22  LEU  52          1HD2      LEU  52 -13.274   0.527  -5.751
  427   HD23  LEU  52          2HD2      LEU  52 -14.636   1.642  -5.870
  428    H    TYR  53           H        TYR  53 -12.256   1.474 -10.060
  429    HA   TYR  53           HA       TYR  53 -10.284  -0.638  -9.851
  430    HB2  TYR  53           2HB      TYR  53  -9.132  -0.136 -11.946
  431    HB3  TYR  53           1HB      TYR  53 -10.779  -0.660 -12.262
  432    HD1  TYR  53           HD1      TYR  53 -12.540   1.206 -12.693
  433    HD2  TYR  53           HD2      TYR  53  -8.331   1.849 -12.903
  434    HE1  TYR  53           HE1      TYR  53 -12.916   3.212 -14.064
  435    HE2  TYR  53           HE2      TYR  53  -8.702   3.859 -14.269
  436    HH   TYR  53           HH       TYR  53 -11.689   5.345 -14.587
  437    H    SER  54           H        SER  54  -8.941   0.121  -8.353
  438    HA   SER  54           HA       SER  54  -7.784   2.777  -8.531
  439    HB2  SER  54           2HB      SER  54  -8.543   3.445  -6.255
  440    HB3  SER  54           1HB      SER  54  -9.882   3.284  -7.389
  441    HG   SER  54           HG       SER  54  -9.082   1.202  -5.629
  442    H    ARG  55           H        ARG  55  -5.803   2.898  -7.529
  443    HA   ARG  55           HA       ARG  55  -4.946   0.511  -6.007
  444    HB2  ARG  55           2HB      ARG  55  -3.332   2.252  -7.885
  445    HB3  ARG  55           1HB      ARG  55  -2.627   1.028  -6.839
  446    HG2  ARG  55           2HG      ARG  55  -2.799  -0.009  -8.926
  447    HG3  ARG  55           1HG      ARG  55  -4.170  -0.636  -8.011
  448    HD2  ARG  55           2HD      ARG  55  -5.636   1.012  -9.125
  449    HD3  ARG  55           1HD      ARG  55  -4.257   1.585 -10.064
  450    HE   ARG  55           HE       ARG  55  -5.141  -1.221 -10.245
  451   HH11  ARG  55          1HH1      ARG  55  -4.547   1.822 -11.759
  452   HH12  ARG  55          2HH1      ARG  55  -4.725   1.179 -13.354
  453   HH21  ARG  55          1HH2      ARG  55  -5.373  -2.018 -12.293
  454   HH22  ARG  55          2HH2      ARG  55  -5.172  -0.971 -13.656
  455    H    ALA  56           H        ALA  56  -3.190   0.871  -4.447
  456    HA   ALA  56           HA       ALA  56  -3.582   3.392  -2.984
  457    HB1  ALA  56           3HB      ALA  56  -2.392   0.783  -2.025
  458    HB2  ALA  56           1HB      ALA  56  -4.058   1.307  -1.773
  459    HB3  ALA  56           2HB      ALA  56  -2.731   2.204  -1.034
  460    H    TYR  57           H        TYR  57  -1.642   4.288  -1.817
  461    HA   TYR  57           HA       TYR  57   0.854   3.906  -3.356
  462    HB2  TYR  57           2HB      TYR  57  -0.318   6.574  -2.515
  463    HB3  TYR  57           1HB      TYR  57   1.211   6.338  -3.354
  464    HD1  TYR  57           HD1      TYR  57  -2.453   6.261  -3.695
  465    HD2  TYR  57           HD2      TYR  57   1.268   5.817  -5.721
  466    HE1  TYR  57           HE1      TYR  57  -3.620   6.401  -5.854
  467    HE2  TYR  57           HE2      TYR  57   0.110   5.952  -7.885
  468    HH   TYR  57           HH       TYR  57  -2.892   7.129  -8.289
  469    H    ILE  58           H        ILE  58   2.816   4.649  -2.255
  470    HA   ILE  58           HA       ILE  58   2.583   4.743   0.684
  471    HB   ILE  58           HB       ILE  58   4.577   3.032  -0.829
  472   HG12  ILE  58          2HG1      ILE  58   2.205   2.187   0.870
  473   HG13  ILE  58          1HG1      ILE  58   2.283   2.097  -0.887
  474   HG21  ILE  58          1HG2      ILE  58   5.512   3.920   1.237
  475   HG22  ILE  58          2HG2      ILE  58   5.213   2.190   1.398
  476   HG23  ILE  58          3HG2      ILE  58   4.110   3.348   2.143
  477   HD11  ILE  58          3HD1      ILE  58   2.680  -0.071   0.082
  478   HD12  ILE  58          1HD1      ILE  58   4.003   0.572   1.055
  479   HD13  ILE  58          2HD1      ILE  58   4.149   0.512  -0.701
  480    H    ASN  59           H        ASN  59   4.063   6.050   1.727
  481    HA   ASN  59           HA       ASN  59   6.118   7.384   0.073
  482    HB2  ASN  59           2HB      ASN  59   4.342   8.936   0.797
  483    HB3  ASN  59           1HB      ASN  59   4.641   8.500   2.477
  484   HD21  ASN  59          1HD2      ASN  59   6.391   9.363   3.526
  485   HD22  ASN  59          2HD2      ASN  59   7.390  10.594   2.848
  486    H    PHE  60           H        PHE  60   8.181   7.746   1.028
  487    HA   PHE  60           HA       PHE  60   8.730   6.104   3.431
  488    HB2  PHE  60           2HB      PHE  60  10.101   6.172   0.770
  489    HB3  PHE  60           1HB      PHE  60  11.069   5.851   2.204
  490    HD1  PHE  60           HD2      PHE  60   8.415   4.573   0.010
  491    HD2  PHE  60           HD1      PHE  60  10.794   3.821   3.465
  492    HE1  PHE  60           HE2      PHE  60   7.736   2.206  -0.037
  493    HE2  PHE  60           HE1      PHE  60  10.125   1.464   3.420
  494    HZ   PHE  60           HZ       PHE  60   8.590   0.650   1.670
  495    H    ARG  61           H        ARG  61  10.938   6.610   4.378
  496    HA   ARG  61           HA       ARG  61  11.592   9.487   4.219
  497    HB2  ARG  61           2HB      ARG  61  11.404   7.796   6.725
  498    HB3  ARG  61           1HB      ARG  61  12.037   9.432   6.669
  499    HG2  ARG  61           2HG      ARG  61   9.217   8.629   5.976
  500    HG3  ARG  61           1HG      ARG  61   9.736   9.342   7.504
  501    HD2  ARG  61           2HD      ARG  61  10.555  11.324   6.219
  502    HD3  ARG  61           1HD      ARG  61   9.836  10.622   4.771
  503    HE   ARG  61           HE       ARG  61   7.995  10.914   6.962
  504   HH11  ARG  61          1HH1      ARG  61   9.410  12.467   4.233
  505   HH12  ARG  61          2HH1      ARG  61   8.125  13.614   4.081
  506   HH21  ARG  61          1HH2      ARG  61   6.345  12.401   6.756
  507   HH22  ARG  61          2HH2      ARG  61   6.413  13.572   5.481
  508    H    ASN  62           H        ASN  62  12.775   6.360   5.493
  509    HA   ASN  62           HA       ASN  62  15.532   7.345   5.267
  510    HB2  ASN  62           2HB      ASN  62  14.666   6.478   7.452
  511    HB3  ASN  62           1HB      ASN  62  14.506   4.895   6.713
  512   HD21  ASN  62          1HD2      ASN  62  16.270   3.608   6.572
  513   HD22  ASN  62          2HD2      ASN  62  17.848   4.062   7.102
  514    HA   PRO  63           HA       PRO  63  16.420   5.010   1.564
  515    HB2  PRO  63           2HB      PRO  63  19.077   4.640   2.890
  516    HB3  PRO  63           1HB      PRO  63  18.701   5.212   1.260
  517    HG2  PRO  63           2HG      PRO  63  19.434   6.911   3.178
  518    HG3  PRO  63           1HG      PRO  63  18.195   7.355   1.990
  519    HD2  PRO  63           2HD      PRO  63  17.893   6.597   4.858
  520    HD3  PRO  63           1HD      PRO  63  16.938   7.729   3.881
  521    H    ASP  64           H        ASP  64  17.931   3.606   4.499
  522    HA   ASP  64           HA       ASP  64  18.010   0.957   3.609
  523    HB2  ASP  64           2HB      ASP  64  19.282   1.724   5.545
  524    HB3  ASP  64           1HB      ASP  64  17.794   2.023   6.436
  525    H    ASP  65           H        ASP  65  15.426   2.758   5.186
  526    HA   ASP  65           HA       ASP  65  13.758   0.583   5.872
  527    HB2  ASP  65           2HB      ASP  65  13.611   2.973   6.718
  528    HB3  ASP  65           1HB      ASP  65  12.860   3.395   5.185
  529    H    ILE  66           H        ILE  66  14.209   2.415   2.929
  530    HA   ILE  66           HA       ILE  66  11.992   1.458   1.452
  531    HB   ILE  66           HB       ILE  66  14.687   2.391   0.436
  532   HG12  ILE  66          2HG1      ILE  66  12.108   3.942   0.805
  533   HG13  ILE  66          1HG1      ILE  66  13.523   4.070   1.843
  534   HG21  ILE  66          1HG2      ILE  66  13.508   2.858  -1.673
  535   HG22  ILE  66          2HG2      ILE  66  12.048   2.123  -1.006
  536   HG23  ILE  66          3HG2      ILE  66  13.491   1.143  -1.267
  537   HD11  ILE  66          3HD1      ILE  66  13.386   4.814  -1.072
  538   HD12  ILE  66          1HD1      ILE  66  14.822   4.919  -0.051
  539   HD13  ILE  66          2HD1      ILE  66  13.415   5.925   0.297
  540    H    LEU  67           H        LEU  67  15.439   0.525   1.114
  541    HA   LEU  67           HA       LEU  67  14.885  -1.641  -0.606
  542    HB2  LEU  67           2HB      LEU  67  17.272  -2.291  -0.190
  543    HB3  LEU  67           1HB      LEU  67  17.019  -0.656  -0.755
  544    HG   LEU  67           HG       LEU  67  17.185  -0.009   1.771
  545   HD11  LEU  67          1HD1      LEU  67  17.148  -2.248   2.707
  546   HD12  LEU  67          2HD1      LEU  67  18.683  -1.461   3.065
  547   HD13  LEU  67          3HD1      LEU  67  18.593  -2.679   1.792
  548   HD21  LEU  67          3HD2      LEU  67  18.788   0.653   0.047
  549   HD22  LEU  67          1HD2      LEU  67  19.621  -0.892   0.219
  550   HD23  LEU  67          2HD2      LEU  67  19.600   0.253   1.561
  551    H    LEU  68           H        LEU  68  15.201  -1.501   2.894
  552    HA   LEU  68           HA       LEU  68  15.502  -4.213   3.481
  553    HB2  LEU  68           2HB      LEU  68  15.795  -2.605   5.210
  554    HB3  LEU  68           1HB      LEU  68  14.178  -1.965   4.992
  555    HG   LEU  68           HG       LEU  68  13.230  -4.064   5.882
  556   HD11  LEU  68          1HD1      LEU  68  16.109  -4.834   6.392
  557   HD12  LEU  68          2HD1      LEU  68  15.013  -5.606   5.246
  558   HD13  LEU  68          3HD1      LEU  68  14.689  -5.704   6.976
  559   HD21  LEU  68          3HD2      LEU  68  15.270  -2.782   7.706
  560   HD22  LEU  68          1HD2      LEU  68  13.848  -3.694   8.211
  561   HD23  LEU  68          2HD2      LEU  68  13.656  -2.160   7.366
  562    H    PHE  69           H        PHE  69  12.412  -2.407   3.696
  563    HA   PHE  69           HA       PHE  69  10.898  -4.817   3.808
  564    HB2  PHE  69           2HB      PHE  69  10.240  -1.910   3.722
  565    HB3  PHE  69           1HB      PHE  69   8.956  -3.075   3.396
  566    HD1  PHE  69           HD1      PHE  69  11.375  -1.890   5.923
  567    HD2  PHE  69           HD2      PHE  69   8.057  -4.436   5.119
  568    HE1  PHE  69           HE1      PHE  69  11.087  -2.275   8.334
  569    HE2  PHE  69           HE2      PHE  69   7.762  -4.823   7.528
  570    HZ   PHE  69           HZ       PHE  69   9.281  -3.742   9.142
  571    H    ARG  70           H        ARG  70  11.852  -2.722   1.160
  572    HA   ARG  70           HA       ARG  70  10.140  -3.661  -0.829
  573    HB2  ARG  70           2HB      ARG  70  11.624  -1.856  -1.352
  574    HB3  ARG  70           1HB      ARG  70  13.042  -2.815  -0.960
  575    HG2  ARG  70           2HG      ARG  70  11.285  -3.725  -3.202
  576    HG3  ARG  70           1HG      ARG  70  12.344  -2.338  -3.461
  577    HD2  ARG  70           2HD      ARG  70  14.290  -3.638  -2.949
  578    HD3  ARG  70           1HD      ARG  70  13.309  -4.999  -2.407
  579    HE   ARG  70           HE       ARG  70  13.140  -4.129  -5.200
  580   HH11  ARG  70          1HH1      ARG  70  14.070  -6.487  -2.877
  581   HH12  ARG  70          2HH1      ARG  70  14.295  -7.732  -4.053
  582   HH21  ARG  70          1HH2      ARG  70  13.465  -5.752  -6.715
  583   HH22  ARG  70          2HH2      ARG  70  13.969  -7.318  -6.182
  584    H    ASP  71           H        ASP  71  13.161  -5.083   0.386
  585    HA   ASP  71           HA       ASP  71  13.450  -7.189  -1.399
  586    HB2  ASP  71           2HB      ASP  71  15.167  -6.577   0.226
  587    HB3  ASP  71           1HB      ASP  71  14.132  -7.103   1.549
  588    H    ARG  72           H        ARG  72  11.713  -7.239   1.718
  589    HA   ARG  72           HA       ARG  72  10.894  -9.974   1.368
  590    HB2  ARG  72           2HB      ARG  72   9.591  -9.560   3.485
  591    HB3  ARG  72           1HB      ARG  72  11.326  -9.300   3.596
  592    HG2  ARG  72           2HG      ARG  72  10.964  -6.877   3.393
  593    HG3  ARG  72           1HG      ARG  72   9.224  -7.156   3.314
  594    HD2  ARG  72           2HD      ARG  72  11.014  -7.900   5.635
  595    HD3  ARG  72           1HD      ARG  72   9.957  -6.490   5.571
  596    HE   ARG  72           HE       ARG  72   8.349  -8.682   5.094
  597   HH11  ARG  72          1HH1      ARG  72  10.364  -7.569   7.666
  598   HH12  ARG  72          2HH1      ARG  72   9.431  -8.378   8.874
  599   HH21  ARG  72          1HH2      ARG  72   7.149  -9.670   6.685
  600   HH22  ARG  72          2HH2      ARG  72   7.653  -9.531   8.335
  601    H    PHE  73           H        PHE  73   9.383  -6.858   0.765
  602    HA   PHE  73           HA       PHE  73   6.776  -8.129   0.342
  603    HB2  PHE  73           2HB      PHE  73   7.677  -5.281   0.627
  604    HB3  PHE  73           1HB      PHE  73   6.122  -5.646  -0.106
  605    HD1  PHE  73           HD2      PHE  73   8.094  -5.800   3.005
  606    HD2  PHE  73           HD1      PHE  73   4.289  -6.478   1.209
  607    HE1  PHE  73           HE2      PHE  73   7.083  -6.030   5.232
  608    HE2  PHE  73           HE1      PHE  73   3.277  -6.702   3.438
  609    HZ   PHE  73           HZ       PHE  73   4.672  -6.478   5.454
  610    H    ASP  74           H        ASP  74   9.426  -7.633  -1.541
  611    HA   ASP  74           HA       ASP  74   8.302  -6.689  -3.963
  612    HB2  ASP  74           2HB      ASP  74  10.765  -6.839  -3.391
  613    HB3  ASP  74           1HB      ASP  74  10.666  -8.569  -3.689
  614    H    GLY  75           H        GLY  75   6.300  -7.796  -4.216
  615    HA2  GLY  75           2HA      GLY  75   5.115  -9.372  -5.500
  616    HA3  GLY  75           1HA      GLY  75   6.538 -10.404  -5.525
  617    H    TYR  76           H        TYR  76   4.737  -8.962  -2.832
  618    HA   TYR  76           HA       TYR  76   4.703 -11.554  -1.476
  619    HB2  TYR  76           2HB      TYR  76   5.436 -10.084   0.087
  620    HB3  TYR  76           1HB      TYR  76   4.664  -8.711  -0.681
  621    HD1  TYR  76           HD2      TYR  76   3.920 -11.674   1.481
  622    HD2  TYR  76           HD1      TYR  76   2.771  -7.765   0.259
  623    HE1  TYR  76           HE2      TYR  76   2.240 -11.612   3.273
  624    HE2  TYR  76           HE1      TYR  76   1.096  -7.686   2.036
  625    HH   TYR  76           HH       TYR  76  -0.191  -9.236   3.434
  626    H    ILE  77           H        ILE  77   2.964 -12.827  -1.456
  627    HA   ILE  77           HA       ILE  77   0.378 -11.797  -2.364
  628    HB   ILE  77           HB       ILE  77   1.320 -14.629  -1.838
  629   HG12  ILE  77          2HG1      ILE  77   2.305 -13.518  -3.838
  630   HG13  ILE  77          1HG1      ILE  77   1.277 -14.882  -4.264
  631   HG21  ILE  77          1HG2      ILE  77  -1.059 -14.494  -1.384
  632   HG22  ILE  77          2HG2      ILE  77  -0.796 -15.342  -2.907
  633   HG23  ILE  77          3HG2      ILE  77  -1.337 -13.663  -2.915
  634   HD11  ILE  77          3HD1      ILE  77   0.527 -11.970  -4.428
  635   HD12  ILE  77          1HD1      ILE  77  -0.527 -13.325  -4.835
  636   HD13  ILE  77          2HD1      ILE  77   0.932 -13.030  -5.778
  637    H    PHE  78           H        PHE  78  -1.272 -11.357  -1.039
  638    HA   PHE  78           HA       PHE  78  -1.217 -12.395   1.730
  639    HB2  PHE  78           2HB      PHE  78  -0.922 -10.001   1.726
  640    HB3  PHE  78           1HB      PHE  78  -2.293  -9.782   0.643
  641    HD1  PHE  78           HD1      PHE  78  -1.441 -11.085   4.035
  642    HD2  PHE  78           HD2      PHE  78  -4.382  -9.291   1.530
  643    HE1  PHE  78           HE1      PHE  78  -2.924 -10.801   5.979
  644    HE2  PHE  78           HE2      PHE  78  -5.866  -9.007   3.468
  645    HZ   PHE  78           HZ       PHE  78  -5.139  -9.762   5.696
  646    H    LEU  79           H        LEU  79  -2.902 -13.599   2.412
  647    HA   LEU  79           HA       LEU  79  -5.191 -13.926   0.581
  648    HB2  LEU  79           2HB      LEU  79  -3.971 -15.807   2.600
  649    HB3  LEU  79           1HB      LEU  79  -5.493 -16.128   1.782
  650    HG   LEU  79           HG       LEU  79  -2.889 -15.700   0.304
  651   HD11  LEU  79          1HD1      LEU  79  -2.674 -17.663   1.739
  652   HD12  LEU  79          2HD1      LEU  79  -2.806 -18.135   0.045
  653   HD13  LEU  79          3HD1      LEU  79  -4.199 -18.300   1.117
  654   HD21  LEU  79          3HD2      LEU  79  -4.121 -16.783  -1.532
  655   HD22  LEU  79          1HD2      LEU  79  -4.891 -15.286  -1.012
  656   HD23  LEU  79          2HD2      LEU  79  -5.563 -16.841  -0.519
  657    H    ASP  80           H        ASP  80  -7.182 -13.418   1.208
  658    HA   ASP  80           HA       ASP  80  -7.776 -12.845   4.024
  659    HB2  ASP  80           2HB      ASP  80  -8.472 -11.214   2.278
  660    HB3  ASP  80           1HB      ASP  80  -9.469 -12.455   1.528
  661    H    SER  81           H        SER  81 -10.078 -13.686   4.738
  662    HA   SER  81           HA       SER  81 -10.154 -16.476   4.781
  663    HB2  SER  81           2HB      SER  81 -12.415 -14.509   5.215
  664    HB3  SER  81           1HB      SER  81 -12.517 -16.231   5.583
  665    HG   SER  81           HG       SER  81 -11.245 -14.196   6.939
  666    H    LYS  82           H        LYS  82 -11.390 -14.285   2.381
  667    HA   LYS  82           HA       LYS  82 -13.113 -16.185   1.073
  668    HB2  LYS  82           2HB      LYS  82 -11.961 -13.549   0.129
  669    HB3  LYS  82           1HB      LYS  82 -13.150 -14.485  -0.764
  670    HG2  LYS  82           2HG      LYS  82 -13.570 -13.321   1.988
  671    HG3  LYS  82           1HG      LYS  82 -14.148 -12.616   0.477
  672    HD2  LYS  82           2HD      LYS  82 -15.439 -14.723   0.072
  673    HD3  LYS  82           1HD      LYS  82 -14.966 -15.263   1.685
  674    HE2  LYS  82           2HE      LYS  82 -16.540 -12.760   1.053
  675    HE3  LYS  82           1HE      LYS  82 -17.212 -14.266   1.672
  676    HZ1  LYS  82           3HZ      LYS  82 -15.197 -12.607   3.084
  677    HZ2  LYS  82           1HZ      LYS  82 -15.949 -13.997   3.686
  678    HZ3  LYS  82           2HZ      LYS  82 -16.854 -12.595   3.410
  679    H    GLY  83           H        GLY  83  -9.832 -16.157   1.327
  680    HA2  GLY  83           2HA      GLY  83  -8.172 -17.322   0.249
  681    HA3  GLY  83           1HA      GLY  83  -9.420 -18.056  -0.738
  682    H    LEU  84           H        LEU  84  -9.120 -14.593  -0.708
  683    HA   LEU  84           HA       LEU  84  -8.458 -14.583  -3.531
  684    HB2  LEU  84           2HB      LEU  84  -8.932 -12.291  -1.614
  685    HB3  LEU  84           1HB      LEU  84  -8.762 -12.137  -3.353
  686    HG   LEU  84           HG       LEU  84 -10.996 -13.583  -1.913
  687   HD11  LEU  84          1HD1      LEU  84 -11.133 -11.144  -1.727
  688   HD12  LEU  84          2HD1      LEU  84 -12.417 -11.793  -2.747
  689   HD13  LEU  84          3HD1      LEU  84 -11.021 -11.003  -3.484
  690   HD21  LEU  84          3HD2      LEU  84 -10.576 -13.110  -4.867
  691   HD22  LEU  84          1HD2      LEU  84 -12.008 -13.831  -4.128
  692   HD23  LEU  84          2HD2      LEU  84 -10.455 -14.662  -4.036
  693    H    GLU  85           H        GLU  85  -6.453 -14.438  -4.328
  694    HA   GLU  85           HA       GLU  85  -4.206 -13.937  -2.572
  695    HB2  GLU  85           2HB      GLU  85  -4.292 -14.556  -5.533
  696    HB3  GLU  85           1HB      GLU  85  -2.827 -14.460  -4.564
  697    HG2  GLU  85           2HG      GLU  85  -3.618 -16.344  -3.202
  698    HG3  GLU  85           1HG      GLU  85  -5.065 -16.451  -4.201
  699    H    TYR  86           H        TYR  86  -4.200 -11.778  -2.019
  700    HA   TYR  86           HA       TYR  86  -4.260  -9.706  -4.042
  701    HB2  TYR  86           2HB      TYR  86  -3.652  -9.565  -1.077
  702    HB3  TYR  86           1HB      TYR  86  -3.820  -8.171  -2.135
  703    HD1  TYR  86           HD1      TYR  86  -6.077  -7.792  -3.275
  704    HD2  TYR  86           HD2      TYR  86  -5.547 -10.536  -0.057
  705    HE1  TYR  86           HE1      TYR  86  -8.499  -7.741  -2.840
  706    HE2  TYR  86           HE2      TYR  86  -7.966 -10.493   0.385
  707    HH   TYR  86           HH       TYR  86  -9.886  -8.995  -0.009
  708    HA   PRO  87           HA       PRO  87   0.214 -10.175  -4.452
  709    HB2  PRO  87           2HB      PRO  87   0.397  -9.207  -6.978
  710    HB3  PRO  87           1HB      PRO  87  -0.196 -10.830  -6.610
  711    HG2  PRO  87           2HG      PRO  87  -1.684  -8.461  -7.531
  712    HG3  PRO  87           1HG      PRO  87  -2.126 -10.171  -7.627
  713    HD2  PRO  87           2HD      PRO  87  -3.003  -8.200  -5.708
  714    HD3  PRO  87           1HD      PRO  87  -3.494  -9.900  -5.840
  715    H    ALA  88           H        ALA  88   1.248  -8.740  -3.170
  716    HA   ALA  88           HA       ALA  88   1.115  -5.868  -3.717
  717    HB1  ALA  88           3HB      ALA  88   2.499  -7.356  -1.480
  718    HB2  ALA  88           1HB      ALA  88   0.881  -6.661  -1.398
  719    HB3  ALA  88           2HB      ALA  88   2.281  -5.610  -1.595
  720    H    VAL  89           H        VAL  89   2.416  -5.293  -5.389
  721    HA   VAL  89           HA       VAL  89   5.194  -6.319  -5.426
  722    HB   VAL  89           HB       VAL  89   3.579  -5.113  -7.690
  723   HG11  VAL  89          1HG1      VAL  89   6.363  -6.293  -7.730
  724   HG12  VAL  89          2HG1      VAL  89   5.960  -4.585  -7.911
  725   HG13  VAL  89          3HG1      VAL  89   5.451  -5.743  -9.138
  726   HG21  VAL  89          3HG2      VAL  89   2.824  -7.358  -7.071
  727   HG22  VAL  89          1HG2      VAL  89   4.476  -7.962  -7.211
  728   HG23  VAL  89          2HG2      VAL  89   3.626  -7.375  -8.642
  729    H    VAL  90           H        VAL  90   6.419  -4.904  -4.272
  730    HA   VAL  90           HA       VAL  90   5.985  -2.061  -4.277
  731    HB   VAL  90           HB       VAL  90   8.360  -3.639  -3.245
  732   HG11  VAL  90          1HG1      VAL  90   7.473  -0.821  -2.611
  733   HG12  VAL  90          2HG1      VAL  90   8.882  -1.272  -3.572
  734   HG13  VAL  90          3HG1      VAL  90   8.819  -1.679  -1.856
  735   HG21  VAL  90          3HG2      VAL  90   6.274  -4.353  -2.189
  736   HG22  VAL  90          1HG2      VAL  90   5.893  -2.681  -1.779
  737   HG23  VAL  90          2HG2      VAL  90   7.288  -3.475  -1.045
  738    H    GLU  91           H        GLU  91   6.530  -0.786  -5.984
  739    HA   GLU  91           HA       GLU  91   9.101  -1.318  -7.332
  740    HB2  GLU  91           2HB      GLU  91   8.097  -0.703  -9.506
  741    HB3  GLU  91           1HB      GLU  91   7.413  -2.170  -8.823
  742    HG2  GLU  91           2HG      GLU  91   5.410  -1.045  -8.201
  743    HG3  GLU  91           1HG      GLU  91   6.103   0.532  -8.583
  744    H    PHE  92           H        PHE  92  10.090   0.487  -8.391
  745    HA   PHE  92           HA       PHE  92   9.939   2.828  -6.734
  746    HB2  PHE  92           2HB      PHE  92  12.098   1.940  -7.446
  747    HB3  PHE  92           1HB      PHE  92  11.676   2.194  -9.135
  748    HD1  PHE  92           HD2      PHE  92  11.772   4.207  -5.976
  749    HD2  PHE  92           HD1      PHE  92  12.665   4.016 -10.140
  750    HE1  PHE  92           HE2      PHE  92  12.752   6.456  -5.867
  751    HE2  PHE  92           HE1      PHE  92  13.646   6.271 -10.030
  752    HZ   PHE  92           HZ       PHE  92  13.691   7.495  -7.891
  753    H    ALA  93           H        ALA  93   9.045   4.772  -7.155
  754    HA   ALA  93           HA       ALA  93   7.615   5.185  -9.677
  755    HB1  ALA  93           3HB      ALA  93   6.404   5.610  -7.611
  756    HB2  ALA  93           1HB      ALA  93   6.606   7.114  -8.509
  757    HB3  ALA  93           2HB      ALA  93   7.624   6.779  -7.106
  758    HA   PRO  94           HA       PRO  94  10.572   7.943 -11.492
  759    HB2  PRO  94           2HB      PRO  94   9.029   9.883 -12.633
  760    HB3  PRO  94           1HB      PRO  94   9.143   8.234 -13.263
  761    HG2  PRO  94           2HG      PRO  94   7.039   9.440 -11.491
  762    HG3  PRO  94           1HG      PRO  94   6.837   8.426 -12.935
  763    HD2  PRO  94           2HD      PRO  94   6.634   7.398 -10.458
  764    HD3  PRO  94           1HD      PRO  94   7.360   6.471 -11.789
  765    H    PHE  95           H        PHE  95   9.160   8.804  -8.704
  766    HA   PHE  95           HA       PHE  95   9.511  10.369  -7.119
  767    HB2  PHE  95           2HB      PHE  95  11.881  10.016  -7.574
  768    HB3  PHE  95           1HB      PHE  95  11.827  11.182  -8.892
  769    HD1  PHE  95           HD1      PHE  95  10.964  11.020  -5.256
  770    HD2  PHE  95           HD2      PHE  95  12.653  13.293  -8.438
  771    HE1  PHE  95           HE1      PHE  95  11.531  12.813  -3.670
  772    HE2  PHE  95           HE2      PHE  95  13.221  15.089  -6.856
  773    HZ   PHE  95           HZ       PHE  95  12.660  14.852  -4.469
  774    H    GLN  96           H        GLN  96  10.568  12.434  -9.837
  775    HA   GLN  96           HA       GLN  96   8.126  14.031  -9.595
  776    HB2  GLN  96           2HB      GLN  96  10.887  15.014  -8.911
  777    HB3  GLN  96           1HB      GLN  96   9.672  16.131  -9.519
  778    HG2  GLN  96           2HG      GLN  96   9.309  14.388  -7.086
  779    HG3  GLN  96           1HG      GLN  96   9.851  16.066  -7.045
  780   HE21  GLN  96          1HE2      GLN  96   7.174  13.950  -7.804
  781   HE22  GLN  96          2HE2      GLN  96   5.951  15.168  -7.760
  782    H    LYS  97           H        LYS  97   7.543  15.142 -11.388
  783    HA   LYS  97           HA       LYS  97   8.963  14.532 -13.837
  784    HB2  LYS  97           2HB      LYS  97   6.457  14.415 -13.642
  785    HB3  LYS  97           1HB      LYS  97   6.433  16.166 -13.495
  786    HG2  LYS  97           2HG      LYS  97   5.904  15.478 -15.767
  787    HG3  LYS  97           1HG      LYS  97   7.430  16.367 -15.730
  788    HD2  LYS  97           2HD      LYS  97   8.669  14.254 -15.798
  789    HD3  LYS  97           1HD      LYS  97   7.150  13.355 -15.808
  790    HE2  LYS  97           2HE      LYS  97   6.559  14.378 -17.954
  791    HE3  LYS  97           1HE      LYS  97   8.069  15.289 -17.943
  792    HZ1  LYS  97           3HZ      LYS  97   9.298  13.241 -18.049
  793    HZ2  LYS  97           1HZ      LYS  97   8.176  13.274 -19.313
  794    HZ3  LYS  97           2HZ      LYS  97   7.881  12.325 -17.946
  Start of MODEL    6
    1    H1   MET   1           1H       MET   1  21.990  10.533  17.451
    2    H2   MET   1           2H       MET   1  20.483  11.083  17.984
    3    H3   MET   1           3H       MET   1  21.859  11.342  18.931
    4    HA   MET   1           HA       MET   1  21.229  13.373  17.839
    5    HB2  MET   1           2HB      MET   1  23.725  12.149  16.624
    6    HB3  MET   1           1HB      MET   1  23.377  13.869  16.731
    7    HG2  MET   1           2HG      MET   1  24.952  13.183  18.449
    8    HG3  MET   1           1HG      MET   1  23.440  13.738  19.169
    9    HE1  MET   1           3HE      MET   1  24.584  10.918  21.650
   10    HE2  MET   1           1HE      MET   1  24.127  12.613  21.483
   11    HE3  MET   1           2HE      MET   1  25.637  12.033  20.780
   12    H    GLY   2           H        GLY   2  20.721  14.539  15.948
   13    HA2  GLY   2           2HA      GLY   2  20.061  14.877  13.758
   14    HA3  GLY   2           1HA      GLY   2  20.707  13.296  13.353
   15    H    HIS   3           H        HIS   3  18.184  14.111  15.721
   16    HA   HIS   3           HA       HIS   3  16.351  12.269  14.366
   17    HB2  HIS   3           2HB      HIS   3  16.704  12.004  16.793
   18    HB3  HIS   3           1HB      HIS   3  16.118  13.643  17.059
   19    HD1  HIS   3           HD1      HIS   3  13.601  13.995  17.115
   20    HD2  HIS   3           HD2      HIS   3  14.682  10.119  16.075
   21    HE1  HIS   3           HE1      HIS   3  11.477  12.664  17.183
   22    HE2  HIS   3           HE2      HIS   3  12.185  10.299  16.717
   23    H    HIS   4           H        HIS   4  16.354  15.605  15.633
   24    HA   HIS   4           HA       HIS   4  13.826  16.350  14.608
   25    HB2  HIS   4           2HB      HIS   4  14.887  17.636  16.375
   26    HB3  HIS   4           1HB      HIS   4  16.245  18.032  15.328
   27    HD1  HIS   4           HD1      HIS   4  12.555  18.760  15.726
   28    HD2  HIS   4           HD2      HIS   4  15.900  20.295  13.795
   29    HE1  HIS   4           HE1      HIS   4  11.821  20.948  14.739
   30    HE2  HIS   4           HE2      HIS   4  13.906  21.944  13.753
   31    H    HIS   5           H        HIS   5  17.100  16.657  13.272
   32    HA   HIS   5           HA       HIS   5  16.236  18.044  10.906
   33    HB2  HIS   5           2HB      HIS   5  18.524  18.264  11.955
   34    HB3  HIS   5           1HB      HIS   5  18.885  16.642  11.371
   35    HD1  HIS   5           HD1      HIS   5  19.708  16.448   9.002
   36    HD2  HIS   5           HD2      HIS   5  18.114  20.193   9.842
   37    HE1  HIS   5           HE1      HIS   5  20.219  17.864   6.996
   38    HE2  HIS   5           HE2      HIS   5  19.364  20.152   7.582
   39    H    HIS   6           H        HIS   6  14.712  16.782   9.854
   40    HA   HIS   6           HA       HIS   6  15.091  13.968   9.410
   41    HB2  HIS   6           2HB      HIS   6  12.978  15.931   8.525
   42    HB3  HIS   6           1HB      HIS   6  12.969  14.247   8.005
   43    HD1  HIS   6           HD1      HIS   6  12.772  16.308  11.189
   44    HD2  HIS   6           HD2      HIS   6  11.928  12.479   9.817
   45    HE1  HIS   6           HE1      HIS   6  11.542  15.179  13.059
   46    HE2  HIS   6           HE2      HIS   6  11.158  12.832  12.252
   47    H    HIS   7           H        HIS   7  15.141  12.899   7.366
   48    HA   HIS   7           HA       HIS   7  16.791  14.373   5.402
   49    HB2  HIS   7           2HB      HIS   7  16.732  11.372   5.780
   50    HB3  HIS   7           1HB      HIS   7  17.953  12.343   4.961
   51    HD1  HIS   7           HD1      HIS   7  19.758  13.451   6.419
   52    HD2  HIS   7           HD2      HIS   7  16.929  11.318   8.596
   53    HE1  HIS   7           HE1      HIS   7  20.697  13.255   8.743
   54    HE2  HIS   7           HE2      HIS   7  18.999  11.911  10.026
   55    H    HIS   8           H        HIS   8  16.362  14.161   3.197
   56    HA   HIS   8           HA       HIS   8  13.685  13.338   2.469
   57    HB2  HIS   8           2HB      HIS   8  15.965  14.447   0.808
   58    HB3  HIS   8           1HB      HIS   8  14.359  14.094   0.173
   59    HD1  HIS   8           HD1      HIS   8  12.691  15.941   0.325
   60    HD2  HIS   8           HD2      HIS   8  15.895  16.514   2.906
   61    HE1  HIS   8           HE1      HIS   8  12.349  18.216   1.324
   62    HE2  HIS   8           HE2      HIS   8  14.252  18.511   2.941
   63    H    SER   9           H        SER   9  13.082  11.477   1.484
   64    HA   SER   9           HA       SER   9  15.217   9.536   0.811
   65    HB2  SER   9           2HB      SER   9  13.949   8.875   2.812
   66    HB3  SER   9           1HB      SER   9  12.444   8.960   1.897
   67    HG   SER   9           HG       SER   9  13.607   6.823   2.167
   68    H    HIS  10           H        HIS  10  14.104   7.630  -0.532
   69    HA   HIS  10           HA       HIS  10  13.043   8.916  -2.960
   70    HB2  HIS  10           2HB      HIS  10  15.147   7.672  -3.202
   71    HB3  HIS  10           1HB      HIS  10  14.382   6.223  -2.565
   72    HD1  HIS  10           HD1      HIS  10  14.480   8.402  -5.628
   73    HD2  HIS  10           HD2      HIS  10  12.927   4.748  -4.409
   74    HE1  HIS  10           HE1      HIS  10  13.663   7.290  -7.721
   75    HE2  HIS  10           HE2      HIS  10  13.007   4.982  -6.983
   76    H    MET  11           H        MET  11  10.883   8.793  -3.198
   77    HA   MET  11           HA       MET  11   9.165   7.114  -1.773
   78    HB2  MET  11           2HB      MET  11   8.682   8.485  -4.427
   79    HB3  MET  11           1HB      MET  11   7.426   7.777  -3.422
   80    HG2  MET  11           2HG      MET  11   7.459  10.153  -3.108
   81    HG3  MET  11           1HG      MET  11   8.003   9.363  -1.628
   82    HE1  MET  11           3HE      MET  11   8.923  11.760  -0.818
   83    HE2  MET  11           1HE      MET  11   8.413  12.484  -2.342
   84    HE3  MET  11           2HE      MET  11  10.059  12.725  -1.758
   85    H    VAL  12           H        VAL  12   8.208   5.177  -2.150
   86    HA   VAL  12           HA       VAL  12   8.773   3.750  -4.670
   87    HB   VAL  12           HB       VAL  12   8.816   2.527  -1.892
   88   HG11  VAL  12          1HG1      VAL  12   9.253   1.239  -4.587
   89   HG12  VAL  12          2HG1      VAL  12   7.877   0.976  -3.513
   90   HG13  VAL  12          3HG1      VAL  12   9.490   0.452  -3.027
   91   HG21  VAL  12          3HG2      VAL  12  11.195   2.091  -2.336
   92   HG22  VAL  12          1HG2      VAL  12  10.839   3.818  -2.350
   93   HG23  VAL  12          2HG2      VAL  12  11.066   2.954  -3.870
   94    H    VAL  13           H        VAL  13   6.995   2.843  -5.605
   95    HA   VAL  13           HA       VAL  13   4.438   3.324  -4.231
   96    HB   VAL  13           HB       VAL  13   3.397   3.363  -6.424
   97   HG11  VAL  13          1HG1      VAL  13   4.322   5.446  -5.572
   98   HG12  VAL  13          2HG1      VAL  13   4.483   5.380  -7.327
   99   HG13  VAL  13          3HG1      VAL  13   5.886   5.075  -6.302
  100   HG21  VAL  13          3HG2      VAL  13   6.157   2.795  -7.530
  101   HG22  VAL  13          1HG2      VAL  13   4.734   3.215  -8.487
  102   HG23  VAL  13          2HG2      VAL  13   4.768   1.706  -7.574
  103    H    ILE  14           H        ILE  14   2.606   1.863  -5.175
  104    HA   ILE  14           HA       ILE  14   3.446  -0.965  -5.090
  105    HB   ILE  14           HB       ILE  14   2.648  -0.232  -2.862
  106   HG12  ILE  14          2HG1      ILE  14   0.774  -1.969  -2.633
  107   HG13  ILE  14          1HG1      ILE  14   0.957  -2.235  -4.364
  108   HG21  ILE  14          1HG2      ILE  14   0.025   0.330  -4.239
  109   HG22  ILE  14          2HG2      ILE  14   1.116   1.525  -3.538
  110   HG23  ILE  14          3HG2      ILE  14   0.303   0.358  -2.496
  111   HD11  ILE  14          3HD1      ILE  14   3.098  -2.604  -2.281
  112   HD12  ILE  14          1HD1      ILE  14   3.289  -2.871  -4.014
  113   HD13  ILE  14          2HD1      ILE  14   2.186  -3.881  -3.083
  114    H    ARG  15           H        ARG  15   2.307  -2.342  -6.468
  115    HA   ARG  15           HA       ARG  15  -0.026  -1.236  -7.900
  116    HB2  ARG  15           2HB      ARG  15   0.808  -2.168 -10.026
  117    HB3  ARG  15           1HB      ARG  15   1.874  -0.926  -9.384
  118    HG2  ARG  15           2HG      ARG  15   3.544  -2.435  -8.853
  119    HG3  ARG  15           1HG      ARG  15   2.430  -3.803  -8.789
  120    HD2  ARG  15           2HD      ARG  15   3.903  -3.869 -10.769
  121    HD3  ARG  15           1HD      ARG  15   2.195  -3.784 -11.193
  122    HE   ARG  15           HE       ARG  15   3.376  -1.201 -11.112
  123   HH11  ARG  15          1HH1      ARG  15   3.179  -4.039 -13.061
  124   HH12  ARG  15          2HH1      ARG  15   3.457  -3.175 -14.530
  125   HH21  ARG  15          1HH2      ARG  15   3.733  -0.111 -12.983
  126   HH22  ARG  15          2HH2      ARG  15   3.770  -0.960 -14.491
  127    H    ARG  16           H        ARG  16  -0.915  -3.096  -9.437
  128    HA   ARG  16           HA       ARG  16  -1.904  -5.116  -9.709
  129    HB2  ARG  16           2HB      ARG  16   0.469  -5.805  -8.159
  130    HB3  ARG  16           1HB      ARG  16  -0.867  -6.891  -7.820
  131    HG2  ARG  16           2HG      ARG  16   0.540  -7.778  -9.580
  132    HG3  ARG  16           1HG      ARG  16  -1.062  -7.402 -10.206
  133    HD2  ARG  16           2HD      ARG  16  -0.236  -5.365 -11.213
  134    HD3  ARG  16           1HD      ARG  16   1.351  -5.610 -10.486
  135    HE   ARG  16           HE       ARG  16   1.210  -7.806 -11.902
  136   HH11  ARG  16          1HH1      ARG  16   0.107  -4.678 -12.845
  137   HH12  ARG  16          2HH1      ARG  16   0.485  -4.933 -14.515
  138   HH21  ARG  16          1HH2      ARG  16   1.644  -8.132 -14.058
  139   HH22  ARG  16          2HH2      ARG  16   1.333  -6.862 -15.192
  140    H    LEU  17           H        LEU  17  -2.586  -3.128  -7.430
  141    HA   LEU  17           HA       LEU  17  -3.845  -4.652  -5.381
  142    HB2  LEU  17           2HB      LEU  17  -4.113  -1.789  -6.272
  143    HB3  LEU  17           1HB      LEU  17  -5.117  -2.445  -4.997
  144    HG   LEU  17           HG       LEU  17  -3.297  -1.244  -4.002
  145   HD11  LEU  17          1HD1      LEU  17  -2.298  -2.965  -2.603
  146   HD12  LEU  17          2HD1      LEU  17  -2.799  -4.209  -3.750
  147   HD13  LEU  17          3HD1      LEU  17  -4.013  -3.282  -2.866
  148   HD21  LEU  17          3HD2      LEU  17  -1.722  -1.310  -5.864
  149   HD22  LEU  17          1HD2      LEU  17  -1.429  -3.025  -5.565
  150   HD23  LEU  17          2HD2      LEU  17  -0.962  -1.823  -4.358
  151    HA   PRO  18           HA       PRO  18  -7.657  -5.375  -7.738
  152    HB2  PRO  18           2HB      PRO  18  -8.192  -7.807  -6.648
  153    HB3  PRO  18           1HB      PRO  18  -7.020  -7.572  -7.945
  154    HG2  PRO  18           2HG      PRO  18  -6.547  -8.275  -5.152
  155    HG3  PRO  18           1HG      PRO  18  -5.429  -8.339  -6.522
  156    HD2  PRO  18           2HD      PRO  18  -5.712  -6.275  -4.459
  157    HD3  PRO  18           1HD      PRO  18  -4.403  -6.512  -5.635
  158    HA   PRO  19           HA       PRO  19 -10.531  -4.028  -4.568
  159    HB2  PRO  19           2HB      PRO  19 -12.737  -4.803  -6.335
  160    HB3  PRO  19           1HB      PRO  19 -12.219  -3.188  -5.838
  161    HG2  PRO  19           2HG      PRO  19 -11.902  -4.101  -8.369
  162    HG3  PRO  19           1HG      PRO  19 -10.772  -2.958  -7.616
  163    HD2  PRO  19           2HD      PRO  19 -10.503  -5.932  -7.979
  164    HD3  PRO  19           1HD      PRO  19  -9.292  -4.655  -8.223
  165    H    GLY  20           H        GLY  20 -10.344  -5.579  -2.928
  166    HA2  GLY  20           2HA      GLY  20 -12.616  -7.344  -2.673
  167    HA3  GLY  20           1HA      GLY  20 -11.100  -8.207  -2.864
  168    H    LEU  21           H        LEU  21 -11.039  -5.177  -1.167
  169    HA   LEU  21           HA       LEU  21 -11.472  -6.160   1.443
  170    HB2  LEU  21           2HB      LEU  21  -9.268  -6.346   2.330
  171    HB3  LEU  21           1HB      LEU  21  -9.365  -7.388   0.927
  172    HG   LEU  21           HG       LEU  21  -8.037  -4.664   0.978
  173   HD11  LEU  21          1HD1      LEU  21  -6.842  -6.299   2.348
  174   HD12  LEU  21          2HD1      LEU  21  -5.934  -5.892   0.892
  175   HD13  LEU  21          3HD1      LEU  21  -6.806  -7.422   0.987
  176   HD21  LEU  21          3HD2      LEU  21  -7.136  -5.282  -1.204
  177   HD22  LEU  21          1HD2      LEU  21  -8.898  -5.270  -1.243
  178   HD23  LEU  21          2HD2      LEU  21  -8.029  -6.803  -1.162
  179    H    THR  22           H        THR  22 -11.058  -4.590   3.105
  180    HA   THR  22           HA       THR  22 -11.399  -1.884   2.103
  181    HB   THR  22           HB       THR  22 -11.496  -2.895   4.964
  182    HG1  THR  22           HG1      THR  22 -13.904  -2.290   4.171
  183   HG21  THR  22          3HG2      THR  22 -12.472  -0.302   3.741
  184   HG22  THR  22          1HG2      THR  22 -11.109  -0.482   4.847
  185   HG23  THR  22          2HG2      THR  22 -12.748  -0.813   5.406
  186    H    LYS  23           H        LYS  23 -10.108  -0.101   2.720
  187    HA   LYS  23           HA       LYS  23  -7.423  -0.267   2.570
  188    HB2  LYS  23           2HB      LYS  23  -7.282   1.957   3.626
  189    HB3  LYS  23           1HB      LYS  23  -8.570   1.855   2.434
  190    HG2  LYS  23           2HG      LYS  23 -10.252   1.834   4.092
  191    HG3  LYS  23           1HG      LYS  23  -9.089   1.507   5.379
  192    HD2  LYS  23           2HD      LYS  23  -9.195   4.048   3.744
  193    HD3  LYS  23           1HD      LYS  23  -9.877   3.860   5.362
  194    HE2  LYS  23           2HE      LYS  23  -7.646   3.356   6.248
  195    HE3  LYS  23           1HE      LYS  23  -6.964   3.515   4.632
  196    HZ1  LYS  23           3HZ      LYS  23  -6.641   5.502   5.970
  197    HZ2  LYS  23           1HZ      LYS  23  -8.315   5.690   6.126
  198    HZ3  LYS  23           2HZ      LYS  23  -7.588   5.824   4.609
  199    H    GLU  24           H        GLU  24  -9.258  -0.552   5.601
  200    HA   GLU  24           HA       GLU  24  -7.126  -0.399   7.398
  201    HB2  GLU  24           2HB      GLU  24  -9.677  -2.013   7.638
  202    HB3  GLU  24           1HB      GLU  24  -8.591  -1.623   8.971
  203    HG2  GLU  24           2HG      GLU  24  -9.013   0.775   8.581
  204    HG3  GLU  24           1HG      GLU  24 -10.144   0.349   7.297
  205    H    GLN  25           H        GLN  25  -8.471  -3.300   5.794
  206    HA   GLN  25           HA       GLN  25  -6.380  -4.997   6.916
  207    HB2  GLN  25           2HB      GLN  25  -8.422  -5.758   4.814
  208    HB3  GLN  25           1HB      GLN  25  -7.497  -6.839   5.849
  209    HG2  GLN  25           2HG      GLN  25  -8.701  -5.891   7.812
  210    HG3  GLN  25           1HG      GLN  25  -9.699  -4.962   6.695
  211   HE21  GLN  25          1HE2      GLN  25  -9.679  -7.224   4.742
  212   HE22  GLN  25          2HE2      GLN  25 -10.789  -8.379   5.381
  213    H    LEU  26           H        LEU  26  -6.622  -2.900   4.386
  214    HA   LEU  26           HA       LEU  26  -4.935  -4.380   2.514
  215    HB2  LEU  26           2HB      LEU  26  -6.730  -3.382   1.426
  216    HB3  LEU  26           1HB      LEU  26  -6.644  -1.922   2.384
  217    HG   LEU  26           HG       LEU  26  -4.527  -1.337   1.154
  218   HD11  LEU  26          1HD1      LEU  26  -5.330  -3.681  -0.568
  219   HD12  LEU  26          2HD1      LEU  26  -3.874  -3.550   0.419
  220   HD13  LEU  26          3HD1      LEU  26  -4.092  -2.491  -0.974
  221   HD21  LEU  26          3HD2      LEU  26  -5.687  -0.642  -0.905
  222   HD22  LEU  26          1HD2      LEU  26  -6.627  -0.306   0.549
  223   HD23  LEU  26          2HD2      LEU  26  -7.044  -1.683  -0.472
  224    H    GLU  27           H        GLU  27  -4.775  -1.591   4.666
  225    HA   GLU  27           HA       GLU  27  -2.277  -0.660   3.519
  226    HB2  GLU  27           2HB      GLU  27  -2.465   1.208   5.033
  227    HB3  GLU  27           1HB      GLU  27  -4.020   0.934   4.262
  228    HG2  GLU  27           2HG      GLU  27  -4.697  -0.335   6.332
  229    HG3  GLU  27           1HG      GLU  27  -3.216   0.253   7.080
  230    H    GLU  28           H        GLU  28  -3.286  -2.637   6.183
  231    HA   GLU  28           HA       GLU  28  -1.152  -2.352   7.957
  232    HB2  GLU  28           2HB      GLU  28  -1.705  -4.617   8.747
  233    HB3  GLU  28           1HB      GLU  28  -3.147  -3.642   8.513
  234    HG2  GLU  28           2HG      GLU  28  -3.645  -4.781   6.441
  235    HG3  GLU  28           1HG      GLU  28  -2.135  -5.686   6.537
  236    H    GLN  29           H        GLN  29  -1.275  -3.965   4.882
  237    HA   GLN  29           HA       GLN  29   1.369  -5.177   5.270
  238    HB2  GLN  29           2HB      GLN  29   0.901  -6.225   3.031
  239    HB3  GLN  29           1HB      GLN  29  -0.230  -6.663   4.306
  240    HG2  GLN  29           2HG      GLN  29  -1.742  -4.841   3.399
  241    HG3  GLN  29           1HG      GLN  29  -0.666  -4.779   2.006
  242   HE21  GLN  29          1HE2      GLN  29  -3.500  -5.590   2.330
  243   HE22  GLN  29          2HE2      GLN  29  -3.597  -7.166   1.646
  244    H    LEU  30           H        LEU  30   0.127  -2.285   4.192
  245    HA   LEU  30           HA       LEU  30   2.336  -1.823   2.300
  246    HB2  LEU  30           2HB      LEU  30  -0.199  -0.228   2.714
  247    HB3  LEU  30           1HB      LEU  30   1.039   0.111   1.516
  248    HG   LEU  30           HG       LEU  30  -0.741  -2.335   1.602
  249   HD11  LEU  30          1HD1      LEU  30  -1.681  -1.456  -0.477
  250   HD12  LEU  30          2HD1      LEU  30  -0.657  -0.024  -0.343
  251   HD13  LEU  30          3HD1      LEU  30  -1.912  -0.330   0.861
  252   HD21  LEU  30          3HD2      LEU  30   0.291  -2.917  -0.562
  253   HD22  LEU  30          1HD2      LEU  30   1.445  -2.958   0.770
  254   HD23  LEU  30          2HD2      LEU  30   1.442  -1.597  -0.353
  255    H    ARG  31           H        ARG  31   1.257  -1.025   5.474
  256    HA   ARG  31           HA       ARG  31   3.496   0.873   5.677
  257    HB2  ARG  31           2HB      ARG  31   2.220   2.362   7.118
  258    HB3  ARG  31           1HB      ARG  31   1.434   2.187   5.556
  259    HG2  ARG  31           2HG      ARG  31  -0.241   0.737   6.491
  260    HG3  ARG  31           1HG      ARG  31   0.604   0.682   8.039
  261    HD2  ARG  31           2HD      ARG  31   0.259   3.135   8.253
  262    HD3  ARG  31           1HD      ARG  31  -0.687   3.098   6.766
  263    HE   ARG  31           HE       ARG  31  -2.209   1.543   8.017
  264   HH11  ARG  31          1HH1      ARG  31  -0.245   3.826   9.684
  265   HH12  ARG  31          2HH1      ARG  31  -1.341   3.957  11.013
  266   HH21  ARG  31          1HH2      ARG  31  -3.599   1.703   9.724
  267   HH22  ARG  31          2HH2      ARG  31  -3.240   2.781  11.027
  268    HA   PRO  32           HA       PRO  32   3.476  -1.907   9.529
  269    HB2  PRO  32           2HB      PRO  32   4.552  -4.248   8.855
  270    HB3  PRO  32           1HB      PRO  32   2.829  -3.945   8.591
  271    HG2  PRO  32           2HG      PRO  32   5.090  -3.839   6.619
  272    HG3  PRO  32           1HG      PRO  32   3.479  -4.556   6.431
  273    HD2  PRO  32           2HD      PRO  32   4.188  -2.047   5.507
  274    HD3  PRO  32           1HD      PRO  32   2.525  -2.550   5.867
  275    H    LEU  33           H        LEU  33   5.397  -0.216   7.753
  276    HA   LEU  33           HA       LEU  33   8.008  -1.337   8.280
  277    HB2  LEU  33           2HB      LEU  33   7.198   1.302   7.045
  278    HB3  LEU  33           1HB      LEU  33   8.842   0.710   7.149
  279    HG   LEU  33           HG       LEU  33   8.056  -1.295   5.771
  280   HD11  LEU  33          1HD1      LEU  33   6.112  -0.969   4.350
  281   HD12  LEU  33          2HD1      LEU  33   5.734   0.537   5.189
  282   HD13  LEU  33          3HD1      LEU  33   5.652  -0.998   6.053
  283   HD21  LEU  33          3HD2      LEU  33   8.035   1.436   4.491
  284   HD22  LEU  33          1HD2      LEU  33   8.306  -0.099   3.663
  285   HD23  LEU  33          2HD2      LEU  33   9.465   0.471   4.863
  286    HA   PRO  34           HA       PRO  34   8.972   0.455  12.121
  287    HB2  PRO  34           2HB      PRO  34  11.512   1.468  11.792
  288    HB3  PRO  34           1HB      PRO  34  11.135  -0.248  11.987
  289    HG2  PRO  34           2HG      PRO  34  11.641   1.303   9.472
  290    HG3  PRO  34           1HG      PRO  34  12.239  -0.304   9.935
  291    HD2  PRO  34           2HD      PRO  34  10.174  -0.017   8.242
  292    HD3  PRO  34           1HD      PRO  34  10.214  -1.337   9.430
  293    H    ALA  35           H        ALA  35  10.072   2.808   9.593
  294    HA   ALA  35           HA       ALA  35   8.727   4.928  11.088
  295    HB1  ALA  35           3HB      ALA  35  10.945   4.747  12.138
  296    HB2  ALA  35           1HB      ALA  35  10.684   6.309  11.365
  297    HB3  ALA  35           2HB      ALA  35  11.694   5.094  10.581
  298    H    HIS  36           H        HIS  36   7.425   5.251   9.299
  299    HA   HIS  36           HA       HIS  36   8.448   7.192   7.464
  300    HB2  HIS  36           2HB      HIS  36   8.106   6.089   5.390
  301    HB3  HIS  36           1HB      HIS  36   9.047   4.973   6.369
  302    HD1  HIS  36           HD1      HIS  36   6.410   3.937   7.967
  303    HD2  HIS  36           HD2      HIS  36   6.997   4.058   3.855
  304    HE1  HIS  36           HE1      HIS  36   4.802   2.274   7.012
  305    HE2  HIS  36           HE2      HIS  36   5.323   2.219   4.554
  306    H    ASP  37           H        ASP  37   6.455   7.397   5.633
  307    HA   ASP  37           HA       ASP  37   3.981   7.541   7.243
  308    HB2  ASP  37           2HB      ASP  37   5.081   9.751   6.832
  309    HB3  ASP  37           1HB      ASP  37   4.890   9.489   5.102
  310    H    TYR  38           H        TYR  38   2.040   7.982   5.517
  311    HA   TYR  38           HA       TYR  38   2.337   6.145   3.249
  312    HB2  TYR  38           2HB      TYR  38   0.284   4.914   3.909
  313    HB3  TYR  38           1HB      TYR  38   1.601   4.705   5.059
  314    HD1  TYR  38           HD2      TYR  38   1.510   5.819   7.269
  315    HD2  TYR  38           HD1      TYR  38  -1.759   6.020   4.549
  316    HE1  TYR  38           HE2      TYR  38   0.043   6.561   9.092
  317    HE2  TYR  38           HE1      TYR  38  -3.233   6.765   6.369
  318    HH   TYR  38           HH       TYR  38  -2.085   7.880   9.308
  319    H    PHE  39           H        PHE  39   0.368   6.157   1.820
  320    HA   PHE  39           HA       PHE  39  -0.775   8.869   1.729
  321    HB2  PHE  39           2HB      PHE  39   0.069   6.923  -0.343
  322    HB3  PHE  39           1HB      PHE  39  -1.375   7.856  -0.712
  323    HD1  PHE  39           HD1      PHE  39  -1.280  10.283  -0.875
  324    HD2  PHE  39           HD2      PHE  39   2.246   7.963  -0.297
  325    HE1  PHE  39           HE1      PHE  39   0.083  12.200  -1.559
  326    HE2  PHE  39           HE2      PHE  39   3.623   9.887  -0.983
  327    HZ   PHE  39           HZ       PHE  39   2.546  12.009  -1.616
  328    H    GLU  40           H        GLU  40  -2.929   8.857   0.420
  329    HA   GLU  40           HA       GLU  40  -4.919   7.656   1.998
  330    HB2  GLU  40           2HB      GLU  40  -6.468   8.466   0.167
  331    HB3  GLU  40           1HB      GLU  40  -5.431   9.694   0.883
  332    HG2  GLU  40           2HG      GLU  40  -3.917   9.543  -1.034
  333    HG3  GLU  40           1HG      GLU  40  -4.948   8.311  -1.755
  334    H    PHE  41           H        PHE  41  -5.450   5.573   2.065
  335    HA   PHE  41           HA       PHE  41  -5.048   3.883  -0.299
  336    HB2  PHE  41           2HB      PHE  41  -5.672   3.118   2.567
  337    HB3  PHE  41           1HB      PHE  41  -5.400   1.980   1.251
  338    HD1  PHE  41           HD1      PHE  41  -3.127   2.181   0.005
  339    HD2  PHE  41           HD2      PHE  41  -3.878   3.813   3.871
  340    HE1  PHE  41           HE1      PHE  41  -0.706   2.246   0.447
  341    HE2  PHE  41           HE2      PHE  41  -1.463   3.877   4.315
  342    HZ   PHE  41           HZ       PHE  41   0.126   3.096   2.605
  343    H    PHE  42           H        PHE  42  -6.653   2.956  -1.422
  344    HA   PHE  42           HA       PHE  42  -9.295   3.969  -1.207
  345    HB2  PHE  42           2HB      PHE  42  -9.807   2.453  -3.079
  346    HB3  PHE  42           1HB      PHE  42  -8.314   3.337  -3.359
  347    HD1  PHE  42           HD2      PHE  42  -6.151   2.184  -3.325
  348    HD2  PHE  42           HD1      PHE  42  -9.798   0.058  -2.746
  349    HE1  PHE  42           HE2      PHE  42  -4.977   0.067  -3.738
  350    HE2  PHE  42           HE1      PHE  42  -8.624  -2.064  -3.157
  351    HZ   PHE  42           HZ       PHE  42  -6.212  -2.063  -3.655
  352    H    ALA  43           H        ALA  43 -11.218   2.973  -0.609
  353    HA   ALA  43           HA       ALA  43 -10.982   0.503   0.986
  354    HB1  ALA  43           3HB      ALA  43 -11.909   2.452   2.168
  355    HB2  ALA  43           1HB      ALA  43 -13.084   1.144   2.039
  356    HB3  ALA  43           2HB      ALA  43 -13.209   2.550   0.980
  357    H    ALA  44           H        ALA  44 -11.060  -1.015  -0.690
  358    HA   ALA  44           HA       ALA  44 -13.308  -0.907  -2.573
  359    HB1  ALA  44           3HB      ALA  44 -11.041  -1.241  -3.462
  360    HB2  ALA  44           1HB      ALA  44 -12.112  -2.592  -3.841
  361    HB3  ALA  44           2HB      ALA  44 -10.917  -2.748  -2.550
  362    H    ASP  45           H        ASP  45 -15.125  -1.802  -1.807
  363    HA   ASP  45           HA       ASP  45 -15.433  -3.668   0.202
  364    HB2  ASP  45           2HB      ASP  45 -17.257  -2.302  -0.774
  365    HB3  ASP  45           1HB      ASP  45 -17.224  -3.310  -2.219
  366    H    LEU  46           H        LEU  46 -15.532  -5.891   0.339
  367    HA   LEU  46           HA       LEU  46 -13.911  -7.372  -1.419
  368    HB2  LEU  46           2HB      LEU  46 -14.370  -9.285  -0.078
  369    HB3  LEU  46           1HB      LEU  46 -14.240  -7.896   0.982
  370    HG   LEU  46           HG       LEU  46 -16.836  -9.205   0.125
  371   HD11  LEU  46          1HD1      LEU  46 -15.376  -9.309   2.766
  372   HD12  LEU  46          2HD1      LEU  46 -15.543 -10.633   1.611
  373   HD13  LEU  46          3HD1      LEU  46 -16.966  -9.997   2.433
  374   HD21  LEU  46          3HD2      LEU  46 -17.881  -7.787   1.825
  375   HD22  LEU  46          1HD2      LEU  46 -17.122  -6.822   0.558
  376   HD23  LEU  46          2HD2      LEU  46 -16.333  -6.998   2.126
  377    H    SER  47           H        SER  47 -17.151  -6.514  -1.795
  378    HA   SER  47           HA       SER  47 -17.461  -8.545  -3.925
  379    HB2  SER  47           2HB      SER  47 -19.156  -8.781  -2.116
  380    HB3  SER  47           1HB      SER  47 -19.680  -7.123  -2.415
  381    HG   SER  47           HG       SER  47 -20.111  -7.862  -4.631
  382    H    LEU  48           H        LEU  48 -16.071  -5.992  -4.112
  383    HA   LEU  48           HA       LEU  48 -17.802  -4.266  -5.693
  384    HB2  LEU  48           2HB      LEU  48 -16.059  -3.343  -4.184
  385    HB3  LEU  48           1HB      LEU  48 -14.825  -4.096  -5.176
  386    HG   LEU  48           HG       LEU  48 -15.484  -2.670  -7.081
  387   HD11  LEU  48          1HD1      LEU  48 -17.830  -2.339  -6.564
  388   HD12  LEU  48          2HD1      LEU  48 -17.018  -0.780  -6.712
  389   HD13  LEU  48          3HD1      LEU  48 -17.407  -1.423  -5.115
  390   HD21  LEU  48          3HD2      LEU  48 -13.701  -1.936  -5.573
  391   HD22  LEU  48          1HD2      LEU  48 -14.888  -1.119  -4.556
  392   HD23  LEU  48          2HD2      LEU  48 -14.606  -0.563  -6.207
  393    H    TYR  49           H        TYR  49 -17.372  -3.726  -7.924
  394    HA   TYR  49           HA       TYR  49 -16.572  -6.073  -9.464
  395    HB2  TYR  49           2HB      TYR  49 -17.766  -3.510 -10.545
  396    HB3  TYR  49           1HB      TYR  49 -17.778  -5.108 -11.287
  397    HD1  TYR  49           HD2      TYR  49 -19.100  -6.967 -10.045
  398    HD2  TYR  49           HD1      TYR  49 -19.579  -2.806  -9.252
  399    HE1  TYR  49           HE2      TYR  49 -21.282  -7.416  -9.001
  400    HE2  TYR  49           HE1      TYR  49 -21.753  -3.250  -8.202
  401    HH   TYR  49           HH       TYR  49 -22.786  -6.361  -7.344
  402    HA   PRO  50           HA       PRO  50 -12.634  -4.445 -10.836
  403    HB2  PRO  50           2HB      PRO  50 -13.286  -5.584 -13.503
  404    HB3  PRO  50           1HB      PRO  50 -11.910  -5.914 -12.444
  405    HG2  PRO  50           2HG      PRO  50 -13.870  -7.702 -12.735
  406    HG3  PRO  50           1HG      PRO  50 -13.108  -7.437 -11.151
  407    HD2  PRO  50           2HD      PRO  50 -15.746  -6.423 -12.183
  408    HD3  PRO  50           1HD      PRO  50 -15.344  -7.089 -10.584
  409    H    HIS  51           H        HIS  51 -11.759  -3.451 -13.117
  410    HA   HIS  51           HA       HIS  51 -11.730  -1.713 -14.563
  411    HB2  HIS  51           2HB      HIS  51 -14.742  -1.819 -14.322
  412    HB3  HIS  51           1HB      HIS  51 -13.887  -0.723 -15.404
  413    HD1  HIS  51           HD1      HIS  51 -13.161  -1.646 -17.630
  414    HD2  HIS  51           HD2      HIS  51 -14.382  -4.618 -14.995
  415    HE1  HIS  51           HE1      HIS  51 -13.250  -3.751 -18.987
  416    HE2  HIS  51           HE2      HIS  51 -14.160  -5.491 -17.417
  417    H    LEU  52           H        LEU  52 -12.886  -1.451 -11.419
  418    HA   LEU  52           HA       LEU  52 -12.781   1.453 -11.348
  419    HB2  LEU  52           2HB      LEU  52 -14.300   0.080  -9.869
  420    HB3  LEU  52           1HB      LEU  52 -12.877  -0.514  -9.042
  421    HG   LEU  52           HG       LEU  52 -14.169   1.338  -7.881
  422   HD11  LEU  52          1HD1      LEU  52 -12.185   2.518  -7.097
  423   HD12  LEU  52          2HD1      LEU  52 -11.254   1.874  -8.447
  424   HD13  LEU  52          3HD1      LEU  52 -11.891   0.784  -7.217
  425   HD21  LEU  52          3HD2      LEU  52 -13.833   3.620  -8.616
  426   HD22  LEU  52          1HD2      LEU  52 -14.621   2.686  -9.887
  427   HD23  LEU  52          2HD2      LEU  52 -12.901   3.066 -10.008
  428    H    TYR  53           H        TYR  53 -10.801   2.335 -11.605
  429    HA   TYR  53           HA       TYR  53  -8.393   0.933 -11.212
  430    HB2  TYR  53           2HB      TYR  53  -7.265   3.137 -11.568
  431    HB3  TYR  53           1HB      TYR  53  -8.412   2.693 -12.824
  432    HD1  TYR  53           HD1      TYR  53 -10.782   3.743 -12.656
  433    HD2  TYR  53           HD2      TYR  53  -7.391   5.252 -10.565
  434    HE1  TYR  53           HE1      TYR  53 -11.893   5.923 -12.437
  435    HE2  TYR  53           HE2      TYR  53  -8.499   7.435 -10.338
  436    HH   TYR  53           HH       TYR  53 -10.254   8.735 -11.459
  437    H    SER  54           H        SER  54  -8.492   0.101  -9.127
  438    HA   SER  54           HA       SER  54  -8.477   1.787  -6.802
  439    HB2  SER  54           2HB      SER  54  -7.919  -0.363  -5.613
  440    HB3  SER  54           1HB      SER  54  -9.388  -0.434  -6.587
  441    HG   SER  54           HG       SER  54  -6.833  -1.518  -7.167
  442    H    ARG  55           H        ARG  55  -6.774   3.205  -6.876
  443    HA   ARG  55           HA       ARG  55  -4.049   2.120  -7.187
  444    HB2  ARG  55           2HB      ARG  55  -4.764   3.857  -8.803
  445    HB3  ARG  55           1HB      ARG  55  -5.054   4.967  -7.471
  446    HG2  ARG  55           2HG      ARG  55  -2.965   5.528  -8.470
  447    HG3  ARG  55           1HG      ARG  55  -2.639   4.812  -6.894
  448    HD2  ARG  55           2HD      ARG  55  -1.072   3.957  -8.526
  449    HD3  ARG  55           1HD      ARG  55  -2.146   2.662  -7.998
  450    HE   ARG  55           HE       ARG  55  -3.399   3.136 -10.141
  451   HH11  ARG  55          1HH1      ARG  55  -0.044   3.852  -9.840
  452   HH12  ARG  55          2HH1      ARG  55   0.284   3.576 -11.513
  453   HH21  ARG  55          1HH2      ARG  55  -2.975   2.799 -12.294
  454   HH22  ARG  55          2HH2      ARG  55  -1.363   2.999 -12.889
  455    H    ALA  56           H        ALA  56  -2.461   2.517  -5.663
  456    HA   ALA  56           HA       ALA  56  -3.078   4.171  -3.322
  457    HB1  ALA  56           3HB      ALA  56  -2.163   1.299  -3.084
  458    HB2  ALA  56           1HB      ALA  56  -3.790   1.886  -2.736
  459    HB3  ALA  56           2HB      ALA  56  -2.429   2.427  -1.753
  460    H    TYR  57           H        TYR  57  -1.158   4.714  -2.040
  461    HA   TYR  57           HA       TYR  57   1.430   4.199  -3.325
  462    HB2  TYR  57           2HB      TYR  57   0.375   6.976  -2.725
  463    HB3  TYR  57           1HB      TYR  57   2.034   6.615  -3.186
  464    HD1  TYR  57           HD2      TYR  57   2.411   5.504  -5.471
  465    HD2  TYR  57           HD1      TYR  57  -1.255   7.369  -4.377
  466    HE1  TYR  57           HE2      TYR  57   1.807   5.694  -7.845
  467    HE2  TYR  57           HE1      TYR  57  -1.870   7.562  -6.749
  468    HH   TYR  57           HH       TYR  57  -0.735   7.629  -8.954
  469    H    ILE  58           H        ILE  58   3.290   4.820  -1.985
  470    HA   ILE  58           HA       ILE  58   2.682   4.919   0.911
  471    HB   ILE  58           HB       ILE  58   4.987   3.407  -0.355
  472   HG12  ILE  58          2HG1      ILE  58   2.447   2.294   0.884
  473   HG13  ILE  58          1HG1      ILE  58   2.780   2.353  -0.844
  474   HG21  ILE  58          1HG2      ILE  58   5.492   4.221   1.881
  475   HG22  ILE  58          2HG2      ILE  58   5.287   2.469   1.909
  476   HG23  ILE  58          3HG2      ILE  58   3.997   3.517   2.501
  477   HD11  ILE  58          3HD1      ILE  58   4.700   0.864  -0.508
  478   HD12  ILE  58          1HD1      ILE  58   3.186   0.138   0.032
  479   HD13  ILE  58          2HD1      ILE  58   4.323   0.785   1.214
  480    H    ASN  59           H        ASN  59   3.886   6.362   2.131
  481    HA   ASN  59           HA       ASN  59   5.683   8.125   0.604
  482    HB2  ASN  59           2HB      ASN  59   3.725   9.210   1.608
  483    HB3  ASN  59           1HB      ASN  59   4.213   8.644   3.202
  484   HD21  ASN  59          1HD2      ASN  59   4.284  10.795   3.936
  485   HD22  ASN  59          2HD2      ASN  59   5.590  11.846   3.514
  486    H    PHE  60           H        PHE  60   7.610   6.993   0.767
  487    HA   PHE  60           HA       PHE  60   8.661   6.052   3.263
  488    HB2  PHE  60           2HB      PHE  60   9.770   6.314   0.477
  489    HB3  PHE  60           1HB      PHE  60  10.825   5.886   1.821
  490    HD1  PHE  60           HD2      PHE  60   7.894   4.803  -0.154
  491    HD2  PHE  60           HD1      PHE  60  10.764   3.739   2.806
  492    HE1  PHE  60           HE2      PHE  60   7.199   2.449  -0.322
  493    HE2  PHE  60           HE1      PHE  60  10.076   1.400   2.646
  494    HZ   PHE  60           HZ       PHE  60   8.288   0.741   1.076
  495    H    ARG  61           H        ARG  61   9.882   7.064   4.729
  496    HA   ARG  61           HA       ARG  61  10.877   9.785   4.126
  497    HB2  ARG  61           2HB      ARG  61   9.893   8.635   6.749
  498    HB3  ARG  61           1HB      ARG  61  10.627  10.221   6.577
  499    HG2  ARG  61           2HG      ARG  61   8.074   9.357   5.212
  500    HG3  ARG  61           1HG      ARG  61   8.152  10.264   6.721
  501    HD2  ARG  61           2HD      ARG  61   7.759  11.845   4.990
  502    HD3  ARG  61           1HD      ARG  61   9.447  12.032   5.467
  503    HE   ARG  61           HE       ARG  61   9.037  10.258   3.239
  504   HH11  ARG  61          1HH1      ARG  61   9.548  13.527   4.174
  505   HH12  ARG  61          2HH1      ARG  61  10.199  13.975   2.636
  506   HH21  ARG  61          1HH2      ARG  61   9.895  10.831   1.300
  507   HH22  ARG  61          2HH2      ARG  61  10.406  12.461   1.028
  508    H    ASN  62           H        ASN  62  12.030   6.764   4.391
  509    HA   ASN  62           HA       ASN  62  14.616   7.643   5.425
  510    HB2  ASN  62           2HB      ASN  62  13.343   6.789   7.386
  511    HB3  ASN  62           1HB      ASN  62  13.158   5.247   6.571
  512   HD21  ASN  62          1HD2      ASN  62  14.240   4.150   8.206
  513   HD22  ASN  62          2HD2      ASN  62  15.952   4.270   8.405
  514    HA   PRO  63           HA       PRO  63  15.928   5.085   1.927
  515    HB2  PRO  63           2HB      PRO  63  18.573   4.849   2.780
  516    HB3  PRO  63           1HB      PRO  63  17.932   6.157   1.783
  517    HG2  PRO  63           2HG      PRO  63  18.402   6.080   4.739
  518    HG3  PRO  63           1HG      PRO  63  18.681   7.406   3.591
  519    HD2  PRO  63           2HD      PRO  63  16.549   7.411   5.209
  520    HD3  PRO  63           1HD      PRO  63  16.423   7.996   3.535
  521    H    ASP  64           H        ASP  64  17.103   4.231   5.208
  522    HA   ASP  64           HA       ASP  64  17.557   1.507   4.792
  523    HB2  ASP  64           2HB      ASP  64  16.512   2.831   7.310
  524    HB3  ASP  64           1HB      ASP  64  17.315   1.265   7.221
  525    H    ASP  65           H        ASP  65  14.631   3.163   5.866
  526    HA   ASP  65           HA       ASP  65  12.885   1.063   6.299
  527    HB2  ASP  65           2HB      ASP  65  12.576   3.513   6.784
  528    HB3  ASP  65           1HB      ASP  65  12.223   3.762   5.083
  529    H    ILE  66           H        ILE  66  13.860   2.538   3.248
  530    HA   ILE  66           HA       ILE  66  11.894   1.451   1.545
  531    HB   ILE  66           HB       ILE  66  14.751   2.205   0.888
  532   HG12  ILE  66          2HG1      ILE  66  12.193   3.800   0.588
  533   HG13  ILE  66          1HG1      ILE  66  13.403   4.052   1.842
  534   HG21  ILE  66          1HG2      ILE  66  13.956   2.417  -1.441
  535   HG22  ILE  66          2HG2      ILE  66  12.398   1.748  -0.953
  536   HG23  ILE  66          3HG2      ILE  66  13.855   0.761  -0.842
  537   HD11  ILE  66          3HD1      ILE  66  13.621   5.681   0.054
  538   HD12  ILE  66          1HD1      ILE  66  13.842   4.381  -1.116
  539   HD13  ILE  66          2HD1      ILE  66  15.044   4.645   0.146
  540    H    LEU  67           H        LEU  67  15.320   0.410   1.571
  541    HA   LEU  67           HA       LEU  67  14.775  -1.932   0.093
  542    HB2  LEU  67           2HB      LEU  67  17.134  -2.589   0.721
  543    HB3  LEU  67           1HB      LEU  67  16.938  -1.063  -0.115
  544    HG   LEU  67           HG       LEU  67  17.102   0.064   2.169
  545   HD11  LEU  67          1HD1      LEU  67  16.683  -1.837   3.611
  546   HD12  LEU  67          2HD1      LEU  67  18.292  -1.187   3.924
  547   HD13  LEU  67          3HD1      LEU  67  18.107  -2.666   2.979
  548   HD21  LEU  67          3HD2      LEU  67  18.905   0.102   0.533
  549   HD22  LEU  67          1HD2      LEU  67  19.494  -1.453   1.125
  550   HD23  LEU  67          2HD2      LEU  67  19.544  -0.033   2.170
  551    H    LEU  68           H        LEU  68  14.633  -1.327   3.476
  552    HA   LEU  68           HA       LEU  68  15.017  -3.893   4.517
  553    HB2  LEU  68           2HB      LEU  68  14.935  -1.916   5.908
  554    HB3  LEU  68           1HB      LEU  68  13.266  -1.624   5.462
  555    HG   LEU  68           HG       LEU  68  12.576  -3.658   6.652
  556   HD11  LEU  68          1HD1      LEU  68  15.487  -3.885   7.421
  557   HD12  LEU  68          2HD1      LEU  68  14.591  -4.992   6.381
  558   HD13  LEU  68          3HD1      LEU  68  14.170  -4.852   8.088
  559   HD21  LEU  68          3HD2      LEU  68  14.250  -1.785   8.332
  560   HD22  LEU  68          1HD2      LEU  68  12.982  -2.855   8.929
  561   HD23  LEU  68          2HD2      LEU  68  12.574  -1.531   7.842
  562    H    PHE  69           H        PHE  69  11.931  -2.322   3.581
  563    HA   PHE  69           HA       PHE  69  10.587  -4.888   3.990
  564    HB2  PHE  69           2HB      PHE  69   9.706  -2.063   3.993
  565    HB3  PHE  69           1HB      PHE  69   8.533  -3.248   3.422
  566    HD1  PHE  69           HD1      PHE  69  10.850  -2.566   6.266
  567    HD2  PHE  69           HD2      PHE  69   7.276  -4.457   4.938
  568    HE1  PHE  69           HE1      PHE  69  10.326  -3.208   8.585
  569    HE2  PHE  69           HE2      PHE  69   6.749  -5.100   7.247
  570    HZ   PHE  69           HZ       PHE  69   8.273  -4.477   9.076
  571    H    ARG  70           H        ARG  70  11.212  -2.641   1.289
  572    HA   ARG  70           HA       ARG  70   9.411  -3.792  -0.526
  573    HB2  ARG  70           2HB      ARG  70  10.704  -2.782  -2.305
  574    HB3  ARG  70           1HB      ARG  70  10.617  -1.677  -0.948
  575    HG2  ARG  70           2HG      ARG  70  12.810  -1.444  -1.566
  576    HG3  ARG  70           1HG      ARG  70  12.944  -2.687  -0.320
  577    HD2  ARG  70           2HD      ARG  70  12.981  -4.421  -2.074
  578    HD3  ARG  70           1HD      ARG  70  12.867  -3.165  -3.309
  579    HE   ARG  70           HE       ARG  70  15.061  -2.391  -2.054
  580   HH11  ARG  70          1HH1      ARG  70  14.098  -5.539  -3.082
  581   HH12  ARG  70          2HH1      ARG  70  15.725  -6.093  -3.261
  582   HH21  ARG  70          1HH2      ARG  70  17.148  -3.122  -2.292
  583   HH22  ARG  70          2HH2      ARG  70  17.425  -4.751  -2.809
  584    H    ASP  71           H        ASP  71  12.504  -4.933   0.582
  585    HA   ASP  71           HA       ASP  71  12.870  -6.909  -1.476
  586    HB2  ASP  71           2HB      ASP  71  14.700  -5.766  -0.137
  587    HB3  ASP  71           1HB      ASP  71  14.229  -6.775   1.225
  588    H    ARG  72           H        ARG  72  11.736  -6.966   1.912
  589    HA   ARG  72           HA       ARG  72  11.505  -9.828   1.988
  590    HB2  ARG  72           2HB      ARG  72  10.605  -9.567   4.199
  591    HB3  ARG  72           1HB      ARG  72  11.945  -8.446   4.010
  592    HG2  ARG  72           2HG      ARG  72  10.333  -6.624   3.616
  593    HG3  ARG  72           1HG      ARG  72   9.009  -7.759   3.883
  594    HD2  ARG  72           2HD      ARG  72  11.129  -6.943   5.875
  595    HD3  ARG  72           1HD      ARG  72   9.427  -6.483   5.902
  596    HE   ARG  72           HE       ARG  72  10.543  -9.108   6.564
  597   HH11  ARG  72          1HH1      ARG  72   7.769  -7.077   6.284
  598   HH12  ARG  72          2HH1      ARG  72   6.779  -8.099   7.258
  599   HH21  ARG  72          1HH2      ARG  72   9.254 -10.419   7.810
  600   HH22  ARG  72          2HH2      ARG  72   7.613  -9.973   8.107
  601    H    PHE  73           H        PHE  73   9.359  -7.255   1.038
  602    HA   PHE  73           HA       PHE  73   7.050  -9.032   0.921
  603    HB2  PHE  73           2HB      PHE  73   7.502  -6.121   0.338
  604    HB3  PHE  73           1HB      PHE  73   6.093  -6.923  -0.346
  605    HD1  PHE  73           HD2      PHE  73   7.839  -6.573   2.957
  606    HD2  PHE  73           HD1      PHE  73   4.140  -6.883   0.863
  607    HE1  PHE  73           HE2      PHE  73   6.618  -6.282   5.067
  608    HE2  PHE  73           HE1      PHE  73   2.918  -6.591   2.977
  609    HZ   PHE  73           HZ       PHE  73   4.158  -6.290   5.081
  610    H    ASP  74           H        ASP  74   8.683  -6.998  -1.525
  611    HA   ASP  74           HA       ASP  74   9.129  -7.312  -3.735
  612    HB2  ASP  74           2HB      ASP  74  10.777  -8.758  -2.503
  613    HB3  ASP  74           1HB      ASP  74   9.730 -10.136  -2.825
  614    H    GLY  75           H        GLY  75   6.365  -7.551  -3.308
  615    HA2  GLY  75           2HA      GLY  75   4.539  -8.051  -4.628
  616    HA3  GLY  75           1HA      GLY  75   5.623  -8.882  -5.730
  617    H    TYR  76           H        TYR  76   4.470  -9.396  -2.370
  618    HA   TYR  76           HA       TYR  76   4.343 -12.262  -2.903
  619    HB2  TYR  76           2HB      TYR  76   4.442 -12.611  -0.625
  620    HB3  TYR  76           1HB      TYR  76   5.293 -11.079  -0.749
  621    HD1  TYR  76           HD1      TYR  76   3.604  -8.943  -0.567
  622    HD2  TYR  76           HD2      TYR  76   2.917 -12.811   1.079
  623    HE1  TYR  76           HE1      TYR  76   2.066  -7.965   1.090
  624    HE2  TYR  76           HE2      TYR  76   1.380 -11.846   2.732
  625    HH   TYR  76           HH       TYR  76   0.135  -8.727   2.502
  626    H    ILE  77           H        ILE  77   2.465 -13.544  -2.345
  627    HA   ILE  77           HA       ILE  77  -0.028 -12.247  -3.130
  628    HB   ILE  77           HB       ILE  77   0.567 -15.175  -2.625
  629   HG12  ILE  77          2HG1      ILE  77   1.826 -14.244  -4.540
  630   HG13  ILE  77          1HG1      ILE  77   0.616 -15.412  -5.059
  631   HG21  ILE  77          1HG2      ILE  77  -1.789 -14.723  -2.314
  632   HG22  ILE  77          2HG2      ILE  77  -1.553 -15.586  -3.834
  633   HG23  ILE  77          3HG2      ILE  77  -1.859 -13.849  -3.843
  634   HD11  ILE  77          3HD1      ILE  77   0.720 -13.478  -6.536
  635   HD12  ILE  77          1HD1      ILE  77   0.325 -12.416  -5.185
  636   HD13  ILE  77          2HD1      ILE  77  -0.853 -13.603  -5.747
  637    H    PHE  78           H        PHE  78  -1.198 -11.331  -1.542
  638    HA   PHE  78           HA       PHE  78  -1.324 -12.573   1.111
  639    HB2  PHE  78           2HB      PHE  78  -0.950 -10.143   0.990
  640    HB3  PHE  78           1HB      PHE  78  -2.470  -9.946   0.124
  641    HD1  PHE  78           HD1      PHE  78  -1.120 -11.297   3.328
  642    HD2  PHE  78           HD2      PHE  78  -4.396  -9.442   1.336
  643    HE1  PHE  78           HE1      PHE  78  -2.294 -11.066   5.477
  644    HE2  PHE  78           HE2      PHE  78  -5.572  -9.209   3.482
  645    HZ   PHE  78           HZ       PHE  78  -4.522 -10.021   5.556
  646    H    LEU  79           H        LEU  79  -3.047 -13.698   1.831
  647    HA   LEU  79           HA       LEU  79  -5.518 -13.673   0.210
  648    HB2  LEU  79           2HB      LEU  79  -4.309 -15.942   1.799
  649    HB3  LEU  79           1HB      LEU  79  -5.867 -16.003   0.997
  650    HG   LEU  79           HG       LEU  79  -3.238 -15.589  -0.441
  651   HD11  LEU  79          1HD1      LEU  79  -3.342 -17.799   0.605
  652   HD12  LEU  79          2HD1      LEU  79  -3.428 -17.902  -1.153
  653   HD13  LEU  79          3HD1      LEU  79  -4.890 -18.102  -0.186
  654   HD21  LEU  79          3HD2      LEU  79  -4.533 -16.071  -2.454
  655   HD22  LEU  79          1HD2      LEU  79  -5.174 -14.658  -1.616
  656   HD23  LEU  79          2HD2      LEU  79  -6.005 -16.209  -1.490
  657    H    ASP  80           H        ASP  80  -6.995 -12.489   1.280
  658    HA   ASP  80           HA       ASP  80  -7.114 -12.473   4.179
  659    HB2  ASP  80           2HB      ASP  80  -7.499 -10.437   2.719
  660    HB3  ASP  80           1HB      ASP  80  -9.025 -11.160   2.226
  661    H    SER  81           H        SER  81  -9.773 -12.438   4.807
  662    HA   SER  81           HA       SER  81 -10.478 -14.997   5.295
  663    HB2  SER  81           2HB      SER  81 -12.411 -12.725   4.769
  664    HB3  SER  81           1HB      SER  81 -12.786 -14.203   5.655
  665    HG   SER  81           HG       SER  81 -11.387 -11.956   6.450
  666    H    LYS  82           H        LYS  82 -11.722 -13.161   2.464
  667    HA   LYS  82           HA       LYS  82 -13.269 -15.325   1.466
  668    HB2  LYS  82           2HB      LYS  82 -12.282 -12.777   0.194
  669    HB3  LYS  82           1HB      LYS  82 -13.269 -13.940  -0.683
  670    HG2  LYS  82           2HG      LYS  82 -14.076 -12.560   1.876
  671    HG3  LYS  82           1HG      LYS  82 -14.586 -12.084   0.254
  672    HD2  LYS  82           2HD      LYS  82 -15.635 -14.307  -0.038
  673    HD3  LYS  82           1HD      LYS  82 -15.162 -14.728   1.609
  674    HE2  LYS  82           2HE      LYS  82 -16.550 -12.950   2.498
  675    HE3  LYS  82           1HE      LYS  82 -16.965 -12.419   0.868
  676    HZ1  LYS  82           3HZ      LYS  82 -17.637 -15.071   2.030
  677    HZ2  LYS  82           1HZ      LYS  82 -18.073 -14.519   0.490
  678    HZ3  LYS  82           2HZ      LYS  82 -18.710 -13.773   1.868
  679    H    GLY  83           H        GLY  83  -9.895 -14.742   1.273
  680    HA2  GLY  83           2HA      GLY  83  -8.251 -16.139   0.412
  681    HA3  GLY  83           1HA      GLY  83  -9.508 -17.141  -0.287
  682    H    LEU  84           H        LEU  84  -9.421 -13.721  -0.946
  683    HA   LEU  84           HA       LEU  84  -8.997 -14.232  -3.766
  684    HB2  LEU  84           2HB      LEU  84  -9.378 -11.613  -2.303
  685    HB3  LEU  84           1HB      LEU  84  -9.402 -11.824  -4.044
  686    HG   LEU  84           HG       LEU  84 -11.409 -12.980  -2.098
  687   HD11  LEU  84          1HD1      LEU  84 -11.638 -10.568  -2.346
  688   HD12  LEU  84          2HD1      LEU  84 -12.984 -11.415  -3.109
  689   HD13  LEU  84          3HD1      LEU  84 -11.691 -10.742  -4.103
  690   HD21  LEU  84          3HD2      LEU  84 -11.309 -13.111  -5.115
  691   HD22  LEU  84          1HD2      LEU  84 -12.661 -13.646  -4.111
  692   HD23  LEU  84          2HD2      LEU  84 -11.101 -14.461  -3.998
  693    H    GLU  85           H        GLU  85  -7.081 -14.139  -4.778
  694    HA   GLU  85           HA       GLU  85  -4.648 -13.700  -3.411
  695    HB2  GLU  85           2HB      GLU  85  -5.214 -13.799  -6.383
  696    HB3  GLU  85           1HB      GLU  85  -3.607 -13.852  -5.668
  697    HG2  GLU  85           2HG      GLU  85  -4.098 -15.953  -4.600
  698    HG3  GLU  85           1HG      GLU  85  -5.772 -15.881  -5.148
  699    H    TYR  86           H        TYR  86  -4.100 -11.740  -2.625
  700    HA   TYR  86           HA       TYR  86  -4.260  -9.388  -4.403
  701    HB2  TYR  86           2HB      TYR  86  -3.593  -9.353  -1.453
  702    HB3  TYR  86           1HB      TYR  86  -4.111  -8.007  -2.462
  703    HD1  TYR  86           HD1      TYR  86  -6.512  -8.566  -3.674
  704    HD2  TYR  86           HD2      TYR  86  -5.159 -10.100   0.059
  705    HE1  TYR  86           HE1      TYR  86  -8.839  -8.960  -2.995
  706    HE2  TYR  86           HE2      TYR  86  -7.481 -10.499   0.742
  707    HH   TYR  86           HH       TYR  86  -9.812  -9.442   0.057
  708    HA   PRO  87           HA       PRO  87   0.239 -10.246  -4.575
  709    HB2  PRO  87           2HB      PRO  87   0.642  -9.396  -7.103
  710    HB3  PRO  87           1HB      PRO  87  -0.036 -10.988  -6.745
  711    HG2  PRO  87           2HG      PRO  87  -1.423  -8.491  -7.626
  712    HG3  PRO  87           1HG      PRO  87  -1.739 -10.173  -8.088
  713    HD2  PRO  87           2HD      PRO  87  -3.191  -8.746  -6.205
  714    HD3  PRO  87           1HD      PRO  87  -3.119 -10.516  -6.298
  715    H    ALA  88           H        ALA  88   0.781  -8.622  -3.061
  716    HA   ALA  88           HA       ALA  88   0.634  -5.825  -3.748
  717    HB1  ALA  88           3HB      ALA  88   2.043  -7.161  -1.430
  718    HB2  ALA  88           1HB      ALA  88   0.388  -6.549  -1.426
  719    HB3  ALA  88           2HB      ALA  88   1.739  -5.430  -1.604
  720    H    VAL  89           H        VAL  89   1.838  -5.788  -5.718
  721    HA   VAL  89           HA       VAL  89   4.659  -6.485  -5.680
  722    HB   VAL  89           HB       VAL  89   3.031  -5.185  -7.876
  723   HG11  VAL  89          1HG1      VAL  89   5.766  -6.469  -7.969
  724   HG12  VAL  89          2HG1      VAL  89   5.415  -4.747  -8.133
  725   HG13  VAL  89          3HG1      VAL  89   4.857  -5.883  -9.363
  726   HG21  VAL  89          3HG2      VAL  89   2.181  -7.402  -7.308
  727   HG22  VAL  89          1HG2      VAL  89   3.799  -8.083  -7.476
  728   HG23  VAL  89          2HG2      VAL  89   2.969  -7.421  -8.885
  729    H    VAL  90           H        VAL  90   6.192  -5.158  -4.993
  730    HA   VAL  90           HA       VAL  90   5.614  -2.291  -4.684
  731    HB   VAL  90           HB       VAL  90   7.910  -3.890  -3.518
  732   HG11  VAL  90          1HG1      VAL  90   6.809  -1.171  -2.790
  733   HG12  VAL  90          2HG1      VAL  90   8.333  -1.487  -3.619
  734   HG13  VAL  90          3HG1      VAL  90   8.113  -2.015  -1.952
  735   HG21  VAL  90          3HG2      VAL  90   6.632  -3.930  -1.425
  736   HG22  VAL  90          1HG2      VAL  90   5.783  -4.785  -2.713
  737   HG23  VAL  90          2HG2      VAL  90   5.267  -3.164  -2.241
  738    H    GLU  91           H        GLU  91   6.571  -0.804  -5.969
  739    HA   GLU  91           HA       GLU  91   9.153  -1.405  -7.228
  740    HB2  GLU  91           2HB      GLU  91   8.317  -0.485  -9.412
  741    HB3  GLU  91           1HB      GLU  91   7.650  -2.048  -8.963
  742    HG2  GLU  91           2HG      GLU  91   5.590  -0.974  -8.223
  743    HG3  GLU  91           1HG      GLU  91   6.262   0.607  -8.622
  744    H    PHE  92           H        PHE  92  10.345   0.449  -7.908
  745    HA   PHE  92           HA       PHE  92  10.122   2.608  -6.077
  746    HB2  PHE  92           2HB      PHE  92  12.097   3.519  -7.191
  747    HB3  PHE  92           1HB      PHE  92  12.287   1.793  -6.907
  748    HD1  PHE  92           HD1      PHE  92  11.962   0.201  -8.826
  749    HD2  PHE  92           HD2      PHE  92  12.218   4.417  -9.377
  750    HE1  PHE  92           HE1      PHE  92  12.474  -0.143 -11.210
  751    HE2  PHE  92           HE2      PHE  92  12.726   4.080 -11.759
  752    HZ   PHE  92           HZ       PHE  92  12.852   1.796 -12.677
  753    H    ALA  93           H        ALA  93   9.892   4.869  -6.513
  754    HA   ALA  93           HA       ALA  93   8.016   5.482  -8.662
  755    HB1  ALA  93           3HB      ALA  93   7.570   6.304  -6.387
  756    HB2  ALA  93           1HB      ALA  93   7.732   7.628  -7.541
  757    HB3  ALA  93           2HB      ALA  93   9.059   7.249  -6.441
  758    HA   PRO  94           HA       PRO  94  11.055   7.214 -11.364
  759    HB2  PRO  94           2HB      PRO  94   9.572   8.923 -12.838
  760    HB3  PRO  94           1HB      PRO  94   9.390   7.168 -12.952
  761    HG2  PRO  94           2HG      PRO  94   7.731   9.153 -11.430
  762    HG3  PRO  94           1HG      PRO  94   7.199   7.790 -12.433
  763    HD2  PRO  94           2HD      PRO  94   7.328   7.673  -9.713
  764    HD3  PRO  94           1HD      PRO  94   7.558   6.253 -10.752
  765    H    PHE  95           H        PHE  95  12.645   8.565 -10.821
  766    HA   PHE  95           HA       PHE  95  12.072  11.195  -9.641
  767    HB2  PHE  95           2HB      PHE  95  14.502  11.224  -9.105
  768    HB3  PHE  95           1HB      PHE  95  13.679   9.825  -8.430
  769    HD1  PHE  95           HD2      PHE  95  13.992   7.581  -9.473
  770    HD2  PHE  95           HD1      PHE  95  16.266  10.971 -10.700
  771    HE1  PHE  95           HE2      PHE  95  15.627   6.093 -10.554
  772    HE2  PHE  95           HE1      PHE  95  17.901   9.484 -11.783
  773    HZ   PHE  95           HZ       PHE  95  17.583   7.043 -11.712
  774    H    GLN  96           H        GLN  96  11.884  10.384 -12.578
  775    HA   GLN  96           HA       GLN  96  14.026  11.839 -13.886
  776    HB2  GLN  96           2HB      GLN  96  13.298   9.771 -14.884
  777    HB3  GLN  96           1HB      GLN  96  11.629  10.313 -14.919
  778    HG2  GLN  96           2HG      GLN  96  12.599  10.370 -17.137
  779    HG3  GLN  96           1HG      GLN  96  12.198  11.996 -16.594
  780   HE21  GLN  96          1HE2      GLN  96  13.825  13.488 -16.376
  781   HE22  GLN  96          2HE2      GLN  96  15.469  13.177 -16.817
  782    H    LYS  97           H        LYS  97  13.936  13.918 -14.542
  783    HA   LYS  97           HA       LYS  97  11.603  15.549 -14.391
  784    HB2  LYS  97           2HB      LYS  97  13.796  16.571 -14.260
  785    HB3  LYS  97           1HB      LYS  97  14.236  15.946 -15.843
  786    HG2  LYS  97           2HG      LYS  97  13.755  18.285 -16.043
  787    HG3  LYS  97           1HG      LYS  97  12.480  17.381 -16.855
  788    HD2  LYS  97           2HD      LYS  97  11.436  19.138 -15.624
  789    HD3  LYS  97           1HD      LYS  97  11.093  17.629 -14.776
  790    HE2  LYS  97           2HE      LYS  97  11.675  19.358 -13.183
  791    HE3  LYS  97           1HE      LYS  97  12.932  18.123 -13.201
  792    HZ1  LYS  97           3HZ      LYS  97  14.252  19.571 -14.640
  793    HZ2  LYS  97           1HZ      LYS  97  13.897  20.322 -13.168
  794    HZ3  LYS  97           2HZ      LYS  97  13.054  20.760 -14.566
  Start of MODEL    7
    1    H1   MET   1           1H       MET   1  15.783  21.285  21.528
    2    H2   MET   1           2H       MET   1  15.505  19.739  22.154
    3    H3   MET   1           3H       MET   1  14.804  20.197  20.686
    4    HA   MET   1           HA       MET   1  16.969  20.375  19.656
    5    HB2  MET   1           2HB      MET   1  17.939  19.377  22.346
    6    HB3  MET   1           1HB      MET   1  18.937  19.466  20.900
    7    HG2  MET   1           2HG      MET   1  18.693  21.873  20.835
    8    HG3  MET   1           1HG      MET   1  17.602  21.824  22.219
    9    HE1  MET   1           3HE      MET   1  19.108  23.665  23.451
   10    HE2  MET   1           1HE      MET   1  20.169  23.696  22.039
   11    HE3  MET   1           2HE      MET   1  20.852  23.503  23.653
   12    H    GLY   2           H        GLY   2  17.914  18.545  18.587
   13    HA2  GLY   2           2HA      GLY   2  17.865  15.913  19.134
   14    HA3  GLY   2           1HA      GLY   2  16.185  16.204  18.716
   15    H    HIS   3           H        HIS   3  15.845  17.322  16.546
   16    HA   HIS   3           HA       HIS   3  17.737  16.157  14.592
   17    HB2  HIS   3           2HB      HIS   3  14.730  16.451  14.365
   18    HB3  HIS   3           1HB      HIS   3  15.784  15.874  13.079
   19    HD1  HIS   3           HD1      HIS   3  16.426  13.433  13.122
   20    HD2  HIS   3           HD2      HIS   3  14.540  14.657  16.612
   21    HE1  HIS   3           HE1      HIS   3  15.962  11.329  14.405
   22    HE2  HIS   3           HE2      HIS   3  14.770  12.084  16.488
   23    H    HIS   4           H        HIS   4  18.948  17.958  14.040
   24    HA   HIS   4           HA       HIS   4  17.486  20.204  12.807
   25    HB2  HIS   4           2HB      HIS   4  20.353  19.916  13.709
   26    HB3  HIS   4           1HB      HIS   4  19.826  21.242  12.676
   27    HD1  HIS   4           HD1      HIS   4  19.559  19.939  16.170
   28    HD2  HIS   4           HD2      HIS   4  18.279  23.210  13.950
   29    HE1  HIS   4           HE1      HIS   4  18.676  21.583  17.843
   30    HE2  HIS   4           HE2      HIS   4  17.954  23.574  16.491
   31    H    HIS   5           H        HIS   5  18.465  17.286  11.874
   32    HA   HIS   5           HA       HIS   5  18.799  18.185   9.089
   33    HB2  HIS   5           2HB      HIS   5  20.343  15.972  10.461
   34    HB3  HIS   5           1HB      HIS   5  20.290  16.181   8.714
   35    HD1  HIS   5           HD1      HIS   5  22.231  17.126  11.597
   36    HD2  HIS   5           HD2      HIS   5  21.327  18.853   7.927
   37    HE1  HIS   5           HE1      HIS   5  23.947  18.919  11.259
   38    HE2  HIS   5           HE2      HIS   5  23.490  19.825   8.959
   39    H    HIS   6           H        HIS   6  16.810  17.717   8.296
   40    HA   HIS   6           HA       HIS   6  15.323  15.381   9.105
   41    HB2  HIS   6           2HB      HIS   6  14.193  17.507   8.565
   42    HB3  HIS   6           1HB      HIS   6  14.776  17.399   6.909
   43    HD1  HIS   6           HD1      HIS   6  13.154  16.426   5.313
   44    HD2  HIS   6           HD2      HIS   6  12.436  15.152   9.206
   45    HE1  HIS   6           HE1      HIS   6  11.080  15.021   5.193
   46    HE2  HIS   6           HE2      HIS   6  10.558  14.432   7.581
   47    H    HIS   7           H        HIS   7  15.011  13.478   7.988
   48    HA   HIS   7           HA       HIS   7  16.916  12.882   5.893
   49    HB2  HIS   7           2HB      HIS   7  14.971  11.214   7.469
   50    HB3  HIS   7           1HB      HIS   7  15.799  10.554   6.062
   51    HD1  HIS   7           HD1      HIS   7  18.461  10.537   6.196
   52    HD2  HIS   7           HD2      HIS   7  16.465  11.213   9.782
   53    HE1  HIS   7           HE1      HIS   7  20.162  10.139   7.999
   54    HE2  HIS   7           HE2      HIS   7  18.907  10.438  10.157
   55    H    HIS   8           H        HIS   8  16.555  12.326   3.830
   56    HA   HIS   8           HA       HIS   8  13.812  12.565   2.766
   57    HB2  HIS   8           2HB      HIS   8  15.131  14.478   2.049
   58    HB3  HIS   8           1HB      HIS   8  16.424  13.422   1.492
   59    HD1  HIS   8           HD1      HIS   8  12.717  13.905   0.721
   60    HD2  HIS   8           HD2      HIS   8  16.308  13.024  -1.176
   61    HE1  HIS   8           HE1      HIS   8  12.161  13.714  -1.720
   62    HE2  HIS   8           HE2      HIS   8  14.366  13.288  -2.856
   63    H    SER   9           H        SER   9  13.073  10.838   1.669
   64    HA   SER   9           HA       SER   9  15.016   8.748   0.872
   65    HB2  SER   9           2HB      SER   9  13.601   8.107   2.819
   66    HB3  SER   9           1HB      SER   9  12.167   8.318   1.814
   67    HG   SER   9           HG       SER   9  13.266   6.115   2.066
   68    H    HIS  10           H        HIS  10  13.368   7.072  -0.547
   69    HA   HIS  10           HA       HIS  10  12.659   8.740  -2.879
   70    HB2  HIS  10           2HB      HIS  10  13.376   5.797  -2.798
   71    HB3  HIS  10           1HB      HIS  10  13.057   6.746  -4.245
   72    HD1  HIS  10           HD1      HIS  10  14.832   8.799  -4.623
   73    HD2  HIS  10           HD2      HIS  10  15.997   5.730  -2.076
   74    HE1  HIS  10           HE1      HIS  10  17.326   8.989  -4.436
   75    HE2  HIS  10           HE2      HIS  10  18.020   7.058  -2.982
   76    H    MET  11           H        MET  11  10.696   8.452  -3.945
   77    HA   MET  11           HA       MET  11   8.507   7.482  -2.391
   78    HB2  MET  11           2HB      MET  11   8.469   8.200  -5.332
   79    HB3  MET  11           1HB      MET  11   7.098   8.154  -4.232
   80    HG2  MET  11           2HG      MET  11   7.680  10.432  -4.594
   81    HG3  MET  11           1HG      MET  11   8.147  10.013  -2.947
   82    HE1  MET  11           3HE      MET  11   9.426  10.646  -6.624
   83    HE2  MET  11           1HE      MET  11   9.995   9.012  -6.273
   84    HE3  MET  11           2HE      MET  11  11.152  10.332  -6.442
   85    H    VAL  12           H        VAL  12   8.786   5.281  -2.020
   86    HA   VAL  12           HA       VAL  12   8.614   3.505  -4.368
   87    HB   VAL  12           HB       VAL  12   9.320   2.770  -1.512
   88   HG11  VAL  12          1HG1      VAL  12   9.521   1.170  -4.070
   89   HG12  VAL  12          2HG1      VAL  12   8.357   0.910  -2.770
   90   HG13  VAL  12          3HG1      VAL  12  10.076   0.645  -2.480
   91   HG21  VAL  12          3HG2      VAL  12  11.024   4.228  -2.508
   92   HG22  VAL  12          1HG2      VAL  12  11.150   3.139  -3.891
   93   HG23  VAL  12          2HG2      VAL  12  11.630   2.585  -2.287
   94    H    VAL  13           H        VAL  13   6.631   2.800  -4.851
   95    HA   VAL  13           HA       VAL  13   4.554   2.857  -2.750
   96    HB   VAL  13           HB       VAL  13   2.914   3.227  -4.543
   97   HG11  VAL  13          1HG1      VAL  13   3.914   5.158  -3.411
   98   HG12  VAL  13          2HG1      VAL  13   3.529   5.528  -5.092
   99   HG13  VAL  13          3HG1      VAL  13   5.198   5.207  -4.622
  100   HG21  VAL  13          3HG2      VAL  13   3.665   3.742  -6.830
  101   HG22  VAL  13          1HG2      VAL  13   4.057   2.084  -6.372
  102   HG23  VAL  13          2HG2      VAL  13   5.318   3.319  -6.379
  103    H    ILE  14           H        ILE  14   2.576   1.459  -3.442
  104    HA   ILE  14           HA       ILE  14   3.554  -1.247  -4.112
  105    HB   ILE  14           HB       ILE  14   2.727  -0.845  -1.754
  106   HG12  ILE  14          2HG1      ILE  14   1.090  -2.885  -1.843
  107   HG13  ILE  14          1HG1      ILE  14   1.527  -2.938  -3.548
  108   HG21  ILE  14          1HG2      ILE  14   0.044  -0.560  -3.100
  109   HG22  ILE  14          2HG2      ILE  14   0.913   0.685  -2.204
  110   HG23  ILE  14          3HG2      ILE  14   0.305  -0.740  -1.364
  111   HD11  ILE  14          3HD1      ILE  14   3.397  -3.161  -1.202
  112   HD12  ILE  14          1HD1      ILE  14   3.895  -3.133  -2.896
  113   HD13  ILE  14          2HD1      ILE  14   2.900  -4.457  -2.290
  114    H    ARG  15           H        ARG  15   2.579  -2.309  -5.829
  115    HA   ARG  15           HA       ARG  15   0.104  -1.150  -6.935
  116    HB2  ARG  15           2HB      ARG  15   2.563  -1.913  -8.517
  117    HB3  ARG  15           1HB      ARG  15   0.998  -1.582  -9.243
  118    HG2  ARG  15           2HG      ARG  15   1.193   0.691  -7.979
  119    HG3  ARG  15           1HG      ARG  15   2.912   0.294  -7.921
  120    HD2  ARG  15           2HD      ARG  15   1.194   0.542 -10.393
  121    HD3  ARG  15           1HD      ARG  15   2.447   1.664  -9.866
  122    HE   ARG  15           HE       ARG  15   3.903  -0.497 -10.139
  123   HH11  ARG  15          1HH1      ARG  15   1.349   0.555 -12.204
  124   HH12  ARG  15          2HH1      ARG  15   2.080  -0.113 -13.619
  125   HH21  ARG  15          1HH2      ARG  15   4.822  -1.331 -11.956
  126   HH22  ARG  15          2HH2      ARG  15   4.023  -1.161 -13.484
  127    H    ARG  16           H        ARG  16  -0.625  -2.630  -8.880
  128    HA   ARG  16           HA       ARG  16  -1.680  -4.518  -9.515
  129    HB2  ARG  16           2HB      ARG  16   0.487  -5.903  -7.927
  130    HB3  ARG  16           1HB      ARG  16  -0.704  -6.747  -8.909
  131    HG2  ARG  16           2HG      ARG  16   0.129  -5.382 -10.871
  132    HG3  ARG  16           1HG      ARG  16   1.463  -4.872  -9.834
  133    HD2  ARG  16           2HD      ARG  16   2.155  -6.752 -11.192
  134    HD3  ARG  16           1HD      ARG  16   2.074  -7.241  -9.500
  135    HE   ARG  16           HE       ARG  16  -0.254  -7.792 -11.168
  136   HH11  ARG  16          1HH1      ARG  16   2.578  -8.988  -9.607
  137   HH12  ARG  16          2HH1      ARG  16   2.078 -10.638  -9.728
  138   HH21  ARG  16          1HH2      ARG  16  -0.873  -9.918 -11.326
  139   HH22  ARG  16          2HH2      ARG  16   0.141 -11.157 -10.667
  140    H    LEU  17           H        LEU  17  -2.270  -3.137  -6.903
  141    HA   LEU  17           HA       LEU  17  -3.660  -5.203  -5.397
  142    HB2  LEU  17           2HB      LEU  17  -3.339  -2.228  -5.092
  143    HB3  LEU  17           1HB      LEU  17  -4.589  -3.071  -4.202
  144    HG   LEU  17           HG       LEU  17  -2.602  -2.712  -2.830
  145   HD11  LEU  17          1HD1      LEU  17  -2.299  -4.996  -2.027
  146   HD12  LEU  17          2HD1      LEU  17  -3.024  -5.622  -3.509
  147   HD13  LEU  17          3HD1      LEU  17  -3.993  -4.664  -2.389
  148   HD21  LEU  17          3HD2      LEU  17  -1.158  -4.436  -4.847
  149   HD22  LEU  17          1HD2      LEU  17  -0.503  -3.865  -3.313
  150   HD23  LEU  17          2HD2      LEU  17  -0.904  -2.709  -4.582
  151    HA   PRO  18           HA       PRO  18  -7.283  -4.414  -8.052
  152    HB2  PRO  18           2HB      PRO  18  -8.479  -6.796  -7.706
  153    HB3  PRO  18           1HB      PRO  18  -7.078  -6.611  -8.768
  154    HG2  PRO  18           2HG      PRO  18  -7.214  -7.694  -5.983
  155    HG3  PRO  18           1HG      PRO  18  -6.263  -8.272  -7.363
  156    HD2  PRO  18           2HD      PRO  18  -5.272  -6.684  -5.318
  157    HD3  PRO  18           1HD      PRO  18  -4.552  -6.810  -6.934
  158    HA   PRO  19           HA       PRO  19 -10.114  -2.972  -4.916
  159    HB2  PRO  19           2HB      PRO  19 -12.254  -3.691  -6.864
  160    HB3  PRO  19           1HB      PRO  19 -11.924  -2.145  -6.070
  161    HG2  PRO  19           2HG      PRO  19 -11.321  -2.496  -8.640
  162    HG3  PRO  19           1HG      PRO  19 -10.233  -1.589  -7.569
  163    HD2  PRO  19           2HD      PRO  19  -9.989  -4.407  -8.577
  164    HD3  PRO  19           1HD      PRO  19  -8.733  -3.164  -8.385
  165    H    GLY  20           H        GLY  20 -10.320  -4.325  -3.194
  166    HA2  GLY  20           2HA      GLY  20 -12.344  -6.457  -3.366
  167    HA3  GLY  20           1HA      GLY  20 -10.743  -6.876  -2.778
  168    H    LEU  21           H        LEU  21 -10.001  -5.837  -0.806
  169    HA   LEU  21           HA       LEU  21 -12.198  -5.445   1.070
  170    HB2  LEU  21           2HB      LEU  21 -10.651  -5.819   2.837
  171    HB3  LEU  21           1HB      LEU  21 -10.381  -7.046   1.615
  172    HG   LEU  21           HG       LEU  21  -8.641  -4.606   2.065
  173   HD11  LEU  21          1HD1      LEU  21  -8.526  -6.189   3.921
  174   HD12  LEU  21          2HD1      LEU  21  -7.025  -6.171   2.998
  175   HD13  LEU  21          3HD1      LEU  21  -8.169  -7.497   2.793
  176   HD21  LEU  21          3HD2      LEU  21  -7.019  -5.880   0.627
  177   HD22  LEU  21          1HD2      LEU  21  -8.428  -5.246  -0.222
  178   HD23  LEU  21          2HD2      LEU  21  -8.347  -6.959   0.196
  179    H    THR  22           H        THR  22 -11.690  -3.866   2.936
  180    HA   THR  22           HA       THR  22 -11.315  -1.221   1.750
  181    HB   THR  22           HB       THR  22 -12.229  -2.008   4.537
  182    HG1  THR  22           HG1      THR  22 -14.200  -2.028   3.740
  183   HG21  THR  22          3HG2      THR  22 -12.995   0.308   4.748
  184   HG22  THR  22          1HG2      THR  22 -12.320   0.686   3.162
  185   HG23  THR  22          2HG2      THR  22 -11.251   0.247   4.494
  186    H    LYS  23           H        LYS  23  -9.883   0.356   2.606
  187    HA   LYS  23           HA       LYS  23  -7.289  -0.307   3.100
  188    HB2  LYS  23           2HB      LYS  23  -6.949   1.958   3.931
  189    HB3  LYS  23           1HB      LYS  23  -8.051   1.964   2.560
  190    HG2  LYS  23           2HG      LYS  23  -9.958   2.152   4.109
  191    HG3  LYS  23           1HG      LYS  23  -8.833   2.192   5.469
  192    HD2  LYS  23           2HD      LYS  23  -9.003   4.213   3.224
  193    HD3  LYS  23           1HD      LYS  23  -9.567   4.445   4.880
  194    HE2  LYS  23           2HE      LYS  23  -7.246   4.165   5.680
  195    HE3  LYS  23           1HE      LYS  23  -6.704   3.994   4.011
  196    HZ1  LYS  23           3HZ      LYS  23  -6.333   6.224   4.676
  197    HZ2  LYS  23           1HZ      LYS  23  -7.913   6.396   5.264
  198    HZ3  LYS  23           2HZ      LYS  23  -7.642   6.243   3.603
  199    H    GLU  24           H        GLU  24  -9.844  -0.135   5.504
  200    HA   GLU  24           HA       GLU  24  -8.484   0.042   7.885
  201    HB2  GLU  24           2HB      GLU  24 -10.839  -1.782   7.335
  202    HB3  GLU  24           1HB      GLU  24 -10.344  -1.175   8.910
  203    HG2  GLU  24           2HG      GLU  24 -10.863   1.106   8.202
  204    HG3  GLU  24           1HG      GLU  24 -11.338   0.508   6.612
  205    H    GLN  25           H        GLN  25  -9.018  -2.906   5.959
  206    HA   GLN  25           HA       GLN  25  -7.179  -4.383   7.748
  207    HB2  GLN  25           2HB      GLN  25  -9.147  -5.547   5.764
  208    HB3  GLN  25           1HB      GLN  25  -8.253  -6.413   7.007
  209    HG2  GLN  25           2HG      GLN  25  -9.501  -5.229   8.741
  210    HG3  GLN  25           1HG      GLN  25 -10.393  -4.347   7.501
  211   HE21  GLN  25          1HE2      GLN  25 -11.895  -5.478   6.218
  212   HE22  GLN  25          2HE2      GLN  25 -12.525  -7.009   6.708
  213    H    LEU  26           H        LEU  26  -7.075  -2.710   4.998
  214    HA   LEU  26           HA       LEU  26  -5.480  -4.607   3.430
  215    HB2  LEU  26           2HB      LEU  26  -7.134  -3.631   2.109
  216    HB3  LEU  26           1HB      LEU  26  -6.910  -2.046   2.806
  217    HG   LEU  26           HG       LEU  26  -4.656  -1.974   1.630
  218   HD11  LEU  26          1HD1      LEU  26  -5.784  -4.383   0.202
  219   HD12  LEU  26          2HD1      LEU  26  -4.363  -4.356   1.249
  220   HD13  LEU  26          3HD1      LEU  26  -4.347  -3.478  -0.281
  221   HD21  LEU  26          3HD2      LEU  26  -7.145  -2.170  -0.067
  222   HD22  LEU  26          1HD2      LEU  26  -5.637  -1.383  -0.537
  223   HD23  LEU  26          2HD2      LEU  26  -6.583  -0.742   0.805
  224    H    GLU  27           H        GLU  27  -5.186  -1.387   4.939
  225    HA   GLU  27           HA       GLU  27  -2.551  -0.987   3.851
  226    HB2  GLU  27           2HB      GLU  27  -2.563   1.121   4.895
  227    HB3  GLU  27           1HB      GLU  27  -4.223   0.842   4.397
  228    HG2  GLU  27           2HG      GLU  27  -4.692   0.088   6.753
  229    HG3  GLU  27           1HG      GLU  27  -3.080   0.647   7.173
  230    H    GLU  28           H        GLU  28  -3.792  -2.503   6.692
  231    HA   GLU  28           HA       GLU  28  -1.849  -2.039   8.594
  232    HB2  GLU  28           2HB      GLU  28  -2.455  -4.274   9.540
  233    HB3  GLU  28           1HB      GLU  28  -3.825  -3.229   9.198
  234    HG2  GLU  28           2HG      GLU  28  -4.297  -4.472   7.161
  235    HG3  GLU  28           1HG      GLU  28  -2.884  -5.489   7.442
  236    H    GLN  29           H        GLN  29  -1.734  -4.588   6.076
  237    HA   GLN  29           HA       GLN  29   0.957  -5.333   6.848
  238    HB2  GLN  29           2HB      GLN  29   0.864  -6.788   4.775
  239    HB3  GLN  29           1HB      GLN  29  -0.315  -7.146   6.026
  240    HG2  GLN  29           2HG      GLN  29  -1.117  -5.323   3.805
  241    HG3  GLN  29           1HG      GLN  29  -0.980  -7.047   3.472
  242   HE21  GLN  29          1HE2      GLN  29  -3.341  -5.333   3.509
  243   HE22  GLN  29          2HE2      GLN  29  -4.425  -6.055   4.647
  244    H    LEU  30           H        LEU  30  -0.374  -2.925   4.847
  245    HA   LEU  30           HA       LEU  30   2.029  -2.701   3.190
  246    HB2  LEU  30           2HB      LEU  30  -0.568  -1.161   3.074
  247    HB3  LEU  30           1HB      LEU  30   0.754  -1.011   1.932
  248    HG   LEU  30           HG       LEU  30  -0.957  -3.474   2.355
  249   HD11  LEU  30          1HD1      LEU  30  -1.770  -3.015   0.095
  250   HD12  LEU  30          2HD1      LEU  30  -0.792  -1.548   0.035
  251   HD13  LEU  30          3HD1      LEU  30  -2.122  -1.674   1.188
  252   HD21  LEU  30          3HD2      LEU  30   0.255  -4.407   0.434
  253   HD22  LEU  30          1HD2      LEU  30   1.336  -4.095   1.790
  254   HD23  LEU  30          2HD2      LEU  30   1.311  -2.993   0.413
  255    H    ARG  31           H        ARG  31   1.087  -1.553   6.178
  256    HA   ARG  31           HA       ARG  31   2.781   0.852   5.845
  257    HB2  ARG  31           2HB      ARG  31   1.426   2.069   7.440
  258    HB3  ARG  31           1HB      ARG  31   0.403   1.468   6.142
  259    HG2  ARG  31           2HG      ARG  31  -0.430  -0.306   7.564
  260    HG3  ARG  31           1HG      ARG  31   0.673   0.163   8.851
  261    HD2  ARG  31           2HD      ARG  31  -0.473   2.397   8.902
  262    HD3  ARG  31           1HD      ARG  31  -1.664   1.745   7.773
  263    HE   ARG  31           HE       ARG  31  -1.330   0.144  10.135
  264   HH11  ARG  31          1HH1      ARG  31  -3.012   2.835   8.771
  265   HH12  ARG  31          2HH1      ARG  31  -4.289   2.755   9.932
  266   HH21  ARG  31          1HH2      ARG  31  -3.005   0.039  11.589
  267   HH22  ARG  31          2HH2      ARG  31  -4.311   1.165  11.483
  268    HA   PRO  32           HA       PRO  32   4.036  -1.527   9.842
  269    HB2  PRO  32           2HB      PRO  32   5.430  -3.703   9.185
  270    HB3  PRO  32           1HB      PRO  32   3.660  -3.736   9.187
  271    HG2  PRO  32           2HG      PRO  32   5.545  -3.461   6.872
  272    HG3  PRO  32           1HG      PRO  32   4.078  -4.446   7.007
  273    HD2  PRO  32           2HD      PRO  32   4.197  -1.964   5.787
  274    HD3  PRO  32           1HD      PRO  32   2.717  -2.698   6.433
  275    H    LEU  33           H        LEU  33   5.297   0.381   7.840
  276    HA   LEU  33           HA       LEU  33   8.147  -0.112   7.992
  277    HB2  LEU  33           2HB      LEU  33   6.575   2.266   6.988
  278    HB3  LEU  33           1HB      LEU  33   8.317   2.123   6.887
  279    HG   LEU  33           HG       LEU  33   8.013   0.129   5.402
  280   HD11  LEU  33          1HD1      LEU  33   5.785  -0.558   6.087
  281   HD12  LEU  33          2HD1      LEU  33   5.840  -0.249   4.353
  282   HD13  LEU  33          3HD1      LEU  33   5.107   0.935   5.438
  283   HD21  LEU  33          3HD2      LEU  33   8.451   2.355   4.492
  284   HD22  LEU  33          1HD2      LEU  33   6.718   2.682   4.447
  285   HD23  LEU  33          2HD2      LEU  33   7.406   1.420   3.425
  286    HA   PRO  34           HA       PRO  34   8.785   2.306  11.707
  287    HB2  PRO  34           2HB      PRO  34  11.501   2.968  10.876
  288    HB3  PRO  34           1HB      PRO  34  10.968   1.842  12.125
  289    HG2  PRO  34           2HG      PRO  34  12.142   1.032   9.804
  290    HG3  PRO  34           1HG      PRO  34  10.964   0.042  10.684
  291    HD2  PRO  34           2HD      PRO  34  10.544   1.787   8.273
  292    HD3  PRO  34           1HD      PRO  34   9.928   0.149   8.600
  293    H    ALA  35           H        ALA  35  11.112   4.159   9.789
  294    HA   ALA  35           HA       ALA  35   9.676   6.609  10.320
  295    HB1  ALA  35           3HB      ALA  35  12.134   6.542  10.369
  296    HB2  ALA  35           1HB      ALA  35  11.534   7.724   9.204
  297    HB3  ALA  35           2HB      ALA  35  12.154   6.170   8.645
  298    H    HIS  36           H        HIS  36   7.775   6.786   9.177
  299    HA   HIS  36           HA       HIS  36   7.869   6.978   6.295
  300    HB2  HIS  36           2HB      HIS  36   6.473   5.123   5.755
  301    HB3  HIS  36           1HB      HIS  36   7.753   4.491   6.786
  302    HD1  HIS  36           HD1      HIS  36   6.800   4.791   9.551
  303    HD2  HIS  36           HD2      HIS  36   4.166   3.919   6.458
  304    HE1  HIS  36           HE1      HIS  36   4.779   3.804  10.651
  305    HE2  HIS  36           HE2      HIS  36   3.315   3.066   8.747
  306    H    ASP  37           H        ASP  37   5.889   7.648   5.332
  307    HA   ASP  37           HA       ASP  37   3.677   8.322   7.173
  308    HB2  ASP  37           2HB      ASP  37   4.564   9.764   4.651
  309    HB3  ASP  37           1HB      ASP  37   3.053  10.095   5.492
  310    H    TYR  38           H        TYR  38   1.899   7.042   6.791
  311    HA   TYR  38           HA       TYR  38   1.861   5.432   4.391
  312    HB2  TYR  38           2HB      TYR  38  -0.191   4.406   5.320
  313    HB3  TYR  38           1HB      TYR  38   1.168   4.355   6.430
  314    HD1  TYR  38           HD1      TYR  38  -2.129   5.862   5.775
  315    HD2  TYR  38           HD2      TYR  38   1.092   5.523   8.541
  316    HE1  TYR  38           HE1      TYR  38  -3.554   6.805   7.542
  317    HE2  TYR  38           HE2      TYR  38  -0.324   6.469  10.314
  318    HH   TYR  38           HH       TYR  38  -2.323   7.817  10.577
  319    H    PHE  39           H        PHE  39   0.739   5.752   2.581
  320    HA   PHE  39           HA       PHE  39  -0.404   8.420   2.280
  321    HB2  PHE  39           2HB      PHE  39   1.434   7.049   0.804
  322    HB3  PHE  39           1HB      PHE  39  -0.027   6.687  -0.103
  323    HD1  PHE  39           HD2      PHE  39   1.903   9.536   1.319
  324    HD2  PHE  39           HD1      PHE  39  -0.798   8.208  -1.691
  325    HE1  PHE  39           HE2      PHE  39   2.095  11.709   0.186
  326    HE2  PHE  39           HE1      PHE  39  -0.612  10.379  -2.827
  327    HZ   PHE  39           HZ       PHE  39   0.837  12.134  -1.890
  328    H    GLU  40           H        GLU  40  -1.819   7.678  -0.211
  329    HA   GLU  40           HA       GLU  40  -4.379   7.180   0.930
  330    HB2  GLU  40           2HB      GLU  40  -5.212   7.372  -1.384
  331    HB3  GLU  40           1HB      GLU  40  -4.125   8.689  -0.964
  332    HG2  GLU  40           2HG      GLU  40  -2.296   7.429  -2.134
  333    HG3  GLU  40           1HG      GLU  40  -3.520   6.296  -2.693
  334    H    PHE  41           H        PHE  41  -5.203   5.269   1.439
  335    HA   PHE  41           HA       PHE  41  -4.598   2.923  -0.257
  336    HB2  PHE  41           2HB      PHE  41  -5.462   2.998   2.651
  337    HB3  PHE  41           1HB      PHE  41  -5.223   1.532   1.707
  338    HD1  PHE  41           HD1      PHE  41  -2.953   0.872   0.996
  339    HD2  PHE  41           HD2      PHE  41  -3.611   4.204   3.562
  340    HE1  PHE  41           HE1      PHE  41  -0.577   0.844   1.635
  341    HE2  PHE  41           HE2      PHE  41  -1.236   4.183   4.201
  342    HZ   PHE  41           HZ       PHE  41   0.286   2.501   3.240
  343    H    PHE  42           H        PHE  42  -6.292   1.948  -1.286
  344    HA   PHE  42           HA       PHE  42  -8.700   3.472  -1.462
  345    HB2  PHE  42           2HB      PHE  42  -9.346   1.952  -3.232
  346    HB3  PHE  42           1HB      PHE  42  -7.664   2.421  -3.432
  347    HD1  PHE  42           HD2      PHE  42  -5.867   0.788  -3.114
  348    HD2  PHE  42           HD1      PHE  42  -9.960  -0.335  -2.702
  349    HE1  PHE  42           HE2      PHE  42  -5.234  -1.581  -3.267
  350    HE2  PHE  42           HE1      PHE  42  -9.328  -2.706  -2.858
  351    HZ   PHE  42           HZ       PHE  42  -6.962  -3.330  -3.140
  352    H    ALA  43           H        ALA  43 -10.847   2.759  -1.174
  353    HA   ALA  43           HA       ALA  43 -11.215   0.498   0.696
  354    HB1  ALA  43           3HB      ALA  43 -11.663   2.646   1.783
  355    HB2  ALA  43           1HB      ALA  43 -13.142   1.698   1.623
  356    HB3  ALA  43           2HB      ALA  43 -12.836   3.047   0.529
  357    H    ALA  44           H        ALA  44 -11.966  -1.162  -0.533
  358    HA   ALA  44           HA       ALA  44 -14.070  -0.568  -2.526
  359    HB1  ALA  44           3HB      ALA  44 -11.913  -1.062  -3.594
  360    HB2  ALA  44           1HB      ALA  44 -13.138  -2.273  -3.977
  361    HB3  ALA  44           2HB      ALA  44 -11.886  -2.630  -2.788
  362    H    ASP  45           H        ASP  45 -15.089  -2.766  -3.278
  363    HA   ASP  45           HA       ASP  45 -15.684  -4.433  -0.921
  364    HB2  ASP  45           2HB      ASP  45 -17.577  -2.988  -1.224
  365    HB3  ASP  45           1HB      ASP  45 -17.613  -3.305  -2.957
  366    H    LEU  46           H        LEU  46 -15.612  -6.575  -1.232
  367    HA   LEU  46           HA       LEU  46 -14.846  -7.556  -3.878
  368    HB2  LEU  46           2HB      LEU  46 -14.112  -9.584  -2.748
  369    HB3  LEU  46           1HB      LEU  46 -13.386  -8.161  -2.031
  370    HG   LEU  46           HG       LEU  46 -15.810  -9.480  -0.802
  371   HD11  LEU  46          1HD1      LEU  46 -12.913 -10.106  -0.233
  372   HD12  LEU  46          2HD1      LEU  46 -14.086 -11.187  -0.986
  373   HD13  LEU  46          3HD1      LEU  46 -14.300 -10.687   0.690
  374   HD21  LEU  46          3HD2      LEU  46 -14.967  -8.402   1.243
  375   HD22  LEU  46          1HD2      LEU  46 -15.316  -7.228  -0.026
  376   HD23  LEU  46          2HD2      LEU  46 -13.647  -7.689   0.315
  377    H    SER  47           H        SER  47 -17.633  -7.456  -1.929
  378    HA   SER  47           HA       SER  47 -18.858  -9.922  -2.385
  379    HB2  SER  47           2HB      SER  47 -19.809  -8.293  -0.843
  380    HB3  SER  47           1HB      SER  47 -20.145  -7.185  -2.173
  381    HG   SER  47           HG       SER  47 -21.542  -9.395  -1.312
  382    H    LEU  48           H        LEU  48 -18.931  -7.002  -4.397
  383    HA   LEU  48           HA       LEU  48 -19.136  -8.652  -6.770
  384    HB2  LEU  48           2HB      LEU  48 -21.501  -8.284  -6.187
  385    HB3  LEU  48           1HB      LEU  48 -21.233  -6.551  -6.179
  386    HG   LEU  48           HG       LEU  48 -20.717  -6.620  -8.597
  387   HD11  LEU  48          1HD1      LEU  48 -21.169  -8.652  -9.887
  388   HD12  LEU  48          2HD1      LEU  48 -21.458  -9.541  -8.392
  389   HD13  LEU  48          3HD1      LEU  48 -19.853  -8.896  -8.737
  390   HD21  LEU  48          3HD2      LEU  48 -22.999  -6.156  -7.858
  391   HD22  LEU  48          1HD2      LEU  48 -23.367  -7.881  -7.873
  392   HD23  LEU  48          2HD2      LEU  48 -22.993  -7.043  -9.381
  393    H    TYR  49           H        TYR  49 -17.569  -7.889  -8.038
  394    HA   TYR  49           HA       TYR  49 -16.594  -5.174  -7.662
  395    HB2  TYR  49           2HB      TYR  49 -14.674  -5.874  -9.010
  396    HB3  TYR  49           1HB      TYR  49 -14.979  -7.029  -7.718
  397    HD1  TYR  49           HD2      TYR  49 -16.085  -9.233  -8.281
  398    HD2  TYR  49           HD1      TYR  49 -14.713  -6.548 -11.293
  399    HE1  TYR  49           HE2      TYR  49 -16.162 -11.052  -9.932
  400    HE2  TYR  49           HE1      TYR  49 -14.789  -8.363 -12.951
  401    HH   TYR  49           HH       TYR  49 -16.346 -11.344 -12.336
  402    HA   PRO  50           HA       PRO  50 -18.412  -3.891 -11.620
  403    HB2  PRO  50           2HB      PRO  50 -18.368  -1.265 -11.175
  404    HB3  PRO  50           1HB      PRO  50 -19.503  -2.294 -10.291
  405    HG2  PRO  50           2HG      PRO  50 -16.908  -1.112  -9.376
  406    HG3  PRO  50           1HG      PRO  50 -18.435  -1.283  -8.492
  407    HD2  PRO  50           2HD      PRO  50 -16.248  -3.015  -8.301
  408    HD3  PRO  50           1HD      PRO  50 -17.904  -3.389  -7.788
  409    H    HIS  51           H        HIS  51 -17.528  -1.781 -13.047
  410    HA   HIS  51           HA       HIS  51 -14.810  -2.421 -13.734
  411    HB2  HIS  51           2HB      HIS  51 -16.537  -0.115 -14.693
  412    HB3  HIS  51           1HB      HIS  51 -15.007  -0.615 -15.406
  413    HD1  HIS  51           HD1      HIS  51 -15.023  -3.069 -16.533
  414    HD2  HIS  51           HD2      HIS  51 -18.738  -1.429 -15.656
  415    HE1  HIS  51           HE1      HIS  51 -16.675  -4.388 -17.879
  416    HE2  HIS  51           HE2      HIS  51 -18.920  -3.484 -17.209
  417    H    LEU  52           H        LEU  52 -13.658  -2.015 -11.803
  418    HA   LEU  52           HA       LEU  52 -13.161   0.840 -11.233
  419    HB2  LEU  52           2HB      LEU  52 -14.657  -0.069  -9.507
  420    HB3  LEU  52           1HB      LEU  52 -13.514  -1.359  -9.184
  421    HG   LEU  52           HG       LEU  52 -11.856   0.348  -8.430
  422   HD11  LEU  52          1HD1      LEU  52 -12.687   2.263  -9.677
  423   HD12  LEU  52          2HD1      LEU  52 -12.626   2.619  -7.951
  424   HD13  LEU  52          3HD1      LEU  52 -14.171   2.263  -8.723
  425   HD21  LEU  52          3HD2      LEU  52 -13.242  -0.841  -6.810
  426   HD22  LEU  52          1HD2      LEU  52 -14.506   0.379  -6.975
  427   HD23  LEU  52          2HD2      LEU  52 -12.943   0.816  -6.284
  428    H    TYR  53           H        TYR  53 -11.054   1.400 -10.880
  429    HA   TYR  53           HA       TYR  53  -9.039  -0.741 -10.646
  430    HB2  TYR  53           2HB      TYR  53  -8.835   1.643 -12.507
  431    HB3  TYR  53           1HB      TYR  53  -7.579   0.437 -12.246
  432    HD1  TYR  53           HD1      TYR  53  -7.855  -1.858 -13.120
  433    HD2  TYR  53           HD2      TYR  53 -10.753   1.166 -13.907
  434    HE1  TYR  53           HE1      TYR  53  -8.809  -3.240 -14.915
  435    HE2  TYR  53           HE2      TYR  53 -11.709  -0.214 -15.703
  436    HH   TYR  53           HH       TYR  53 -11.008  -2.025 -17.193
  437    H    SER  54           H        SER  54  -9.098  -0.128  -8.389
  438    HA   SER  54           HA       SER  54  -7.875   2.483  -7.760
  439    HB2  SER  54           2HB      SER  54  -8.758   2.110  -5.468
  440    HB3  SER  54           1HB      SER  54 -10.036   2.099  -6.685
  441    HG   SER  54           HG       SER  54  -8.781  -0.234  -5.652
  442    H    ARG  55           H        ARG  55  -5.935   2.608  -6.686
  443    HA   ARG  55           HA       ARG  55  -4.744   0.126  -5.645
  444    HB2  ARG  55           2HB      ARG  55  -2.598   0.555  -6.684
  445    HB3  ARG  55           1HB      ARG  55  -3.839   0.449  -7.920
  446    HG2  ARG  55           2HG      ARG  55  -2.854   3.085  -6.849
  447    HG3  ARG  55           1HG      ARG  55  -2.079   2.256  -8.197
  448    HD2  ARG  55           2HD      ARG  55  -4.157   2.334  -9.465
  449    HD3  ARG  55           1HD      ARG  55  -4.976   3.106  -8.108
  450    HE   ARG  55           HE       ARG  55  -2.769   4.675  -8.778
  451   HH11  ARG  55          1HH1      ARG  55  -5.801   3.748 -10.145
  452   HH12  ARG  55          2HH1      ARG  55  -5.921   5.181 -11.108
  453   HH21  ARG  55          1HH2      ARG  55  -2.955   6.510 -10.007
  454   HH22  ARG  55          2HH2      ARG  55  -4.341   6.719 -11.019
  455    H    ALA  56           H        ALA  56  -2.899   0.484  -4.200
  456    HA   ALA  56           HA       ALA  56  -3.375   2.865  -2.543
  457    HB1  ALA  56           3HB      ALA  56  -3.646   0.685  -1.469
  458    HB2  ALA  56           1HB      ALA  56  -2.318   1.590  -0.745
  459    HB3  ALA  56           2HB      ALA  56  -1.977   0.273  -1.868
  460    H    TYR  57           H        TYR  57  -1.513   3.888  -1.450
  461    HA   TYR  57           HA       TYR  57   1.017   3.707  -2.965
  462    HB2  TYR  57           2HB      TYR  57  -0.499   6.218  -2.227
  463    HB3  TYR  57           1HB      TYR  57   1.191   6.232  -2.720
  464    HD1  TYR  57           HD1      TYR  57  -2.232   5.316  -3.873
  465    HD2  TYR  57           HD2      TYR  57   1.773   6.211  -5.017
  466    HE1  TYR  57           HE1      TYR  57  -2.925   5.381  -6.229
  467    HE2  TYR  57           HE2      TYR  57   1.083   6.279  -7.376
  468    HH   TYR  57           HH       TYR  57  -0.611   5.561  -8.819
  469    H    ILE  58           H        ILE  58   2.919   4.353  -1.821
  470    HA   ILE  58           HA       ILE  58   2.655   4.542   1.115
  471    HB   ILE  58           HB       ILE  58   4.696   2.842  -0.354
  472   HG12  ILE  58          2HG1      ILE  58   2.330   2.000   1.352
  473   HG13  ILE  58          1HG1      ILE  58   2.439   1.841  -0.398
  474   HG21  ILE  58          1HG2      ILE  58   5.582   3.819   1.713
  475   HG22  ILE  58          2HG2      ILE  58   5.385   2.075   1.867
  476   HG23  ILE  58          3HG2      ILE  58   4.216   3.163   2.616
  477   HD11  ILE  58          3HD1      ILE  58   4.189   0.444   1.614
  478   HD12  ILE  58          1HD1      ILE  58   4.299   0.284  -0.138
  479   HD13  ILE  58          2HD1      ILE  58   2.857  -0.273   0.708
  480    H    ASN  59           H        ASN  59   4.350   5.706   2.192
  481    HA   ASN  59           HA       ASN  59   6.262   7.130   0.456
  482    HB2  ASN  59           2HB      ASN  59   4.286   8.570   1.038
  483    HB3  ASN  59           1HB      ASN  59   4.740   8.423   2.732
  484   HD21  ASN  59          1HD2      ASN  59   4.552  10.818   1.182
  485   HD22  ASN  59          2HD2      ASN  59   6.112  11.548   1.199
  486    H    PHE  60           H        PHE  60   8.286   6.825   1.106
  487    HA   PHE  60           HA       PHE  60   8.905   5.908   3.810
  488    HB2  PHE  60           2HB      PHE  60  10.495   6.136   1.257
  489    HB3  PHE  60           1HB      PHE  60  11.295   5.864   2.798
  490    HD1  PHE  60           HD2      PHE  60   8.778   4.428   0.466
  491    HD2  PHE  60           HD1      PHE  60  11.447   3.725   3.716
  492    HE1  PHE  60           HE2      PHE  60   8.431   2.001   0.232
  493    HE2  PHE  60           HE1      PHE  60  11.104   1.308   3.485
  494    HZ   PHE  60           HZ       PHE  60   9.595   0.437   1.739
  495    H    ARG  61           H        ARG  61  10.198   7.022   5.287
  496    HA   ARG  61           HA       ARG  61  10.874   9.816   4.625
  497    HB2  ARG  61           2HB      ARG  61  10.714   8.408   7.298
  498    HB3  ARG  61           1HB      ARG  61  11.236  10.074   7.088
  499    HG2  ARG  61           2HG      ARG  61   8.510   8.989   6.376
  500    HG3  ARG  61           1HG      ARG  61   8.905   9.902   7.833
  501    HD2  ARG  61           2HD      ARG  61   7.939  11.460   6.350
  502    HD3  ARG  61           1HD      ARG  61   9.673  11.768   6.286
  503    HE   ARG  61           HE       ARG  61   8.926   9.969   4.241
  504   HH11  ARG  61          1HH1      ARG  61   8.704  13.295   5.096
  505   HH12  ARG  61          2HH1      ARG  61   8.562  13.810   3.456
  506   HH21  ARG  61          1HH2      ARG  61   8.782  10.632   2.153
  507   HH22  ARG  61          2HH2      ARG  61   8.633  12.317   1.798
  508    H    ASN  62           H        ASN  62  12.262   6.763   5.656
  509    HA   ASN  62           HA       ASN  62  14.967   7.922   5.464
  510    HB2  ASN  62           2HB      ASN  62  14.279   7.084   7.718
  511    HB3  ASN  62           1HB      ASN  62  14.101   5.478   7.029
  512   HD21  ASN  62          1HD2      ASN  62  15.876   4.246   6.715
  513   HD22  ASN  62          2HD2      ASN  62  17.482   4.736   7.137
  514    HA   PRO  63           HA       PRO  63  15.453   5.357   1.870
  515    HB2  PRO  63           2HB      PRO  63  18.150   5.483   1.577
  516    HB3  PRO  63           1HB      PRO  63  17.083   6.850   1.232
  517    HG2  PRO  63           2HG      PRO  63  18.710   6.294   3.693
  518    HG3  PRO  63           1HG      PRO  63  18.520   7.816   2.800
  519    HD2  PRO  63           2HD      PRO  63  17.146   7.286   5.075
  520    HD3  PRO  63           1HD      PRO  63  16.466   8.269   3.763
  521    H    ASP  64           H        ASP  64  17.442   4.592   4.717
  522    HA   ASP  64           HA       ASP  64  18.545   2.176   3.826
  523    HB2  ASP  64           2HB      ASP  64  17.833   2.915   6.674
  524    HB3  ASP  64           1HB      ASP  64  19.008   1.701   6.172
  525    H    ASP  65           H        ASP  65  15.321   2.844   4.840
  526    HA   ASP  65           HA       ASP  65  14.651   0.130   5.551
  527    HB2  ASP  65           2HB      ASP  65  12.884   2.544   5.082
  528    HB3  ASP  65           1HB      ASP  65  12.362   1.012   5.786
  529    H    ILE  66           H        ILE  66  14.700   1.988   2.633
  530    HA   ILE  66           HA       ILE  66  12.671   0.719   1.157
  531    HB   ILE  66           HB       ILE  66  15.256   1.930   0.153
  532   HG12  ILE  66          2HG1      ILE  66  12.469   3.105   0.406
  533   HG13  ILE  66          1HG1      ILE  66  13.850   3.501   1.425
  534   HG21  ILE  66          1HG2      ILE  66  14.123   2.123  -2.017
  535   HG22  ILE  66          2HG2      ILE  66  12.730   1.259  -1.368
  536   HG23  ILE  66          3HG2      ILE  66  14.284   0.438  -1.521
  537   HD11  ILE  66          3HD1      ILE  66  13.638   4.024  -1.532
  538   HD12  ILE  66          1HD1      ILE  66  15.011   4.436  -0.504
  539   HD13  ILE  66          2HD1      ILE  66  13.451   5.215  -0.248
  540    H    LEU  67           H        LEU  67  16.181   0.020   1.189
  541    HA   LEU  67           HA       LEU  67  16.074  -2.217  -0.508
  542    HB2  LEU  67           2HB      LEU  67  18.309  -2.798   0.475
  543    HB3  LEU  67           1HB      LEU  67  18.168  -1.179  -0.174
  544    HG   LEU  67           HG       LEU  67  17.725  -0.459   2.280
  545   HD11  LEU  67          1HD1      LEU  67  17.449  -2.705   3.214
  546   HD12  LEU  67          2HD1      LEU  67  18.783  -1.842   3.974
  547   HD13  LEU  67          3HD1      LEU  67  19.113  -3.092   2.777
  548   HD21  LEU  67          3HD2      LEU  67  19.703   0.161   1.008
  549   HD22  LEU  67          1HD2      LEU  67  20.460  -1.384   1.401
  550   HD23  LEU  67          2HD2      LEU  67  20.124  -0.214   2.678
  551    H    LEU  68           H        LEU  68  15.401  -1.917   2.885
  552    HA   LEU  68           HA       LEU  68  15.444  -4.703   3.517
  553    HB2  LEU  68           2HB      LEU  68  15.698  -3.228   5.337
  554    HB3  LEU  68           1HB      LEU  68  14.332  -2.244   4.846
  555    HG   LEU  68           HG       LEU  68  12.789  -4.052   5.501
  556   HD11  LEU  68          1HD1      LEU  68  13.627  -5.966   6.805
  557   HD12  LEU  68          2HD1      LEU  68  15.284  -5.468   6.465
  558   HD13  LEU  68          3HD1      LEU  68  14.229  -5.982   5.148
  559   HD21  LEU  68          3HD2      LEU  68  14.715  -3.243   7.687
  560   HD22  LEU  68          1HD2      LEU  68  13.065  -3.828   7.920
  561   HD23  LEU  68          2HD2      LEU  68  13.350  -2.293   7.100
  562    H    PHE  69           H        PHE  69  12.720  -2.417   3.098
  563    HA   PHE  69           HA       PHE  69  10.776  -4.461   3.354
  564    HB2  PHE  69           2HB      PHE  69  10.704  -1.561   2.666
  565    HB3  PHE  69           1HB      PHE  69   9.253  -2.532   2.411
  566    HD1  PHE  69           HD1      PHE  69  11.546  -1.127   4.917
  567    HD2  PHE  69           HD2      PHE  69   8.068  -3.509   4.289
  568    HE1  PHE  69           HE1      PHE  69  11.010  -0.982   7.313
  569    HE2  PHE  69           HE2      PHE  69   7.530  -3.361   6.678
  570    HZ   PHE  69           HZ       PHE  69   9.002  -2.096   8.197
  571    H    ARG  70           H        ARG  70  12.400  -3.181   0.500
  572    HA   ARG  70           HA       ARG  70  10.618  -4.377  -1.380
  573    HB2  ARG  70           2HB      ARG  70  12.397  -4.163  -3.019
  574    HB3  ARG  70           1HB      ARG  70  12.308  -2.699  -2.053
  575    HG2  ARG  70           2HG      ARG  70  14.311  -3.137  -0.958
  576    HG3  ARG  70           1HG      ARG  70  14.250  -4.860  -1.326
  577    HD2  ARG  70           2HD      ARG  70  15.965  -3.656  -2.636
  578    HD3  ARG  70           1HD      ARG  70  14.748  -4.432  -3.647
  579    HE   ARG  70           HE       ARG  70  14.927  -1.540  -3.110
  580   HH11  ARG  70          1HH1      ARG  70  13.812  -4.186  -5.021
  581   HH12  ARG  70          2HH1      ARG  70  13.244  -3.169  -6.298
  582   HH21  ARG  70          1HH2      ARG  70  14.206  -0.246  -4.746
  583   HH22  ARG  70          2HH2      ARG  70  13.453  -0.948  -6.137
  584    H    ASP  71           H        ASP  71  13.372  -5.555   0.448
  585    HA   ASP  71           HA       ASP  71  13.724  -8.009  -0.931
  586    HB2  ASP  71           2HB      ASP  71  15.476  -6.932   0.434
  587    HB3  ASP  71           1HB      ASP  71  14.518  -7.210   1.884
  588    H    ARG  72           H        ARG  72  12.061  -7.178   2.102
  589    HA   ARG  72           HA       ARG  72  11.197  -9.917   2.506
  590    HB2  ARG  72           2HB      ARG  72  10.146  -9.005   4.576
  591    HB3  ARG  72           1HB      ARG  72  11.873  -8.687   4.451
  592    HG2  ARG  72           2HG      ARG  72  11.438  -6.399   3.768
  593    HG3  ARG  72           1HG      ARG  72   9.700  -6.701   3.780
  594    HD2  ARG  72           2HD      ARG  72  11.515  -6.891   6.188
  595    HD3  ARG  72           1HD      ARG  72  10.491  -5.508   5.798
  596    HE   ARG  72           HE       ARG  72   9.079  -8.018   5.996
  597   HH11  ARG  72          1HH1      ARG  72  10.235  -5.281   7.743
  598   HH12  ARG  72          2HH1      ARG  72   9.045  -5.432   8.985
  599   HH21  ARG  72          1HH2      ARG  72   7.570  -8.208   7.594
  600   HH22  ARG  72          2HH2      ARG  72   7.560  -7.092   8.913
  601    H    PHE  73           H        PHE  73  10.046  -7.936   0.310
  602    HA   PHE  73           HA       PHE  73   7.305  -8.913   0.632
  603    HB2  PHE  73           2HB      PHE  73   8.046  -6.005   0.327
  604    HB3  PHE  73           1HB      PHE  73   6.479  -6.606  -0.204
  605    HD1  PHE  73           HD1      PHE  73   5.049  -7.842   1.522
  606    HD2  PHE  73           HD2      PHE  73   8.361  -5.386   2.581
  607    HE1  PHE  73           HE1      PHE  73   4.153  -7.623   3.797
  608    HE2  PHE  73           HE2      PHE  73   7.469  -5.170   4.862
  609    HZ   PHE  73           HZ       PHE  73   5.365  -6.285   5.474
  610    H    ASP  74           H        ASP  74   9.341  -6.973  -1.560
  611    HA   ASP  74           HA       ASP  74   9.273  -6.624  -3.785
  612    HB2  ASP  74           2HB      ASP  74   9.877  -8.564  -5.147
  613    HB3  ASP  74           1HB      ASP  74  10.782  -8.499  -3.646
  614    H    GLY  75           H        GLY  75   7.155  -9.526  -3.689
  615    HA2  GLY  75           2HA      GLY  75   4.891  -8.002  -4.640
  616    HA3  GLY  75           1HA      GLY  75   5.576  -9.078  -5.850
  617    H    TYR  76           H        TYR  76   4.789  -9.257  -2.381
  618    HA   TYR  76           HA       TYR  76   4.371 -12.076  -2.479
  619    HB2  TYR  76           2HB      TYR  76   3.991 -11.961  -0.146
  620    HB3  TYR  76           1HB      TYR  76   5.188 -10.717  -0.484
  621    HD1  TYR  76           HD1      TYR  76   4.264  -8.283  -0.808
  622    HD2  TYR  76           HD2      TYR  76   2.081 -11.423   1.072
  623    HE1  TYR  76           HE1      TYR  76   2.822  -6.623   0.303
  624    HE2  TYR  76           HE2      TYR  76   0.643  -9.769   2.178
  625    HH   TYR  76           HH       TYR  76   0.592  -6.490   1.292
  626    H    ILE  77           H        ILE  77   2.435 -13.215  -1.867
  627    HA   ILE  77           HA       ILE  77   0.018 -12.049  -3.030
  628    HB   ILE  77           HB       ILE  77   0.602 -14.871  -2.102
  629   HG12  ILE  77          2HG1      ILE  77   1.873 -14.195  -4.109
  630   HG13  ILE  77          1HG1      ILE  77   0.676 -15.428  -4.487
  631   HG21  ILE  77          1HG2      ILE  77  -1.766 -14.419  -1.879
  632   HG22  ILE  77          2HG2      ILE  77  -1.494 -15.483  -3.257
  633   HG23  ILE  77          3HG2      ILE  77  -1.828 -13.774  -3.521
  634   HD11  ILE  77          3HD1      ILE  77  -0.795 -13.727  -5.419
  635   HD12  ILE  77          1HD1      ILE  77   0.782 -13.712  -6.205
  636   HD13  ILE  77          2HD1      ILE  77   0.381 -12.478  -5.012
  637    H    PHE  78           H        PHE  78  -1.094 -10.813  -1.613
  638    HA   PHE  78           HA       PHE  78  -1.471 -11.652   1.156
  639    HB2  PHE  78           2HB      PHE  78  -1.118  -9.303   0.864
  640    HB3  PHE  78           1HB      PHE  78  -2.331  -9.207  -0.407
  641    HD1  PHE  78           HD1      PHE  78  -2.294 -10.545   3.096
  642    HD2  PHE  78           HD2      PHE  78  -4.169  -7.982   0.253
  643    HE1  PHE  78           HE1      PHE  78  -3.996  -9.940   4.763
  644    HE2  PHE  78           HE2      PHE  78  -5.871  -7.377   1.919
  645    HZ   PHE  78           HZ       PHE  78  -5.787  -8.355   4.177
  646    H    LEU  79           H        LEU  79  -3.147 -12.897   1.787
  647    HA   LEU  79           HA       LEU  79  -5.290 -13.418  -0.146
  648    HB2  LEU  79           2HB      LEU  79  -4.267 -14.920   2.246
  649    HB3  LEU  79           1HB      LEU  79  -5.791 -15.338   1.482
  650    HG   LEU  79           HG       LEU  79  -3.153 -15.276   0.000
  651   HD11  LEU  79          1HD1      LEU  79  -4.575 -17.646   1.218
  652   HD12  LEU  79          2HD1      LEU  79  -3.044 -16.958   1.765
  653   HD13  LEU  79          3HD1      LEU  79  -3.154 -17.716   0.176
  654   HD21  LEU  79          3HD2      LEU  79  -4.360 -16.590  -1.670
  655   HD22  LEU  79          1HD2      LEU  79  -5.130 -15.025  -1.410
  656   HD23  LEU  79          2HD2      LEU  79  -5.832 -16.481  -0.703
  657    H    ASP  80           H        ASP  80  -7.305 -12.791   0.113
  658    HA   ASP  80           HA       ASP  80  -8.167 -11.209   2.345
  659    HB2  ASP  80           2HB      ASP  80  -8.904 -10.977  -0.093
  660    HB3  ASP  80           1HB      ASP  80  -9.899 -12.401   0.163
  661    H    SER  81           H        SER  81 -10.383 -11.742   3.382
  662    HA   SER  81           HA       SER  81 -10.351 -14.206   4.758
  663    HB2  SER  81           2HB      SER  81 -12.645 -12.263   4.351
  664    HB3  SER  81           1HB      SER  81 -12.610 -13.561   5.547
  665    HG   SER  81           HG       SER  81 -11.981 -11.542   6.436
  666    H    LYS  82           H        LYS  82 -11.818 -13.226   1.740
  667    HA   LYS  82           HA       LYS  82 -13.266 -15.724   1.397
  668    HB2  LYS  82           2HB      LYS  82 -12.913 -13.222  -0.197
  669    HB3  LYS  82           1HB      LYS  82 -13.376 -14.681  -1.058
  670    HG2  LYS  82           2HG      LYS  82 -14.883 -13.506   1.279
  671    HG3  LYS  82           1HG      LYS  82 -15.299 -13.274  -0.423
  672    HD2  LYS  82           2HD      LYS  82 -15.503 -15.760  -0.641
  673    HD3  LYS  82           1HD      LYS  82 -15.264 -15.886   1.102
  674    HE2  LYS  82           2HE      LYS  82 -17.506 -14.392  -0.265
  675    HE3  LYS  82           1HE      LYS  82 -17.640 -15.977   0.492
  676    HZ1  LYS  82           3HZ      LYS  82 -17.031 -13.410   1.845
  677    HZ2  LYS  82           1HZ      LYS  82 -16.992 -14.919   2.609
  678    HZ3  LYS  82           2HZ      LYS  82 -18.446 -14.320   1.988
  679    H    GLY  83           H        GLY  83 -10.073 -15.080   1.328
  680    HA2  GLY  83           2HA      GLY  83  -8.299 -16.353   0.578
  681    HA3  GLY  83           1HA      GLY  83  -9.447 -17.417  -0.216
  682    H    LEU  84           H        LEU  84  -9.325 -13.965  -0.847
  683    HA   LEU  84           HA       LEU  84  -8.739 -14.473  -3.649
  684    HB2  LEU  84           2HB      LEU  84  -9.281 -11.876  -2.192
  685    HB3  LEU  84           1HB      LEU  84  -9.154 -12.057  -3.933
  686    HG   LEU  84           HG       LEU  84 -11.289 -13.300  -2.186
  687   HD11  LEU  84          1HD1      LEU  84 -11.558 -10.889  -2.409
  688   HD12  LEU  84          2HD1      LEU  84 -12.801 -11.741  -3.323
  689   HD13  LEU  84          3HD1      LEU  84 -11.428 -11.021  -4.163
  690   HD21  LEU  84          3HD2      LEU  84 -10.756 -14.720  -4.093
  691   HD22  LEU  84          1HD2      LEU  84 -10.931 -13.347  -5.185
  692   HD23  LEU  84          2HD2      LEU  84 -12.334 -13.963  -4.310
  693    H    GLU  85           H        GLU  85  -6.828 -14.145  -4.650
  694    HA   GLU  85           HA       GLU  85  -4.500 -13.527  -3.046
  695    HB2  GLU  85           2HB      GLU  85  -4.752 -14.258  -5.973
  696    HB3  GLU  85           1HB      GLU  85  -3.235 -14.125  -5.089
  697    HG2  GLU  85           2HG      GLU  85  -3.858 -15.979  -3.666
  698    HG3  GLU  85           1HG      GLU  85  -5.443 -16.073  -4.433
  699    H    TYR  86           H        TYR  86  -4.104 -11.416  -2.656
  700    HA   TYR  86           HA       TYR  86  -4.204  -9.483  -4.871
  701    HB2  TYR  86           2HB      TYR  86  -3.652  -8.957  -1.940
  702    HB3  TYR  86           1HB      TYR  86  -3.949  -7.751  -3.186
  703    HD1  TYR  86           HD1      TYR  86  -6.299  -7.998  -4.414
  704    HD2  TYR  86           HD2      TYR  86  -5.407  -9.574  -0.565
  705    HE1  TYR  86           HE1      TYR  86  -8.700  -8.027  -3.874
  706    HE2  TYR  86           HE2      TYR  86  -7.794  -9.601  -0.014
  707    HH   TYR  86           HH       TYR  86  -9.859  -8.707  -0.651
  708    HA   PRO  87           HA       PRO  87   0.295 -10.352  -4.900
  709    HB2  PRO  87           2HB      PRO  87   0.747  -9.627  -7.461
  710    HB3  PRO  87           1HB      PRO  87   0.042 -11.191  -7.034
  711    HG2  PRO  87           2HG      PRO  87  -1.315  -8.704  -8.012
  712    HG3  PRO  87           1HG      PRO  87  -1.620 -10.393  -8.456
  713    HD2  PRO  87           2HD      PRO  87  -3.143  -8.985  -6.656
  714    HD3  PRO  87           1HD      PRO  87  -2.977 -10.753  -6.640
  715    H    ALA  88           H        ALA  88   0.847  -8.687  -3.467
  716    HA   ALA  88           HA       ALA  88   0.625  -5.911  -4.305
  717    HB1  ALA  88           3HB      ALA  88   1.663  -7.090  -1.728
  718    HB2  ALA  88           1HB      ALA  88   0.013  -6.542  -2.025
  719    HB3  ALA  88           2HB      ALA  88   1.343  -5.383  -2.032
  720    H    VAL  89           H        VAL  89   2.144  -5.492  -5.876
  721    HA   VAL  89           HA       VAL  89   4.939  -6.252  -5.421
  722    HB   VAL  89           HB       VAL  89   3.610  -5.023  -7.847
  723   HG11  VAL  89          1HG1      VAL  89   6.446  -6.016  -7.510
  724   HG12  VAL  89          2HG1      VAL  89   5.947  -4.339  -7.726
  725   HG13  VAL  89          3HG1      VAL  89   5.711  -5.502  -9.030
  726   HG21  VAL  89          3HG2      VAL  89   2.913  -7.325  -7.444
  727   HG22  VAL  89          1HG2      VAL  89   4.598  -7.835  -7.341
  728   HG23  VAL  89          2HG2      VAL  89   3.951  -7.233  -8.866
  729    H    VAL  90           H        VAL  90   6.234  -4.887  -4.384
  730    HA   VAL  90           HA       VAL  90   5.601  -2.034  -4.271
  731    HB   VAL  90           HB       VAL  90   6.077  -3.153  -2.158
  732   HG11  VAL  90          1HG1      VAL  90   7.575  -4.912  -2.945
  733   HG12  VAL  90          2HG1      VAL  90   8.300  -4.019  -1.609
  734   HG13  VAL  90          3HG1      VAL  90   8.833  -3.715  -3.263
  735   HG21  VAL  90          3HG2      VAL  90   8.256  -1.207  -2.920
  736   HG22  VAL  90          1HG2      VAL  90   7.774  -1.616  -1.273
  737   HG23  VAL  90          2HG2      VAL  90   6.642  -0.792  -2.344
  738    H    GLU  91           H        GLU  91   6.609  -0.552  -5.509
  739    HA   GLU  91           HA       GLU  91   9.306  -1.056  -6.535
  740    HB2  GLU  91           2HB      GLU  91   8.665  -0.555  -8.849
  741    HB3  GLU  91           1HB      GLU  91   7.845  -1.994  -8.255
  742    HG2  GLU  91           2HG      GLU  91   5.798  -0.760  -7.945
  743    HG3  GLU  91           1HG      GLU  91   6.600   0.754  -8.366
  744    H    PHE  92           H        PHE  92  10.062   0.888  -7.893
  745    HA   PHE  92           HA       PHE  92   9.699   3.249  -6.250
  746    HB2  PHE  92           2HB      PHE  92  11.951   2.607  -6.874
  747    HB3  PHE  92           1HB      PHE  92  11.533   2.646  -8.582
  748    HD1  PHE  92           HD2      PHE  92  11.596   4.878  -5.586
  749    HD2  PHE  92           HD1      PHE  92  12.072   4.542  -9.809
  750    HE1  PHE  92           HE2      PHE  92  12.317   7.226  -5.692
  751    HE2  PHE  92           HE1      PHE  92  12.793   6.892  -9.916
  752    HZ   PHE  92           HZ       PHE  92  12.916   8.238  -7.856
  753    H    ALA  93           H        ALA  93   8.912   5.233  -6.894
  754    HA   ALA  93           HA       ALA  93   7.345   5.292  -9.388
  755    HB1  ALA  93           3HB      ALA  93   6.059   7.088  -8.354
  756    HB2  ALA  93           1HB      ALA  93   7.131   7.068  -6.951
  757    HB3  ALA  93           2HB      ALA  93   6.107   5.676  -7.299
  758    HA   PRO  94           HA       PRO  94  10.095   7.973 -11.575
  759    HB2  PRO  94           2HB      PRO  94   7.619   9.560 -12.169
  760    HB3  PRO  94           1HB      PRO  94   8.876   8.978 -13.269
  761    HG2  PRO  94           2HG      PRO  94   6.549   7.717 -13.131
  762    HG3  PRO  94           1HG      PRO  94   8.060   6.796 -13.262
  763    HD2  PRO  94           2HD      PRO  94   6.300   7.227 -10.884
  764    HD3  PRO  94           1HD      PRO  94   7.256   5.802 -11.340
  765    H    PHE  95           H        PHE  95  11.435   9.455 -10.756
  766    HA   PHE  95           HA       PHE  95  10.497  11.377  -8.768
  767    HB2  PHE  95           2HB      PHE  95  12.495  10.079  -8.237
  768    HB3  PHE  95           1HB      PHE  95  13.290  10.649  -9.698
  769    HD1  PHE  95           HD1      PHE  95  11.599  12.106  -6.694
  770    HD2  PHE  95           HD2      PHE  95  14.873  12.297  -9.412
  771    HE1  PHE  95           HE1      PHE  95  12.551  13.977  -5.414
  772    HE2  PHE  95           HE2      PHE  95  15.826  14.170  -8.137
  773    HZ   PHE  95           HZ       PHE  95  14.668  15.012  -6.133
  774    H    GLN  96           H        GLN  96   9.447  12.981  -9.904
  775    HA   GLN  96           HA       GLN  96  10.803  14.307 -12.128
  776    HB2  GLN  96           2HB      GLN  96   8.030  14.646 -10.968
  777    HB3  GLN  96           1HB      GLN  96   8.652  15.602 -12.304
  778    HG2  GLN  96           2HG      GLN  96   8.647  12.614 -12.484
  779    HG3  GLN  96           1HG      GLN  96   7.161  13.515 -12.758
  780   HE21  GLN  96          1HE2      GLN  96  10.281  14.822 -13.708
  781   HE22  GLN  96          2HE2      GLN  96  10.031  14.656 -15.401
  782    H    LYS  97           H        LYS  97  10.226  16.855 -12.089
  783    HA   LYS  97           HA       LYS  97  11.905  17.857  -9.956
  784    HB2  LYS  97           2HB      LYS  97  10.802  19.063 -12.481
  785    HB3  LYS  97           1HB      LYS  97  11.573  20.071 -11.265
  786    HG2  LYS  97           2HG      LYS  97  13.161  19.499 -12.984
  787    HG3  LYS  97           1HG      LYS  97  13.624  18.734 -11.465
  788    HD2  LYS  97           2HD      LYS  97  12.540  16.626 -12.292
  789    HD3  LYS  97           1HD      LYS  97  12.301  17.424 -13.849
  790    HE2  LYS  97           2HE      LYS  97  14.956  16.911 -12.493
  791    HE3  LYS  97           1HE      LYS  97  14.309  16.032 -13.880
  792    HZ1  LYS  97           3HZ      LYS  97  14.350  18.118 -15.137
  793    HZ2  LYS  97           1HZ      LYS  97  15.891  17.675 -14.599
  794    HZ3  LYS  97           2HZ      LYS  97  15.046  18.908 -13.812
  Start of MODEL    8
    1    H1   MET   1           1H       MET   1  37.697  17.764  11.653
    2    H2   MET   1           2H       MET   1  36.638  18.029  12.945
    3    H3   MET   1           3H       MET   1  36.862  19.230  11.778
    4    HA   MET   1           HA       MET   1  34.763  18.129  11.430
    5    HB2  MET   1           2HB      MET   1  36.866  17.444   9.363
    6    HB3  MET   1           1HB      MET   1  35.134  17.393   9.072
    7    HG2  MET   1           2HG      MET   1  34.972  19.783   9.471
    8    HG3  MET   1           1HG      MET   1  36.692  19.855   9.840
    9    HE1  MET   1           3HE      MET   1  38.003  17.959   7.708
   10    HE2  MET   1           1HE      MET   1  38.618  19.578   8.052
   11    HE3  MET   1           2HE      MET   1  38.331  19.079   6.385
   12    H    GLY   2           H        GLY   2  33.679  16.133  10.597
   13    HA2  GLY   2           2HA      GLY   2  35.076  13.611  11.052
   14    HA3  GLY   2           1HA      GLY   2  33.776  13.969  12.175
   15    H    HIS   3           H        HIS   3  31.601  14.393  11.174
   16    HA   HIS   3           HA       HIS   3  31.226  12.731   8.758
   17    HB2  HIS   3           2HB      HIS   3  29.536  12.584  11.269
   18    HB3  HIS   3           1HB      HIS   3  29.309  11.636   9.802
   19    HD1  HIS   3           HD1      HIS   3  31.371  11.844  12.894
   20    HD2  HIS   3           HD2      HIS   3  31.155   9.522   9.455
   21    HE1  HIS   3           HE1      HIS   3  32.812   9.843  13.346
   22    HE2  HIS   3           HE2      HIS   3  32.626   8.428  11.280
   23    H    HIS   4           H        HIS   4  29.865  13.545   7.268
   24    HA   HIS   4           HA       HIS   4  27.949  15.655   8.076
   25    HB2  HIS   4           2HB      HIS   4  29.217  15.168   5.361
   26    HB3  HIS   4           1HB      HIS   4  27.984  16.382   5.690
   27    HD1  HIS   4           HD1      HIS   4  31.360  16.360   5.052
   28    HD2  HIS   4           HD2      HIS   4  29.142  17.976   8.172
   29    HE1  HIS   4           HE1      HIS   4  32.802  18.158   6.042
   30    HE2  HIS   4           HE2      HIS   4  31.383  19.218   7.827
   31    H    HIS   5           H        HIS   5  26.050  14.639   8.436
   32    HA   HIS   5           HA       HIS   5  25.454  12.140   7.080
   33    HB2  HIS   5           2HB      HIS   5  23.966  13.613   9.264
   34    HB3  HIS   5           1HB      HIS   5  23.544  12.013   8.660
   35    HD1  HIS   5           HD1      HIS   5  25.483  13.645  11.225
   36    HD2  HIS   5           HD2      HIS   5  25.778  10.081   9.102
   37    HE1  HIS   5           HE1      HIS   5  27.009  12.178  12.577
   38    HE2  HIS   5           HE2      HIS   5  27.266  10.080  11.218
   39    H    HIS   6           H        HIS   6  24.230  11.941   5.336
   40    HA   HIS   6           HA       HIS   6  21.847  13.621   5.023
   41    HB2  HIS   6           2HB      HIS   6  23.977  13.223   2.913
   42    HB3  HIS   6           1HB      HIS   6  22.327  13.666   2.495
   43    HD1  HIS   6           HD1      HIS   6  21.590  16.080   2.965
   44    HD2  HIS   6           HD2      HIS   6  25.488  15.261   4.162
   45    HE1  HIS   6           HE1      HIS   6  22.628  18.311   3.451
   46    HE2  HIS   6           HE2      HIS   6  24.953  17.794   4.246
   47    H    HIS   7           H        HIS   7  20.145  12.622   3.813
   48    HA   HIS   7           HA       HIS   7  20.523   9.746   3.260
   49    HB2  HIS   7           2HB      HIS   7  18.334  11.029   4.899
   50    HB3  HIS   7           1HB      HIS   7  18.168   9.422   4.197
   51    HD1  HIS   7           HD1      HIS   7  19.342  11.084   7.186
   52    HD2  HIS   7           HD2      HIS   7  20.304   7.603   5.133
   53    HE1  HIS   7           HE1      HIS   7  20.595   9.660   8.825
   54    HE2  HIS   7           HE2      HIS   7  20.973   7.483   7.624
   55    H    HIS   8           H        HIS   8  20.042   9.301   1.217
   56    HA   HIS   8           HA       HIS   8  18.611  11.091  -0.483
   57    HB2  HIS   8           2HB      HIS   8  19.425   8.206  -0.943
   58    HB3  HIS   8           1HB      HIS   8  18.846   9.307  -2.188
   59    HD1  HIS   8           HD1      HIS   8  21.896   8.299  -0.369
   60    HD2  HIS   8           HD2      HIS   8  20.679  11.464  -2.777
   61    HE1  HIS   8           HE1      HIS   8  24.000   9.463  -1.071
   62    HE2  HIS   8           HE2      HIS   8  23.233  11.469  -2.371
   63    H    SER   9           H        SER   9  16.487  11.412  -0.207
   64    HA   SER   9           HA       SER   9  14.765   9.208   0.709
   65    HB2  SER   9           2HB      SER   9  14.169  12.180   0.541
   66    HB3  SER   9           1HB      SER   9  13.171  10.955   1.327
   67    HG   SER   9           HG       SER   9  15.802  11.746   2.073
   68    H    HIS  10           H        HIS  10  13.432   8.190  -0.679
   69    HA   HIS  10           HA       HIS  10  12.399   9.650  -3.017
   70    HB2  HIS  10           2HB      HIS  10  13.625   6.880  -3.080
   71    HB3  HIS  10           1HB      HIS  10  12.713   7.592  -4.410
   72    HD1  HIS  10           HD1      HIS  10  16.041   6.988  -3.559
   73    HD2  HIS  10           HD2      HIS  10  14.038  10.345  -4.979
   74    HE1  HIS  10           HE1      HIS  10  17.812   8.465  -4.543
   75    HE2  HIS  10           HE2      HIS  10  16.602  10.562  -5.227
   76    H    MET  11           H        MET  11  10.326   9.164  -3.628
   77    HA   MET  11           HA       MET  11   8.710   7.786  -1.671
   78    HB2  MET  11           2HB      MET  11   6.789   8.508  -3.100
   79    HB3  MET  11           1HB      MET  11   7.813   9.824  -2.548
   80    HG2  MET  11           2HG      MET  11   8.867   9.960  -4.728
   81    HG3  MET  11           1HG      MET  11   7.933   8.575  -5.290
   82    HE1  MET  11           3HE      MET  11   6.605  11.404  -2.940
   83    HE2  MET  11           1HE      MET  11   5.938  12.564  -4.086
   84    HE3  MET  11           2HE      MET  11   7.684  12.316  -3.994
   85    H    VAL  12           H        VAL  12   9.111   5.614  -1.765
   86    HA   VAL  12           HA       VAL  12   8.707   4.170  -4.269
   87    HB   VAL  12           HB       VAL  12   9.344   3.091  -1.510
   88   HG11  VAL  12          1HG1      VAL  12   9.405   1.727  -4.206
   89   HG12  VAL  12          2HG1      VAL  12   8.268   1.411  -2.896
   90   HG13  VAL  12          3HG1      VAL  12   9.975   1.026  -2.690
   91   HG21  VAL  12          3HG2      VAL  12  11.637   2.811  -2.368
   92   HG22  VAL  12          1HG2      VAL  12  11.146   4.504  -2.320
   93   HG23  VAL  12          2HG2      VAL  12  11.172   3.636  -3.857
   94    H    VAL  13           H        VAL  13   6.828   3.268  -4.848
   95    HA   VAL  13           HA       VAL  13   4.604   3.298  -2.907
   96    HB   VAL  13           HB       VAL  13   3.087   3.502  -4.827
   97   HG11  VAL  13          1HG1      VAL  13   3.891   5.542  -3.766
   98   HG12  VAL  13          2HG1      VAL  13   3.668   5.795  -5.496
   99   HG13  VAL  13          3HG1      VAL  13   5.290   5.573  -4.839
  100   HG21  VAL  13          3HG2      VAL  13   5.603   3.599  -6.510
  101   HG22  VAL  13          1HG2      VAL  13   3.967   3.921  -7.092
  102   HG23  VAL  13          2HG2      VAL  13   4.397   2.312  -6.512
  103    H    ILE  14           H        ILE  14   2.723   1.790  -4.042
  104    HA   ILE  14           HA       ILE  14   3.916  -0.898  -4.320
  105    HB   ILE  14           HB       ILE  14   2.689  -0.377  -2.140
  106   HG12  ILE  14          2HG1      ILE  14   1.385  -2.588  -2.217
  107   HG13  ILE  14          1HG1      ILE  14   1.916  -2.713  -3.892
  108   HG21  ILE  14          1HG2      ILE  14   0.267  -0.530  -3.926
  109   HG22  ILE  14          2HG2      ILE  14   0.836   0.895  -3.055
  110   HG23  ILE  14          3HG2      ILE  14   0.248  -0.509  -2.163
  111   HD11  ILE  14          3HD1      ILE  14   3.711  -2.532  -1.480
  112   HD12  ILE  14          1HD1      ILE  14   4.242  -2.684  -3.157
  113   HD13  ILE  14          2HD1      ILE  14   3.339  -3.993  -2.393
  114    H    ARG  15           H        ARG  15   2.676  -2.419  -5.668
  115    HA   ARG  15           HA       ARG  15   0.921  -1.110  -7.646
  116    HB2  ARG  15           2HB      ARG  15   3.238  -1.024  -8.484
  117    HB3  ARG  15           1HB      ARG  15   3.372  -2.766  -8.301
  118    HG2  ARG  15           2HG      ARG  15   3.002  -2.366 -10.596
  119    HG3  ARG  15           1HG      ARG  15   1.476  -2.975  -9.957
  120    HD2  ARG  15           2HD      ARG  15   0.962  -1.146 -11.397
  121    HD3  ARG  15           1HD      ARG  15   0.718  -0.590  -9.741
  122    HE   ARG  15           HE       ARG  15   3.338   0.029 -10.560
  123   HH11  ARG  15          1HH1      ARG  15   0.080   0.992 -11.145
  124   HH12  ARG  15          2HH1      ARG  15   0.531   2.592 -11.621
  125   HH21  ARG  15          1HH2      ARG  15   3.893   2.076 -11.179
  126   HH22  ARG  15          2HH2      ARG  15   2.658   3.191 -11.657
  127    H    ARG  16           H        ARG  16  -0.411  -2.505  -8.880
  128    HA   ARG  16           HA       ARG  16  -1.422  -4.392  -9.631
  129    HB2  ARG  16           2HB      ARG  16   0.592  -5.858  -7.921
  130    HB3  ARG  16           1HB      ARG  16  -0.602  -6.661  -8.933
  131    HG2  ARG  16           2HG      ARG  16   1.500  -4.750  -9.948
  132    HG3  ARG  16           1HG      ARG  16   1.638  -6.507  -9.970
  133    HD2  ARG  16           2HD      ARG  16  -0.579  -4.974 -11.333
  134    HD3  ARG  16           1HD      ARG  16   0.905  -5.484 -12.135
  135    HE   ARG  16           HE       ARG  16   0.166  -7.819 -11.400
  136   HH11  ARG  16          1HH1      ARG  16  -2.016  -5.291 -12.231
  137   HH12  ARG  16          2HH1      ARG  16  -3.229  -6.385 -12.794
  138   HH21  ARG  16          1HH2      ARG  16  -1.406  -9.203 -12.125
  139   HH22  ARG  16          2HH2      ARG  16  -2.895  -8.558 -12.737
  140    H    LEU  17           H        LEU  17  -1.916  -3.015  -6.868
  141    HA   LEU  17           HA       LEU  17  -3.392  -4.993  -5.394
  142    HB2  LEU  17           2HB      LEU  17  -3.230  -1.990  -5.233
  143    HB3  LEU  17           1HB      LEU  17  -4.363  -2.894  -4.251
  144    HG   LEU  17           HG       LEU  17  -2.383  -2.349  -2.969
  145   HD11  LEU  17          1HD1      LEU  17  -3.526  -4.455  -2.480
  146   HD12  LEU  17          2HD1      LEU  17  -1.797  -4.567  -2.159
  147   HD13  LEU  17          3HD1      LEU  17  -2.471  -5.297  -3.617
  148   HD21  LEU  17          3HD2      LEU  17  -0.750  -2.149  -4.746
  149   HD22  LEU  17          1HD2      LEU  17  -0.848  -3.881  -5.068
  150   HD23  LEU  17          2HD2      LEU  17  -0.186  -3.305  -3.539
  151    HA   PRO  18           HA       PRO  18  -7.047  -4.423  -8.029
  152    HB2  PRO  18           2HB      PRO  18  -8.145  -6.827  -7.626
  153    HB3  PRO  18           1HB      PRO  18  -6.690  -6.647  -8.613
  154    HG2  PRO  18           2HG      PRO  18  -6.967  -7.611  -5.799
  155    HG3  PRO  18           1HG      PRO  18  -5.881  -8.181  -7.081
  156    HD2  PRO  18           2HD      PRO  18  -5.202  -6.406  -5.018
  157    HD3  PRO  18           1HD      PRO  18  -4.273  -6.676  -6.503
  158    HA   PRO  19           HA       PRO  19 -10.116  -3.037  -5.076
  159    HB2  PRO  19           2HB      PRO  19 -12.141  -4.190  -6.938
  160    HB3  PRO  19           1HB      PRO  19 -12.001  -2.546  -6.300
  161    HG2  PRO  19           2HG      PRO  19 -11.336  -3.076  -8.826
  162    HG3  PRO  19           1HG      PRO  19 -10.372  -1.945  -7.856
  163    HD2  PRO  19           2HD      PRO  19  -9.792  -4.798  -8.578
  164    HD3  PRO  19           1HD      PRO  19  -8.691  -3.405  -8.513
  165    H    GLY  20           H        GLY  20 -10.371  -4.129  -3.206
  166    HA2  GLY  20           2HA      GLY  20 -12.125  -6.440  -3.127
  167    HA3  GLY  20           1HA      GLY  20 -10.463  -6.767  -2.665
  168    H    LEU  21           H        LEU  21  -9.835  -6.333  -0.611
  169    HA   LEU  21           HA       LEU  21 -11.779  -5.773   1.361
  170    HB2  LEU  21           2HB      LEU  21 -10.043  -5.939   2.975
  171    HB3  LEU  21           1HB      LEU  21  -9.723  -7.133   1.734
  172    HG   LEU  21           HG       LEU  21  -8.289  -4.485   2.044
  173   HD11  LEU  21          1HD1      LEU  21  -7.765  -6.050   3.834
  174   HD12  LEU  21          2HD1      LEU  21  -6.384  -5.839   2.756
  175   HD13  LEU  21          3HD1      LEU  21  -7.373  -7.296   2.648
  176   HD21  LEU  21          3HD2      LEU  21  -6.733  -5.326   0.356
  177   HD22  LEU  21          1HD2      LEU  21  -8.364  -5.189  -0.298
  178   HD23  LEU  21          2HD2      LEU  21  -7.723  -6.772   0.146
  179    H    THR  22           H        THR  22 -11.407  -4.085   3.108
  180    HA   THR  22           HA       THR  22 -11.431  -1.463   1.852
  181    HB   THR  22           HB       THR  22 -11.991  -2.235   4.738
  182    HG1  THR  22           HG1      THR  22 -14.057  -2.448   4.149
  183   HG21  THR  22          3HG2      THR  22 -12.576   0.335   3.249
  184   HG22  THR  22          1HG2      THR  22 -11.361   0.127   4.511
  185   HG23  THR  22          2HG2      THR  22 -13.073  -0.036   4.900
  186    H    LYS  23           H        LYS  23 -10.109   0.268   2.454
  187    HA   LYS  23           HA       LYS  23  -7.435  -0.052   2.797
  188    HB2  LYS  23           2HB      LYS  23  -7.363   2.305   3.559
  189    HB3  LYS  23           1HB      LYS  23  -8.400   2.066   2.160
  190    HG2  LYS  23           2HG      LYS  23 -10.368   2.061   3.672
  191    HG3  LYS  23           1HG      LYS  23  -9.287   2.423   5.019
  192    HD2  LYS  23           2HD      LYS  23  -9.704   4.144   2.569
  193    HD3  LYS  23           1HD      LYS  23 -10.369   4.452   4.172
  194    HE2  LYS  23           2HE      LYS  23  -8.071   4.632   5.061
  195    HE3  LYS  23           1HE      LYS  23  -7.441   4.389   3.432
  196    HZ1  LYS  23           3HZ      LYS  23  -8.645   6.408   2.750
  197    HZ2  LYS  23           1HZ      LYS  23  -7.482   6.713   3.941
  198    HZ3  LYS  23           2HZ      LYS  23  -9.116   6.655   4.358
  199    H    GLU  24           H        GLU  24  -9.817  -0.049   5.382
  200    HA   GLU  24           HA       GLU  24  -8.232   0.418   7.619
  201    HB2  GLU  24           2HB      GLU  24 -10.569  -1.495   7.402
  202    HB3  GLU  24           1HB      GLU  24  -9.952  -0.784   8.886
  203    HG2  GLU  24           2HG      GLU  24 -10.643   1.408   8.211
  204    HG3  GLU  24           1HG      GLU  24 -11.077   0.830   6.602
  205    H    GLN  25           H        GLN  25  -8.854  -2.683   5.973
  206    HA   GLN  25           HA       GLN  25  -6.847  -4.017   7.689
  207    HB2  GLN  25           2HB      GLN  25  -8.822  -5.206   5.714
  208    HB3  GLN  25           1HB      GLN  25  -7.766  -6.113   6.790
  209    HG2  GLN  25           2HG      GLN  25  -8.951  -5.355   8.716
  210    HG3  GLN  25           1HG      GLN  25  -9.885  -4.209   7.752
  211   HE21  GLN  25          1HE2      GLN  25 -11.556  -4.969   6.463
  212   HE22  GLN  25          2HE2      GLN  25 -12.227  -6.548   6.660
  213    H    LEU  26           H        LEU  26  -6.878  -2.354   4.921
  214    HA   LEU  26           HA       LEU  26  -5.046  -4.090   3.425
  215    HB2  LEU  26           2HB      LEU  26  -6.744  -3.350   2.031
  216    HB3  LEU  26           1HB      LEU  26  -6.798  -1.758   2.751
  217    HG   LEU  26           HG       LEU  26  -4.522  -1.348   1.648
  218   HD11  LEU  26          1HD1      LEU  26  -5.317  -3.845   0.144
  219   HD12  LEU  26          2HD1      LEU  26  -3.917  -3.656   1.201
  220   HD13  LEU  26          3HD1      LEU  26  -4.010  -2.747  -0.305
  221   HD21  LEU  26          3HD2      LEU  26  -6.928  -1.814  -0.120
  222   HD22  LEU  26          1HD2      LEU  26  -5.531  -0.809  -0.512
  223   HD23  LEU  26          2HD2      LEU  26  -6.592  -0.360   0.821
  224    H    GLU  27           H        GLU  27  -5.170  -1.122   5.229
  225    HA   GLU  27           HA       GLU  27  -2.699   0.010   4.416
  226    HB2  GLU  27           2HB      GLU  27  -2.917   1.366   6.474
  227    HB3  GLU  27           1HB      GLU  27  -4.413   1.329   5.550
  228    HG2  GLU  27           2HG      GLU  27  -5.250  -0.452   7.069
  229    HG3  GLU  27           1HG      GLU  27  -3.796  -0.258   8.041
  230    H    GLU  28           H        GLU  28  -3.590  -2.266   6.958
  231    HA   GLU  28           HA       GLU  28  -1.365  -1.946   8.617
  232    HB2  GLU  28           2HB      GLU  28  -2.089  -4.149   9.599
  233    HB3  GLU  28           1HB      GLU  28  -3.356  -2.939   9.481
  234    HG2  GLU  28           2HG      GLU  28  -4.274  -4.029   7.536
  235    HG3  GLU  28           1HG      GLU  28  -2.951  -5.194   7.531
  236    H    GLN  29           H        GLN  29  -1.676  -3.921   5.726
  237    HA   GLN  29           HA       GLN  29   0.886  -5.223   6.305
  238    HB2  GLN  29           2HB      GLN  29   0.487  -6.594   4.304
  239    HB3  GLN  29           1HB      GLN  29  -0.827  -6.710   5.459
  240    HG2  GLN  29           2HG      GLN  29  -1.039  -4.799   3.164
  241    HG3  GLN  29           1HG      GLN  29  -1.325  -6.520   2.910
  242   HE21  GLN  29          1HE2      GLN  29  -3.495  -6.248   2.451
  243   HE22  GLN  29          2HE2      GLN  29  -4.653  -5.822   3.658
  244    H    LEU  30           H        LEU  30  -0.423  -2.677   4.328
  245    HA   LEU  30           HA       LEU  30   1.914  -2.560   2.617
  246    HB2  LEU  30           2HB      LEU  30  -0.427  -0.666   2.867
  247    HB3  LEU  30           1HB      LEU  30   0.837  -0.552   1.656
  248    HG   LEU  30           HG       LEU  30  -1.199  -2.769   1.934
  249   HD11  LEU  30          1HD1      LEU  30  -2.117  -0.740   0.979
  250   HD12  LEU  30          2HD1      LEU  30  -1.977  -1.990  -0.257
  251   HD13  LEU  30          3HD1      LEU  30  -0.807  -0.671  -0.201
  252   HD21  LEU  30          3HD2      LEU  30   1.063  -2.496  -0.055
  253   HD22  LEU  30          1HD2      LEU  30  -0.217  -3.708  -0.110
  254   HD23  LEU  30          2HD2      LEU  30   0.935  -3.705   1.223
  255    H    ARG  31           H        ARG  31   0.971  -1.196   5.657
  256    HA   ARG  31           HA       ARG  31   3.510   0.277   5.664
  257    HB2  ARG  31           2HB      ARG  31   2.454   2.139   6.958
  258    HB3  ARG  31           1HB      ARG  31   1.980   2.038   5.270
  259    HG2  ARG  31           2HG      ARG  31  -0.187   1.339   5.786
  260    HG3  ARG  31           1HG      ARG  31   0.261   0.816   7.413
  261    HD2  ARG  31           2HD      ARG  31   0.499   3.059   8.162
  262    HD3  ARG  31           1HD      ARG  31   0.384   3.692   6.525
  263    HE   ARG  31           HE       ARG  31  -1.979   3.050   6.563
  264   HH11  ARG  31          1HH1      ARG  31  -0.365   3.090   9.604
  265   HH12  ARG  31          2HH1      ARG  31  -1.778   3.574  10.474
  266   HH21  ARG  31          1HH2      ARG  31  -3.792   3.662   7.684
  267   HH22  ARG  31          2HH2      ARG  31  -3.709   3.887   9.394
  268    HA   PRO  32           HA       PRO  32   3.291  -1.857   9.735
  269    HB2  PRO  32           2HB      PRO  32   4.600  -4.128   9.298
  270    HB3  PRO  32           1HB      PRO  32   2.909  -3.968   8.812
  271    HG2  PRO  32           2HG      PRO  32   5.375  -3.898   7.134
  272    HG3  PRO  32           1HG      PRO  32   3.775  -4.557   6.754
  273    HD2  PRO  32           2HD      PRO  32   4.780  -2.017   6.004
  274    HD3  PRO  32           1HD      PRO  32   3.107  -2.586   5.845
  275    H    LEU  33           H        LEU  33   5.223  -0.002   8.219
  276    HA   LEU  33           HA       LEU  33   7.863  -0.863   9.009
  277    HB2  LEU  33           2HB      LEU  33   6.887   1.738   7.818
  278    HB3  LEU  33           1HB      LEU  33   8.567   1.402   8.178
  279    HG   LEU  33           HG       LEU  33   8.330  -0.612   6.598
  280   HD11  LEU  33          1HD1      LEU  33   5.907   0.948   5.708
  281   HD12  LEU  33          2HD1      LEU  33   5.890  -0.635   6.484
  282   HD13  LEU  33          3HD1      LEU  33   6.613  -0.446   4.887
  283   HD21  LEU  33          3HD2      LEU  33   8.823   0.739   4.653
  284   HD22  LEU  33          1HD2      LEU  33   9.594   1.435   6.077
  285   HD23  LEU  33          2HD2      LEU  33   8.124   2.161   5.426
  286    HA   PRO  34           HA       PRO  34   8.205   0.759  13.068
  287    HB2  PRO  34           2HB      PRO  34  10.738   1.876  13.000
  288    HB3  PRO  34           1HB      PRO  34  10.398   0.155  13.211
  289    HG2  PRO  34           2HG      PRO  34  11.137   1.654  10.724
  290    HG3  PRO  34           1HG      PRO  34  11.711   0.072  11.289
  291    HD2  PRO  34           2HD      PRO  34   9.857   0.265   9.368
  292    HD3  PRO  34           1HD      PRO  34   9.763  -1.014  10.598
  293    H    ALA  35           H        ALA  35   9.516   3.143  10.699
  294    HA   ALA  35           HA       ALA  35   7.810   5.217  11.779
  295    HB1  ALA  35           3HB      ALA  35   9.641   5.198  13.416
  296    HB2  ALA  35           1HB      ALA  35   9.587   6.710  12.510
  297    HB3  ALA  35           2HB      ALA  35  10.799   5.490  12.118
  298    H    HIS  36           H        HIS  36   7.034   5.881   9.855
  299    HA   HIS  36           HA       HIS  36   8.629   7.521   8.171
  300    HB2  HIS  36           2HB      HIS  36   8.760   6.287   6.163
  301    HB3  HIS  36           1HB      HIS  36   9.230   5.128   7.401
  302    HD1  HIS  36           HD1      HIS  36   6.400   4.258   8.337
  303    HD2  HIS  36           HD2      HIS  36   7.552   4.638   4.362
  304    HE1  HIS  36           HE1      HIS  36   4.780   2.860   7.033
  305    HE2  HIS  36           HE2      HIS  36   5.391   3.245   4.626
  306    H    ASP  37           H        ASP  37   7.217   7.955   6.012
  307    HA   ASP  37           HA       ASP  37   4.598   8.750   6.964
  308    HB2  ASP  37           2HB      ASP  37   6.208  10.173   5.556
  309    HB3  ASP  37           1HB      ASP  37   5.712   9.182   4.190
  310    H    TYR  38           H        TYR  38   2.770   8.560   5.149
  311    HA   TYR  38           HA       TYR  38   2.775   6.006   3.777
  312    HB2  TYR  38           2HB      TYR  38   0.606   5.316   4.970
  313    HB3  TYR  38           1HB      TYR  38   2.115   5.112   5.851
  314    HD1  TYR  38           HD2      TYR  38   2.675   6.610   7.729
  315    HD2  TYR  38           HD1      TYR  38  -1.081   6.891   5.733
  316    HE1  TYR  38           HE2      TYR  38   1.777   7.918   9.606
  317    HE2  TYR  38           HE1      TYR  38  -1.981   8.201   7.608
  318    HH   TYR  38           HH       TYR  38  -0.047   9.583   9.978
  319    H    PHE  39           H        PHE  39   1.349   5.908   2.094
  320    HA   PHE  39           HA       PHE  39   0.048   8.439   1.413
  321    HB2  PHE  39           2HB      PHE  39   1.745   6.944  -0.044
  322    HB3  PHE  39           1HB      PHE  39   0.235   6.204  -0.561
  323    HD1  PHE  39           HD2      PHE  39   2.080   9.404  -0.364
  324    HD2  PHE  39           HD1      PHE  39  -1.171   7.295  -2.131
  325    HE1  PHE  39           HE2      PHE  39   1.758  11.243  -1.965
  326    HE2  PHE  39           HE1      PHE  39  -1.492   9.126  -3.734
  327    HZ   PHE  39           HZ       PHE  39  -0.030  11.105  -3.658
  328    H    GLU  40           H        GLU  40  -1.937   7.882  -0.246
  329    HA   GLU  40           HA       GLU  40  -4.017   6.994   1.471
  330    HB2  GLU  40           2HB      GLU  40  -5.512   7.432  -0.433
  331    HB3  GLU  40           1HB      GLU  40  -4.387   8.759  -0.172
  332    HG2  GLU  40           2HG      GLU  40  -3.026   8.038  -2.027
  333    HG3  GLU  40           1HG      GLU  40  -4.021   6.599  -2.247
  334    H    PHE  41           H        PHE  41  -5.452   5.259   1.265
  335    HA   PHE  41           HA       PHE  41  -4.614   3.012  -0.469
  336    HB2  PHE  41           2HB      PHE  41  -5.826   2.776   2.303
  337    HB3  PHE  41           1HB      PHE  41  -5.277   1.450   1.284
  338    HD1  PHE  41           HD1      PHE  41  -2.815   1.222   0.806
  339    HD2  PHE  41           HD2      PHE  41  -4.328   3.926   3.725
  340    HE1  PHE  41           HE1      PHE  41  -0.586   1.359   1.831
  341    HE2  PHE  41           HE2      PHE  41  -2.099   4.063   4.755
  342    HZ   PHE  41           HZ       PHE  41  -0.224   2.780   3.807
  343    H    PHE  42           H        PHE  42  -6.288   1.897  -1.535
  344    HA   PHE  42           HA       PHE  42  -8.626   3.454  -2.009
  345    HB2  PHE  42           2HB      PHE  42  -9.231   1.814  -3.663
  346    HB3  PHE  42           1HB      PHE  42  -7.501   2.098  -3.767
  347    HD1  PHE  42           HD1      PHE  42 -10.111  -0.315  -2.841
  348    HD2  PHE  42           HD2      PHE  42  -5.918   0.343  -3.230
  349    HE1  PHE  42           HE1      PHE  42  -9.715  -2.736  -2.675
  350    HE2  PHE  42           HE2      PHE  42  -5.522  -2.078  -3.062
  351    HZ   PHE  42           HZ       PHE  42  -7.420  -3.622  -2.787
  352    H    ALA  43           H        ALA  43 -10.848   2.681  -1.907
  353    HA   ALA  43           HA       ALA  43 -11.368   0.742   0.256
  354    HB1  ALA  43           3HB      ALA  43 -11.607   3.036   1.123
  355    HB2  ALA  43           1HB      ALA  43 -13.139   2.163   1.126
  356    HB3  ALA  43           2HB      ALA  43 -12.813   3.371  -0.119
  357    H    ALA  44           H        ALA  44 -12.373  -0.929  -0.673
  358    HA   ALA  44           HA       ALA  44 -14.750  -0.448  -2.312
  359    HB1  ALA  44           3HB      ALA  44 -12.930  -0.687  -3.940
  360    HB2  ALA  44           1HB      ALA  44 -14.054  -2.045  -4.031
  361    HB3  ALA  44           2HB      ALA  44 -12.496  -2.242  -3.229
  362    H    ASP  45           H        ASP  45 -15.702  -2.797  -2.876
  363    HA   ASP  45           HA       ASP  45 -15.601  -4.375  -0.385
  364    HB2  ASP  45           2HB      ASP  45 -17.807  -3.428  -0.885
  365    HB3  ASP  45           1HB      ASP  45 -17.800  -4.209  -2.464
  366    H    LEU  46           H        LEU  46 -15.275  -6.568  -0.440
  367    HA   LEU  46           HA       LEU  46 -13.831  -7.556  -2.727
  368    HB2  LEU  46           2HB      LEU  46 -13.685  -9.655  -1.164
  369    HB3  LEU  46           1HB      LEU  46 -12.760  -8.209  -0.823
  370    HG   LEU  46           HG       LEU  46 -14.540  -7.536   0.822
  371   HD11  LEU  46          1HD1      LEU  46 -15.557 -10.339   0.366
  372   HD12  LEU  46          2HD1      LEU  46 -16.405  -8.840  -0.019
  373   HD13  LEU  46          3HD1      LEU  46 -16.067  -9.255   1.661
  374   HD21  LEU  46          3HD2      LEU  46 -13.112 -10.150   1.310
  375   HD22  LEU  46          1HD2      LEU  46 -13.797  -9.110   2.561
  376   HD23  LEU  46          2HD2      LEU  46 -12.462  -8.530   1.566
  377    H    SER  47           H        SER  47 -16.157  -7.235  -3.811
  378    HA   SER  47           HA       SER  47 -17.781  -9.652  -3.685
  379    HB2  SER  47           2HB      SER  47 -19.235  -8.486  -5.308
  380    HB3  SER  47           1HB      SER  47 -18.907  -7.481  -3.897
  381    HG   SER  47           HG       SER  47 -17.214  -7.248  -6.124
  382    H    LEU  48           H        LEU  48 -17.917 -11.216  -5.267
  383    HA   LEU  48           HA       LEU  48 -15.681 -11.633  -6.955
  384    HB2  LEU  48           2HB      LEU  48 -18.384 -12.979  -6.854
  385    HB3  LEU  48           1HB      LEU  48 -17.102 -13.493  -7.934
  386    HG   LEU  48           HG       LEU  48 -15.661 -13.929  -5.923
  387   HD11  LEU  48          1HD1      LEU  48 -16.742 -12.481  -4.304
  388   HD12  LEU  48          2HD1      LEU  48 -16.746 -14.150  -3.733
  389   HD13  LEU  48          3HD1      LEU  48 -18.218 -13.442  -4.397
  390   HD21  LEU  48          3HD2      LEU  48 -16.795 -16.019  -5.297
  391   HD22  LEU  48          1HD2      LEU  48 -16.808 -15.751  -7.041
  392   HD23  LEU  48          2HD2      LEU  48 -18.264 -15.451  -6.092
  393    H    TYR  49           H        TYR  49 -15.264 -10.993  -8.981
  394    HA   TYR  49           HA       TYR  49 -15.380  -9.796 -10.892
  395    HB2  TYR  49           2HB      TYR  49 -18.179 -10.929 -10.873
  396    HB3  TYR  49           1HB      TYR  49 -17.581  -9.930 -12.194
  397    HD1  TYR  49           HD2      TYR  49 -15.850 -10.747 -13.689
  398    HD2  TYR  49           HD1      TYR  49 -17.338 -13.207 -10.549
  399    HE1  TYR  49           HE2      TYR  49 -14.820 -12.707 -14.746
  400    HE2  TYR  49           HE1      TYR  49 -16.307 -15.177 -11.602
  401    HH   TYR  49           HH       TYR  49 -15.569 -15.888 -13.838
  402    HA   PRO  50           HA       PRO  50 -17.384  -6.143  -8.911
  403    HB2  PRO  50           2HB      PRO  50 -15.224  -4.913  -7.916
  404    HB3  PRO  50           1HB      PRO  50 -15.962  -6.288  -7.087
  405    HG2  PRO  50           2HG      PRO  50 -13.462  -6.168  -8.697
  406    HG3  PRO  50           1HG      PRO  50 -13.846  -7.176  -7.293
  407    HD2  PRO  50           2HD      PRO  50 -13.963  -7.938 -10.027
  408    HD3  PRO  50           1HD      PRO  50 -14.560  -8.866  -8.638
  409    H    HIS  51           H        HIS  51 -17.995  -4.816 -10.541
  410    HA   HIS  51           HA       HIS  51 -16.188  -3.979 -12.618
  411    HB2  HIS  51           2HB      HIS  51 -19.019  -3.109 -11.980
  412    HB3  HIS  51           1HB      HIS  51 -18.123  -2.606 -13.411
  413    HD1  HIS  51           HD1      HIS  51 -18.266  -4.108 -15.396
  414    HD2  HIS  51           HD2      HIS  51 -19.488  -6.006 -11.906
  415    HE1  HIS  51           HE1      HIS  51 -19.154  -6.338 -16.121
  416    HE2  HIS  51           HE2      HIS  51 -20.013  -7.409 -14.018
  417    H    LEU  52           H        LEU  52 -14.559  -3.015 -11.300
  418    HA   LEU  52           HA       LEU  52 -14.860  -0.183 -10.893
  419    HB2  LEU  52           2HB      LEU  52 -15.722  -1.642  -8.777
  420    HB3  LEU  52           1HB      LEU  52 -14.014  -1.577  -8.392
  421    HG   LEU  52           HG       LEU  52 -15.794   0.841  -8.804
  422   HD11  LEU  52          1HD1      LEU  52 -16.395  -0.414  -6.793
  423   HD12  LEU  52          2HD1      LEU  52 -15.651   1.132  -6.388
  424   HD13  LEU  52          3HD1      LEU  52 -14.717  -0.359  -6.252
  425   HD21  LEU  52          3HD2      LEU  52 -13.465   1.311  -9.361
  426   HD22  LEU  52          1HD2      LEU  52 -12.944   0.642  -7.816
  427   HD23  LEU  52          2HD2      LEU  52 -13.918   2.111  -7.858
  428    H    TYR  53           H        TYR  53 -12.803   0.849 -10.690
  429    HA   TYR  53           HA       TYR  53 -10.450  -0.931 -10.739
  430    HB2  TYR  53           2HB      TYR  53  -9.383   0.597 -12.370
  431    HB3  TYR  53           1HB      TYR  53 -10.833  -0.162 -13.008
  432    HD1  TYR  53           HD1      TYR  53 -13.008   1.229 -13.005
  433    HD2  TYR  53           HD2      TYR  53  -9.147   2.931 -12.404
  434    HE1  TYR  53           HE1      TYR  53 -13.887   3.442 -13.620
  435    HE2  TYR  53           HE2      TYR  53 -10.021   5.142 -13.014
  436    HH   TYR  53           HH       TYR  53 -11.882   6.077 -14.325
  437    H    SER  54           H        SER  54  -9.097  -0.546  -9.115
  438    HA   SER  54           HA       SER  54  -8.539   2.156  -8.203
  439    HB2  SER  54           2HB      SER  54  -9.725   0.105  -6.303
  440    HB3  SER  54           1HB      SER  54  -9.108   1.691  -5.844
  441    HG   SER  54           HG       SER  54 -10.781   2.336  -7.611
  442    H    ARG  55           H        ARG  55  -6.796   2.212  -6.562
  443    HA   ARG  55           HA       ARG  55  -5.331  -0.181  -5.923
  444    HB2  ARG  55           2HB      ARG  55  -3.247   0.330  -7.041
  445    HB3  ARG  55           1HB      ARG  55  -4.526   0.223  -8.240
  446    HG2  ARG  55           2HG      ARG  55  -3.524   2.839  -7.118
  447    HG3  ARG  55           1HG      ARG  55  -2.853   2.083  -8.562
  448    HD2  ARG  55           2HD      ARG  55  -4.990   2.240  -9.687
  449    HD3  ARG  55           1HD      ARG  55  -5.754   2.854  -8.220
  450    HE   ARG  55           HE       ARG  55  -3.917   4.710  -8.592
  451   HH11  ARG  55          1HH1      ARG  55  -5.917   3.194 -10.946
  452   HH12  ARG  55          2HH1      ARG  55  -6.017   4.607 -11.930
  453   HH21  ARG  55          1HH2      ARG  55  -4.057   6.521  -9.868
  454   HH22  ARG  55          2HH2      ARG  55  -4.969   6.469 -11.334
  455    H    ALA  56           H        ALA  56  -3.746   0.146  -4.317
  456    HA   ALA  56           HA       ALA  56  -3.997   2.694  -2.877
  457    HB1  ALA  56           3HB      ALA  56  -2.883   0.039  -1.959
  458    HB2  ALA  56           1HB      ALA  56  -4.501   0.654  -1.624
  459    HB3  ALA  56           2HB      ALA  56  -3.090   1.475  -0.958
  460    H    TYR  57           H        TYR  57  -1.937   3.426  -1.689
  461    HA   TYR  57           HA       TYR  57   0.501   2.870  -3.235
  462    HB2  TYR  57           2HB      TYR  57  -0.639   5.624  -2.733
  463    HB3  TYR  57           1HB      TYR  57   1.011   5.338  -3.270
  464    HD1  TYR  57           HD2      TYR  57   1.434   4.386  -5.520
  465    HD2  TYR  57           HD1      TYR  57  -2.485   5.475  -4.259
  466    HE1  TYR  57           HE2      TYR  57   0.683   4.367  -7.861
  467    HE2  TYR  57           HE1      TYR  57  -3.246   5.461  -6.594
  468    HH   TYR  57           HH       TYR  57  -2.146   5.767  -8.887
  469    H    ILE  58           H        ILE  58   2.468   3.411  -2.196
  470    HA   ILE  58           HA       ILE  58   2.283   3.928   0.710
  471    HB   ILE  58           HB       ILE  58   4.441   2.335  -0.707
  472   HG12  ILE  58          2HG1      ILE  58   2.158   1.323   1.024
  473   HG13  ILE  58          1HG1      ILE  58   2.257   1.151  -0.726
  474   HG21  ILE  58          1HG2      ILE  58   5.133   1.696   1.568
  475   HG22  ILE  58          2HG2      ILE  58   3.895   2.763   2.234
  476   HG23  ILE  58          3HG2      ILE  58   5.238   3.438   1.309
  477   HD11  ILE  58          3HD1      ILE  58   4.279  -0.213  -0.462
  478   HD12  ILE  58          1HD1      ILE  58   2.885  -0.906   0.367
  479   HD13  ILE  58          2HD1      ILE  58   4.131  -0.070   1.291
  480    H    ASN  59           H        ASN  59   3.975   5.268   1.616
  481    HA   ASN  59           HA       ASN  59   5.612   6.729  -0.356
  482    HB2  ASN  59           2HB      ASN  59   3.628   8.065   0.439
  483    HB3  ASN  59           1HB      ASN  59   4.314   8.014   2.060
  484   HD21  ASN  59          1HD2      ASN  59   6.242   9.148   2.464
  485   HD22  ASN  59          2HD2      ASN  59   6.781  10.409   1.418
  486    H    PHE  60           H        PHE  60   7.433   5.501   0.141
  487    HA   PHE  60           HA       PHE  60   8.418   5.066   2.762
  488    HB2  PHE  60           2HB      PHE  60   9.551   4.794   0.008
  489    HB3  PHE  60           1HB      PHE  60  10.654   4.736   1.380
  490    HD1  PHE  60           HD2      PHE  60   7.599   3.137  -0.030
  491    HD2  PHE  60           HD1      PHE  60  10.896   2.786   2.636
  492    HE1  PHE  60           HE2      PHE  60   7.053   0.766   0.328
  493    HE2  PHE  60           HE1      PHE  60  10.358   0.422   3.006
  494    HZ   PHE  60           HZ       PHE  60   8.433  -0.600   1.846
  495    H    ARG  61           H        ARG  61  10.743   5.802   3.347
  496    HA   ARG  61           HA       ARG  61  11.121   8.665   2.837
  497    HB2  ARG  61           2HB      ARG  61  10.606   7.465   5.563
  498    HB3  ARG  61           1HB      ARG  61  11.330   9.049   5.335
  499    HG2  ARG  61           2HG      ARG  61   8.613   8.271   4.283
  500    HG3  ARG  61           1HG      ARG  61   8.890   9.092   5.821
  501    HD2  ARG  61           2HD      ARG  61   9.606  10.128   3.074
  502    HD3  ARG  61           1HD      ARG  61   8.298  10.708   4.107
  503    HE   ARG  61           HE       ARG  61  11.079  10.875   5.041
  504   HH11  ARG  61          1HH1      ARG  61   8.157  12.471   4.107
  505   HH12  ARG  61          2HH1      ARG  61   8.695  14.000   4.709
  506   HH21  ARG  61          1HH2      ARG  61  11.725  12.830   5.800
  507   HH22  ARG  61          2HH2      ARG  61  10.671  14.200   5.665
  508    H    ASN  62           H        ASN  62  12.330   5.935   4.817
  509    HA   ASN  62           HA       ASN  62  14.994   7.123   4.818
  510    HB2  ASN  62           2HB      ASN  62  13.971   6.235   6.906
  511    HB3  ASN  62           1HB      ASN  62  13.983   4.627   6.196
  512   HD21  ASN  62          1HD2      ASN  62  15.314   3.794   7.761
  513   HD22  ASN  62          2HD2      ASN  62  16.993   4.193   7.864
  514    HA   PRO  63           HA       PRO  63  16.319   4.619   1.306
  515    HB2  PRO  63           2HB      PRO  63  19.037   4.806   1.907
  516    HB3  PRO  63           1HB      PRO  63  18.123   5.962   0.934
  517    HG2  PRO  63           2HG      PRO  63  18.858   6.088   3.834
  518    HG3  PRO  63           1HG      PRO  63  18.846   7.382   2.620
  519    HD2  PRO  63           2HD      PRO  63  16.882   7.174   4.418
  520    HD3  PRO  63           1HD      PRO  63  16.528   7.639   2.737
  521    H    ASP  64           H        ASP  64  16.885   3.985   4.650
  522    HA   ASP  64           HA       ASP  64  18.049   1.371   4.229
  523    HB2  ASP  64           2HB      ASP  64  17.072   2.690   6.769
  524    HB3  ASP  64           1HB      ASP  64  17.983   1.184   6.684
  525    H    ASP  65           H        ASP  65  14.876   2.620   5.433
  526    HA   ASP  65           HA       ASP  65  13.836  -0.007   5.788
  527    HB2  ASP  65           2HB      ASP  65  11.614   1.051   6.046
  528    HB3  ASP  65           1HB      ASP  65  12.840   1.774   7.070
  529    H    ILE  66           H        ILE  66  13.923   2.185   3.066
  530    HA   ILE  66           HA       ILE  66  12.201   0.970   1.278
  531    HB   ILE  66           HB       ILE  66  14.950   2.102   0.693
  532   HG12  ILE  66          2HG1      ILE  66  12.197   3.372   0.538
  533   HG13  ILE  66          1HG1      ILE  66  13.404   3.698   1.774
  534   HG21  ILE  66          1HG2      ILE  66  14.168   2.375  -1.620
  535   HG22  ILE  66          2HG2      ILE  66  12.665   1.548  -1.209
  536   HG23  ILE  66          3HG2      ILE  66  14.198   0.677  -1.143
  537   HD11  ILE  66          3HD1      ILE  66  13.344   5.469   0.124
  538   HD12  ILE  66          1HD1      ILE  66  13.675   4.308  -1.162
  539   HD13  ILE  66          2HD1      ILE  66  14.894   4.628   0.074
  540    H    LEU  67           H        LEU  67  15.687   0.125   1.648
  541    HA   LEU  67           HA       LEU  67  15.379  -2.196  -0.003
  542    HB2  LEU  67           2HB      LEU  67  17.727  -2.715   0.638
  543    HB3  LEU  67           1HB      LEU  67  17.491  -1.140  -0.081
  544    HG   LEU  67           HG       LEU  67  17.514  -0.234   2.340
  545   HD11  LEU  67          1HD1      LEU  67  18.831  -1.578   3.928
  546   HD12  LEU  67          2HD1      LEU  67  18.774  -2.938   2.807
  547   HD13  LEU  67          3HD1      LEU  67  17.287  -2.333   3.534
  548   HD21  LEU  67          3HD2      LEU  67  19.290   0.202   0.763
  549   HD22  LEU  67          1HD2      LEU  67  19.997  -1.385   1.065
  550   HD23  LEU  67          2HD2      LEU  67  19.983  -0.168   2.341
  551    H    LEU  68           H        LEU  68  15.328  -1.629   3.455
  552    HA   LEU  68           HA       LEU  68  15.539  -4.284   4.351
  553    HB2  LEU  68           2HB      LEU  68  15.696  -2.547   5.958
  554    HB3  LEU  68           1HB      LEU  68  14.173  -1.837   5.462
  555    HG   LEU  68           HG       LEU  68  12.965  -3.769   6.430
  556   HD11  LEU  68          1HD1      LEU  68  15.694  -4.632   7.413
  557   HD12  LEU  68          2HD1      LEU  68  14.704  -5.469   6.217
  558   HD13  LEU  68          3HD1      LEU  68  14.151  -5.345   7.886
  559   HD21  LEU  68          3HD2      LEU  68  13.294  -1.744   7.759
  560   HD22  LEU  68          1HD2      LEU  68  14.832  -2.369   8.356
  561   HD23  LEU  68          2HD2      LEU  68  13.324  -3.179   8.783
  562    H    PHE  69           H        PHE  69  12.627  -2.389   3.549
  563    HA   PHE  69           HA       PHE  69  10.937  -4.667   4.077
  564    HB2  PHE  69           2HB      PHE  69  10.495  -1.790   3.517
  565    HB3  PHE  69           1HB      PHE  69   9.180  -2.892   3.107
  566    HD1  PHE  69           HD1      PHE  69  11.413  -1.833   5.882
  567    HD2  PHE  69           HD2      PHE  69   7.780  -3.757   4.774
  568    HE1  PHE  69           HE1      PHE  69  10.746  -1.929   8.247
  569    HE2  PHE  69           HE2      PHE  69   7.106  -3.855   7.132
  570    HZ   PHE  69           HZ       PHE  69   8.591  -2.941   8.878
  571    H    ARG  70           H        ARG  70  12.201  -3.112   1.152
  572    HA   ARG  70           HA       ARG  70  10.579  -4.438  -0.728
  573    HB2  ARG  70           2HB      ARG  70  12.230  -3.988  -2.352
  574    HB3  ARG  70           1HB      ARG  70  12.455  -2.702  -1.172
  575    HG2  ARG  70           2HG      ARG  70  14.353  -3.810  -0.225
  576    HG3  ARG  70           1HG      ARG  70  14.067  -5.248  -1.198
  577    HD2  ARG  70           2HD      ARG  70  14.481  -3.855  -3.232
  578    HD3  ARG  70           1HD      ARG  70  14.950  -2.537  -2.157
  579    HE   ARG  70           HE       ARG  70  16.439  -4.752  -1.408
  580   HH11  ARG  70          1HH1      ARG  70  16.138  -2.696  -4.162
  581   HH12  ARG  70          2HH1      ARG  70  17.756  -2.990  -4.690
  582   HH21  ARG  70          1HH2      ARG  70  18.506  -5.126  -2.093
  583   HH22  ARG  70          2HH2      ARG  70  19.084  -4.364  -3.533
  584    H    ASP  71           H        ASP  71  13.349  -5.512   1.141
  585    HA   ASP  71           HA       ASP  71  13.562  -8.040  -0.236
  586    HB2  ASP  71           2HB      ASP  71  15.112  -6.645   1.918
  587    HB3  ASP  71           1HB      ASP  71  15.359  -8.364   1.650
  588    H    ARG  72           H        ARG  72  11.198  -7.242   1.617
  589    HA   ARG  72           HA       ARG  72  10.936  -9.957   2.680
  590    HB2  ARG  72           2HB      ARG  72  10.081  -9.202   4.833
  591    HB3  ARG  72           1HB      ARG  72  11.709  -8.587   4.583
  592    HG2  ARG  72           2HG      ARG  72  10.639  -6.426   3.813
  593    HG3  ARG  72           1HG      ARG  72   9.113  -7.077   4.409
  594    HD2  ARG  72           2HD      ARG  72  11.614  -6.568   6.025
  595    HD3  ARG  72           1HD      ARG  72  10.121  -5.633   6.079
  596    HE   ARG  72           HE       ARG  72  10.622  -8.216   7.302
  597   HH11  ARG  72          1HH1      ARG  72   8.232  -5.918   6.354
  598   HH12  ARG  72          2HH1      ARG  72   7.109  -6.431   7.562
  599   HH21  ARG  72          1HH2      ARG  72   9.153  -8.844   8.856
  600   HH22  ARG  72          2HH2      ARG  72   7.611  -8.062   8.934
  601    H    PHE  73           H        PHE  73   9.847  -8.200   0.469
  602    HA   PHE  73           HA       PHE  73   7.039  -8.909   0.764
  603    HB2  PHE  73           2HB      PHE  73   8.004  -6.064   0.606
  604    HB3  PHE  73           1HB      PHE  73   6.466  -6.498  -0.127
  605    HD1  PHE  73           HD1      PHE  73   4.715  -7.598   1.334
  606    HD2  PHE  73           HD2      PHE  73   8.132  -5.622   2.933
  607    HE1  PHE  73           HE1      PHE  73   3.569  -7.370   3.493
  608    HE2  PHE  73           HE2      PHE  73   6.989  -5.401   5.096
  609    HZ   PHE  73           HZ       PHE  73   4.705  -6.271   5.382
  610    H    ASP  74           H        ASP  74   9.255  -7.054  -1.310
  611    HA   ASP  74           HA       ASP  74   9.405  -6.748  -3.537
  612    HB2  ASP  74           2HB      ASP  74  10.069  -8.742  -4.778
  613    HB3  ASP  74           1HB      ASP  74  10.812  -8.675  -3.189
  614    H    GLY  75           H        GLY  75   7.179  -9.566  -3.578
  615    HA2  GLY  75           2HA      GLY  75   5.044  -8.055  -4.752
  616    HA3  GLY  75           1HA      GLY  75   5.878  -9.050  -5.938
  617    H    TYR  76           H        TYR  76   5.010  -9.614  -2.537
  618    HA   TYR  76           HA       TYR  76   4.396 -12.357  -3.026
  619    HB2  TYR  76           2HB      TYR  76   4.099 -12.560  -0.705
  620    HB3  TYR  76           1HB      TYR  76   5.284 -11.267  -0.861
  621    HD1  TYR  76           HD1      TYR  76   4.171  -8.820  -1.013
  622    HD2  TYR  76           HD2      TYR  76   2.361 -12.230   0.787
  623    HE1  TYR  76           HE1      TYR  76   2.729  -7.348   0.325
  624    HE2  TYR  76           HE2      TYR  76   0.918 -10.763   2.129
  625    HH   TYR  76           HH       TYR  76   0.619  -7.417   1.512
  626    H    ILE  77           H        ILE  77   2.330 -13.380  -2.298
  627    HA   ILE  77           HA       ILE  77   0.015 -11.893  -3.342
  628    HB   ILE  77           HB       ILE  77   0.395 -14.866  -2.882
  629   HG12  ILE  77          2HG1      ILE  77   1.667 -13.989  -4.802
  630   HG13  ILE  77          1HG1      ILE  77   0.351 -15.028  -5.335
  631   HG21  ILE  77          1HG2      ILE  77  -1.934 -14.229  -2.511
  632   HG22  ILE  77          2HG2      ILE  77  -1.764 -15.159  -4.000
  633   HG23  ILE  77          3HG2      ILE  77  -1.969 -13.410  -4.073
  634   HD11  ILE  77          3HD1      ILE  77  -0.971 -13.068  -5.916
  635   HD12  ILE  77          1HD1      ILE  77   0.584 -13.062  -6.749
  636   HD13  ILE  77          2HD1      ILE  77   0.328 -12.018  -5.351
  637    H    PHE  78           H        PHE  78  -1.198 -10.926  -1.831
  638    HA   PHE  78           HA       PHE  78  -1.387 -12.031   0.875
  639    HB2  PHE  78           2HB      PHE  78  -0.925  -9.625   0.651
  640    HB3  PHE  78           1HB      PHE  78  -2.412  -9.413  -0.268
  641    HD1  PHE  78           HD1      PHE  78  -1.068 -10.306   3.073
  642    HD2  PHE  78           HD2      PHE  78  -4.485  -9.095   0.826
  643    HE1  PHE  78           HE1      PHE  78  -2.298  -9.902   5.162
  644    HE2  PHE  78           HE2      PHE  78  -5.715  -8.691   2.917
  645    HZ   PHE  78           HZ       PHE  78  -4.624  -9.092   5.088
  646    H    LEU  79           H        LEU  79  -3.124 -13.106   1.603
  647    HA   LEU  79           HA       LEU  79  -5.576 -13.111  -0.046
  648    HB2  LEU  79           2HB      LEU  79  -4.498 -15.265   1.786
  649    HB3  LEU  79           1HB      LEU  79  -6.009 -15.355   0.897
  650    HG   LEU  79           HG       LEU  79  -3.278 -15.148  -0.396
  651   HD11  LEU  79          1HD1      LEU  79  -3.523 -17.272   0.782
  652   HD12  LEU  79          2HD1      LEU  79  -3.551 -17.507  -0.965
  653   HD13  LEU  79          3HD1      LEU  79  -5.054 -17.564  -0.042
  654   HD21  LEU  79          3HD2      LEU  79  -4.483 -15.769  -2.443
  655   HD22  LEU  79          1HD2      LEU  79  -5.047 -14.234  -1.785
  656   HD23  LEU  79          2HD2      LEU  79  -6.008 -15.696  -1.561
  657    H    ASP  80           H        ASP  80  -7.491 -12.584   0.882
  658    HA   ASP  80           HA       ASP  80  -7.506 -11.636   3.630
  659    HB2  ASP  80           2HB      ASP  80  -9.652 -10.694   3.108
  660    HB3  ASP  80           1HB      ASP  80  -8.614 -10.411   1.714
  661    H    SER  81           H        SER  81 -10.244 -12.231   4.262
  662    HA   SER  81           HA       SER  81  -9.991 -14.814   5.413
  663    HB2  SER  81           2HB      SER  81 -12.478 -13.115   5.077
  664    HB3  SER  81           1HB      SER  81 -12.323 -14.502   6.152
  665    HG   SER  81           HG       SER  81 -10.619 -13.323   7.218
  666    H    LYS  82           H        LYS  82 -11.391 -13.702   2.404
  667    HA   LYS  82           HA       LYS  82 -12.699 -16.235   1.849
  668    HB2  LYS  82           2HB      LYS  82 -12.295 -13.779   0.120
  669    HB3  LYS  82           1HB      LYS  82 -13.256 -15.180  -0.337
  670    HG2  LYS  82           2HG      LYS  82 -13.807 -13.365   2.013
  671    HG3  LYS  82           1HG      LYS  82 -14.654 -13.340   0.461
  672    HD2  LYS  82           2HD      LYS  82 -15.461 -15.604   0.837
  673    HD3  LYS  82           1HD      LYS  82 -14.559 -15.703   2.349
  674    HE2  LYS  82           2HE      LYS  82 -15.921 -13.925   3.304
  675    HE3  LYS  82           1HE      LYS  82 -16.783 -13.744   1.775
  676    HZ1  LYS  82           3HZ      LYS  82 -17.610 -15.996   2.011
  677    HZ2  LYS  82           1HZ      LYS  82 -18.046 -15.064   3.351
  678    HZ3  LYS  82           2HZ      LYS  82 -16.783 -16.178   3.475
  679    H    GLY  83           H        GLY  83 -10.022 -14.373   0.391
  680    HA2  GLY  83           2HA      GLY  83  -7.932 -15.728   0.085
  681    HA3  GLY  83           1HA      GLY  83  -8.958 -16.934  -0.671
  682    H    LEU  84           H        LEU  84  -9.228 -13.449  -1.165
  683    HA   LEU  84           HA       LEU  84  -8.886 -13.767  -4.018
  684    HB2  LEU  84           2HB      LEU  84  -9.211 -11.243  -2.381
  685    HB3  LEU  84           1HB      LEU  84  -9.345 -11.365  -4.126
  686    HG   LEU  84           HG       LEU  84 -11.216 -12.615  -2.105
  687   HD11  LEU  84          1HD1      LEU  84 -12.866 -11.052  -3.040
  688   HD12  LEU  84          2HD1      LEU  84 -11.602 -10.327  -4.035
  689   HD13  LEU  84          3HD1      LEU  84 -11.514 -10.218  -2.277
  690   HD21  LEU  84          3HD2      LEU  84 -11.312 -12.676  -5.122
  691   HD22  LEU  84          1HD2      LEU  84 -12.569 -13.275  -4.039
  692   HD23  LEU  84          2HD2      LEU  84 -10.985 -14.047  -4.062
  693    H    GLU  85           H        GLU  85  -6.937 -13.816  -4.960
  694    HA   GLU  85           HA       GLU  85  -4.535 -13.275  -3.600
  695    HB2  GLU  85           2HB      GLU  85  -5.030 -13.569  -6.569
  696    HB3  GLU  85           1HB      GLU  85  -3.442 -13.568  -5.811
  697    HG2  GLU  85           2HG      GLU  85  -4.134 -15.566  -4.495
  698    HG3  GLU  85           1HG      GLU  85  -5.637 -15.600  -5.418
  699    H    TYR  86           H        TYR  86  -4.232 -11.247  -2.837
  700    HA   TYR  86           HA       TYR  86  -4.278  -8.971  -4.691
  701    HB2  TYR  86           2HB      TYR  86  -3.689  -9.013  -1.714
  702    HB3  TYR  86           1HB      TYR  86  -3.902  -7.579  -2.711
  703    HD1  TYR  86           HD1      TYR  86  -6.229  -7.415  -3.942
  704    HD2  TYR  86           HD2      TYR  86  -5.508  -9.806  -0.494
  705    HE1  TYR  86           HE1      TYR  86  -8.632  -7.388  -3.430
  706    HE2  TYR  86           HE2      TYR  86  -7.911  -9.789   0.024
  707    HH   TYR  86           HH       TYR  86 -10.262  -8.881  -2.134
  708    HA   PRO  87           HA       PRO  87   0.208  -9.799  -4.913
  709    HB2  PRO  87           2HB      PRO  87   0.340  -8.529  -7.462
  710    HB3  PRO  87           1HB      PRO  87   0.347 -10.260  -7.124
  711    HG2  PRO  87           2HG      PRO  87  -1.694  -8.838  -8.412
  712    HG3  PRO  87           1HG      PRO  87  -1.818 -10.480  -7.761
  713    HD2  PRO  87           2HD      PRO  87  -2.765  -7.900  -6.609
  714    HD3  PRO  87           1HD      PRO  87  -3.446  -9.533  -6.444
  715    H    ALA  88           H        ALA  88   1.255  -8.415  -3.582
  716    HA   ALA  88           HA       ALA  88   1.036  -5.522  -4.060
  717    HB1  ALA  88           3HB      ALA  88   1.988  -5.255  -1.815
  718    HB2  ALA  88           1HB      ALA  88   2.140  -7.007  -1.672
  719    HB3  ALA  88           2HB      ALA  88   0.544  -6.266  -1.795
  720    H    VAL  89           H        VAL  89   2.439  -5.240  -5.794
  721    HA   VAL  89           HA       VAL  89   5.210  -6.160  -5.583
  722    HB   VAL  89           HB       VAL  89   3.829  -4.642  -7.820
  723   HG11  VAL  89          1HG1      VAL  89   6.518  -6.031  -7.770
  724   HG12  VAL  89          2HG1      VAL  89   6.247  -4.289  -7.837
  725   HG13  VAL  89          3HG1      VAL  89   5.759  -5.308  -9.191
  726   HG21  VAL  89          3HG2      VAL  89   2.839  -6.843  -7.520
  727   HG22  VAL  89          1HG2      VAL  89   4.438  -7.591  -7.535
  728   HG23  VAL  89          2HG2      VAL  89   3.812  -6.816  -8.990
  729    H    VAL  90           H        VAL  90   6.910  -4.882  -5.079
  730    HA   VAL  90           HA       VAL  90   6.371  -2.128  -4.264
  731    HB   VAL  90           HB       VAL  90   8.878  -3.787  -3.873
  732   HG11  VAL  90          1HG1      VAL  90   8.019  -1.205  -2.555
  733   HG12  VAL  90          2HG1      VAL  90   9.298  -1.379  -3.757
  734   HG13  VAL  90          3HG1      VAL  90   9.472  -2.131  -2.171
  735   HG21  VAL  90          3HG2      VAL  90   8.069  -4.087  -1.551
  736   HG22  VAL  90          1HG2      VAL  90   7.008  -4.839  -2.744
  737   HG23  VAL  90          2HG2      VAL  90   6.552  -3.307  -1.999
  738    H    GLU  91           H        GLU  91   6.812  -0.452  -5.572
  739    HA   GLU  91           HA       GLU  91   9.281  -0.415  -7.138
  740    HB2  GLU  91           2HB      GLU  91   8.146   0.326  -9.201
  741    HB3  GLU  91           1HB      GLU  91   7.668  -1.303  -8.746
  742    HG2  GLU  91           2HG      GLU  91   5.556  -0.514  -7.906
  743    HG3  GLU  91           1HG      GLU  91   6.043   1.164  -8.145
  744    H    PHE  92           H        PHE  92   9.790   1.802  -7.967
  745    HA   PHE  92           HA       PHE  92   8.916   3.773  -5.986
  746    HB2  PHE  92           2HB      PHE  92  10.874   5.027  -6.522
  747    HB3  PHE  92           1HB      PHE  92  11.367   3.340  -6.434
  748    HD1  PHE  92           HD1      PHE  92  11.595   2.052  -8.641
  749    HD2  PHE  92           HD2      PHE  92  11.313   6.300  -8.432
  750    HE1  PHE  92           HE1      PHE  92  12.572   2.228 -10.891
  751    HE2  PHE  92           HE2      PHE  92  12.289   6.476 -10.680
  752    HZ   PHE  92           HZ       PHE  92  12.919   4.439 -11.915
  753    H    ALA  93           H        ALA  93   8.346   5.950  -6.584
  754    HA   ALA  93           HA       ALA  93   6.844   6.083  -9.092
  755    HB1  ALA  93           3HB      ALA  93   6.920   8.014  -6.767
  756    HB2  ALA  93           1HB      ALA  93   5.717   6.748  -7.023
  757    HB3  ALA  93           2HB      ALA  93   5.829   8.099  -8.151
  758    HA   PRO  94           HA       PRO  94  10.030   8.334 -11.269
  759    HB2  PRO  94           2HB      PRO  94   7.735   9.605 -12.685
  760    HB3  PRO  94           1HB      PRO  94   9.130   8.741 -13.344
  761    HG2  PRO  94           2HG      PRO  94   6.720   7.597 -13.285
  762    HG3  PRO  94           1HG      PRO  94   8.188   6.653 -12.960
  763    HD2  PRO  94           2HD      PRO  94   6.147   7.719 -11.038
  764    HD3  PRO  94           1HD      PRO  94   7.017   6.170 -11.019
  765    H    PHE  95           H        PHE  95  11.096  10.162 -10.759
  766    HA   PHE  95           HA       PHE  95   9.558  12.503  -9.819
  767    HB2  PHE  95           2HB      PHE  95  11.403  12.953  -8.196
  768    HB3  PHE  95           1HB      PHE  95  10.530  11.462  -7.868
  769    HD1  PHE  95           HD2      PHE  95  11.585   9.290  -8.221
  770    HD2  PHE  95           HD1      PHE  95  13.728  12.914  -8.891
  771    HE1  PHE  95           HE2      PHE  95  13.703   8.039  -8.211
  772    HE2  PHE  95           HE1      PHE  95  15.845  11.664  -8.885
  773    HZ   PHE  95           HZ       PHE  95  15.836   9.224  -8.545
  774    H    GLN  96           H        GLN  96  10.914  14.548  -9.825
  775    HA   GLN  96           HA       GLN  96  12.193  14.791 -12.431
  776    HB2  GLN  96           2HB      GLN  96  10.513  16.442 -11.872
  777    HB3  GLN  96           1HB      GLN  96  11.357  16.860 -10.389
  778    HG2  GLN  96           2HG      GLN  96  11.654  18.544 -12.149
  779    HG3  GLN  96           1HG      GLN  96  13.183  17.825 -11.648
  780   HE21  GLN  96          1HE2      GLN  96  14.359  16.653 -13.105
  781   HE22  GLN  96          2HE2      GLN  96  13.951  16.517 -14.777
  782    H    LYS  97           H        LYS  97  14.313  14.689 -12.700
  783    HA   LYS  97           HA       LYS  97  16.238  14.532 -10.666
  784    HB2  LYS  97           2HB      LYS  97  16.608  13.659 -12.919
  785    HB3  LYS  97           1HB      LYS  97  16.561  15.284 -13.584
  786    HG2  LYS  97           2HG      LYS  97  18.841  14.525 -13.458
  787    HG3  LYS  97           1HG      LYS  97  18.599  15.841 -12.308
  788    HD2  LYS  97           2HD      LYS  97  18.398  14.211 -10.484
  789    HD3  LYS  97           1HD      LYS  97  18.622  12.891 -11.635
  790    HE2  LYS  97           2HE      LYS  97  20.630  15.048 -10.955
  791    HE3  LYS  97           1HE      LYS  97  20.706  13.354 -10.471
  792    HZ1  LYS  97           3HZ      LYS  97  22.131  13.739 -12.347
  793    HZ2  LYS  97           1HZ      LYS  97  20.858  14.391 -13.247
  794    HZ3  LYS  97           2HZ      LYS  97  20.844  12.755 -12.829
  Start of MODEL    9
    1    H1   MET   1           1H       MET   1  14.638   7.366  11.179
    2    H2   MET   1           2H       MET   1  13.414   6.738  12.160
    3    H3   MET   1           3H       MET   1  14.610   7.726  12.830
    4    HA   MET   1           HA       MET   1  12.662   8.605  10.776
    5    HB2  MET   1           2HB      MET   1  11.517   9.811  12.590
    6    HB3  MET   1           1HB      MET   1  11.510   8.074  12.865
    7    HG2  MET   1           2HG      MET   1  13.312   8.297  14.480
    8    HG3  MET   1           1HG      MET   1  13.388  10.035  14.178
    9    HE1  MET   1           3HE      MET   1  13.208  10.398  16.813
   10    HE2  MET   1           1HE      MET   1  13.028   8.672  17.113
   11    HE3  MET   1           2HE      MET   1  11.868   9.809  17.799
   12    H    GLY   2           H        GLY   2  15.729   8.997  11.466
   13    HA2  GLY   2           2HA      GLY   2  15.970  11.749  12.212
   14    HA3  GLY   2           1HA      GLY   2  17.252  10.720  11.603
   15    H    HIS   3           H        HIS   3  15.544  13.463  10.977
   16    HA   HIS   3           HA       HIS   3  15.453  13.282   8.084
   17    HB2  HIS   3           2HB      HIS   3  15.085  15.674   9.910
   18    HB3  HIS   3           1HB      HIS   3  14.735  15.638   8.185
   19    HD1  HIS   3           HD1      HIS   3  13.331  14.735  11.482
   20    HD2  HIS   3           HD2      HIS   3  12.436  14.081   7.478
   21    HE1  HIS   3           HE1      HIS   3  10.976  13.882  11.454
   22    HE2  HIS   3           HE2      HIS   3  10.535  13.300   9.050
   23    H    HIS   4           H        HIS   4  17.257  13.416   6.891
   24    HA   HIS   4           HA       HIS   4  19.616  14.753   8.030
   25    HB2  HIS   4           2HB      HIS   4  19.372  12.718   5.807
   26    HB3  HIS   4           1HB      HIS   4  20.889  13.446   6.331
   27    HD1  HIS   4           HD1      HIS   4  18.262  11.002   7.417
   28    HD2  HIS   4           HD2      HIS   4  21.919  12.468   8.732
   29    HE1  HIS   4           HE1      HIS   4  18.961   9.486   9.285
   30    HE2  HIS   4           HE2      HIS   4  21.262  10.272   9.921
   31    H    HIS   5           H        HIS   5  20.924  16.158   6.839
   32    HA   HIS   5           HA       HIS   5  19.563  17.897   5.019
   33    HB2  HIS   5           2HB      HIS   5  21.220  18.774   6.587
   34    HB3  HIS   5           1HB      HIS   5  22.477  17.788   5.849
   35    HD1  HIS   5           HD1      HIS   5  20.280  20.766   5.111
   36    HD2  HIS   5           HD2      HIS   5  23.708  18.929   3.651
   37    HE1  HIS   5           HE1      HIS   5  21.204  22.339   3.391
   38    HE2  HIS   5           HE2      HIS   5  23.349  21.281   2.630
   39    H    HIS   6           H        HIS   6  21.927  15.300   4.661
   40    HA   HIS   6           HA       HIS   6  22.443  15.671   1.893
   41    HB2  HIS   6           2HB      HIS   6  22.539  13.116   3.525
   42    HB3  HIS   6           1HB      HIS   6  23.242  13.331   1.926
   43    HD1  HIS   6           HD1      HIS   6  24.191  13.352   5.354
   44    HD2  HIS   6           HD2      HIS   6  25.262  15.607   2.033
   45    HE1  HIS   6           HE1      HIS   6  26.385  14.411   5.940
   46    HE2  HIS   6           HE2      HIS   6  27.062  15.695   3.887
   47    H    HIS   7           H        HIS   7  20.765  15.827   0.506
   48    HA   HIS   7           HA       HIS   7  18.223  14.659   1.093
   49    HB2  HIS   7           2HB      HIS   7  18.547  16.899   0.029
   50    HB3  HIS   7           1HB      HIS   7  19.074  16.083  -1.438
   51    HD1  HIS   7           HD1      HIS   7  16.054  16.953   0.536
   52    HD2  HIS   7           HD2      HIS   7  16.991  14.816  -2.900
   53    HE1  HIS   7           HE1      HIS   7  13.866  16.547  -0.616
   54    HE2  HIS   7           HE2      HIS   7  14.491  15.477  -2.803
   55    H    HIS   8           H        HIS   8  18.963  12.394   1.085
   56    HA   HIS   8           HA       HIS   8  18.818  11.246  -1.633
   57    HB2  HIS   8           2HB      HIS   8  19.826   9.987   0.936
   58    HB3  HIS   8           1HB      HIS   8  19.671   9.138  -0.601
   59    HD1  HIS   8           HD1      HIS   8  21.303   9.905  -2.528
   60    HD2  HIS   8           HD2      HIS   8  22.098  11.525   1.214
   61    HE1  HIS   8           HE1      HIS   8  23.616  10.866  -2.687
   62    HE2  HIS   8           HE2      HIS   8  23.981  12.017  -0.487
   63    H    SER   9           H        SER   9  16.599  11.369  -1.887
   64    HA   SER   9           HA       SER   9  15.007   9.497  -0.317
   65    HB2  SER   9           2HB      SER   9  14.756  11.557   0.961
   66    HB3  SER   9           1HB      SER   9  14.324  12.446  -0.498
   67    HG   SER   9           HG       SER   9  12.836  10.458   0.865
   68    H    HIS  10           H        HIS  10  14.367   8.243  -1.956
   69    HA   HIS  10           HA       HIS  10  12.817   9.513  -4.121
   70    HB2  HIS  10           2HB      HIS  10  13.514   7.688  -5.631
   71    HB3  HIS  10           1HB      HIS  10  14.892   8.619  -5.060
   72    HD1  HIS  10           HD1      HIS  10  13.781   5.231  -5.486
   73    HD2  HIS  10           HD2      HIS  10  16.270   7.209  -2.809
   74    HE1  HIS  10           HE1      HIS  10  15.144   3.437  -4.383
   75    HE2  HIS  10           HE2      HIS  10  16.764   4.675  -2.913
   76    H    MET  11           H        MET  11  10.737   8.982  -4.048
   77    HA   MET  11           HA       MET  11   9.722   7.300  -2.037
   78    HB2  MET  11           2HB      MET  11   8.302   8.412  -4.469
   79    HB3  MET  11           1HB      MET  11   7.515   7.727  -3.051
   80    HG2  MET  11           2HG      MET  11   9.183  10.231  -3.175
   81    HG3  MET  11           1HG      MET  11   7.446  10.111  -2.887
   82    HE1  MET  11           3HE      MET  11   9.497  11.764  -1.061
   83    HE2  MET  11           1HE      MET  11   8.948  11.340   0.561
   84    HE3  MET  11           2HE      MET  11   7.773  11.696  -0.702
   85    H    VAL  12           H        VAL  12   8.510   5.382  -2.154
   86    HA   VAL  12           HA       VAL  12   8.974   3.706  -4.543
   87    HB   VAL  12           HB       VAL  12   9.072   2.777  -1.656
   88   HG11  VAL  12          1HG1      VAL  12   9.789   0.621  -2.589
   89   HG12  VAL  12          2HG1      VAL  12   9.548   1.249  -4.219
   90   HG13  VAL  12          3HG1      VAL  12   8.170   1.059  -3.134
   91   HG21  VAL  12          3HG2      VAL  12  11.454   2.361  -2.081
   92   HG22  VAL  12          1HG2      VAL  12  11.051   4.069  -2.244
   93   HG23  VAL  12          2HG2      VAL  12  11.294   3.077  -3.684
   94    H    VAL  13           H        VAL  13   7.167   2.843  -5.383
   95    HA   VAL  13           HA       VAL  13   4.657   3.189  -3.873
   96    HB   VAL  13           HB       VAL  13   3.509   3.227  -6.035
   97   HG11  VAL  13          1HG1      VAL  13   4.307   5.342  -5.117
   98   HG12  VAL  13          2HG1      VAL  13   4.387   5.362  -6.879
   99   HG13  VAL  13          3HG1      VAL  13   5.857   5.131  -5.931
  100   HG21  VAL  13          3HG2      VAL  13   6.270   2.926  -7.236
  101   HG22  VAL  13          1HG2      VAL  13   4.793   3.264  -8.140
  102   HG23  VAL  13          2HG2      VAL  13   4.973   1.730  -7.289
  103    H    ILE  14           H        ILE  14   2.868   1.647  -4.821
  104    HA   ILE  14           HA       ILE  14   3.896  -1.077  -5.228
  105    HB   ILE  14           HB       ILE  14   3.309  -0.845  -2.833
  106   HG12  ILE  14          2HG1      ILE  14   1.385  -2.592  -4.394
  107   HG13  ILE  14          1HG1      ILE  14   3.032  -3.023  -3.949
  108   HG21  ILE  14          1HG2      ILE  14   0.526  -0.219  -3.827
  109   HG22  ILE  14          2HG2      ILE  14   1.618   0.901  -3.013
  110   HG23  ILE  14          3HG2      ILE  14   0.981  -0.495  -2.145
  111   HD11  ILE  14          3HD1      ILE  14   1.431  -4.086  -2.484
  112   HD12  ILE  14          1HD1      ILE  14   0.760  -2.515  -2.044
  113   HD13  ILE  14          2HD1      ILE  14   2.413  -2.928  -1.589
  114    H    ARG  15           H        ARG  15   2.623  -2.356  -6.608
  115    HA   ARG  15           HA       ARG  15   0.260  -1.024  -7.770
  116    HB2  ARG  15           2HB      ARG  15   0.987  -1.605 -10.019
  117    HB3  ARG  15           1HB      ARG  15   2.181  -0.591  -9.222
  118    HG2  ARG  15           2HG      ARG  15   3.611  -2.495  -8.827
  119    HG3  ARG  15           1HG      ARG  15   2.382  -3.591  -9.466
  120    HD2  ARG  15           2HD      ARG  15   2.561  -2.528 -11.660
  121    HD3  ARG  15           1HD      ARG  15   3.766  -1.406 -11.030
  122    HE   ARG  15           HE       ARG  15   4.977  -3.685 -10.525
  123   HH11  ARG  15          1HH1      ARG  15   3.195  -2.809 -13.342
  124   HH12  ARG  15          2HH1      ARG  15   4.203  -3.737 -14.396
  125   HH21  ARG  15          1HH2      ARG  15   6.237  -4.897 -11.880
  126   HH22  ARG  15          2HH2      ARG  15   5.884  -4.935 -13.573
  127    H    ARG  16           H        ARG  16  -0.732  -2.627  -9.509
  128    HA   ARG  16           HA       ARG  16  -2.030  -4.450  -9.852
  129    HB2  ARG  16           2HB      ARG  16   0.467  -5.460  -9.538
  130    HB3  ARG  16           1HB      ARG  16  -0.347  -6.286  -8.220
  131    HG2  ARG  16           2HG      ARG  16  -1.121  -6.385 -11.140
  132    HG3  ARG  16           1HG      ARG  16  -0.326  -7.663 -10.223
  133    HD2  ARG  16           2HD      ARG  16  -2.320  -7.806  -8.762
  134    HD3  ARG  16           1HD      ARG  16  -3.110  -6.586  -9.759
  135    HE   ARG  16           HE       ARG  16  -2.270  -8.726 -11.378
  136   HH11  ARG  16          1HH1      ARG  16  -4.662  -7.910  -9.037
  137   HH12  ARG  16          2HH1      ARG  16  -5.763  -9.126  -9.583
  138   HH21  ARG  16          1HH2      ARG  16  -3.714 -10.255 -12.084
  139   HH22  ARG  16          2HH2      ARG  16  -5.242 -10.418 -11.292
  140    H    LEU  17           H        LEU  17  -2.574  -2.791  -7.546
  141    HA   LEU  17           HA       LEU  17  -3.574  -4.581  -5.491
  142    HB2  LEU  17           2HB      LEU  17  -3.595  -1.608  -5.882
  143    HB3  LEU  17           1HB      LEU  17  -4.705  -2.331  -4.736
  144    HG   LEU  17           HG       LEU  17  -2.728  -1.530  -3.587
  145   HD11  LEU  17          1HD1      LEU  17  -2.076  -3.565  -2.413
  146   HD12  LEU  17          2HD1      LEU  17  -2.758  -4.548  -3.709
  147   HD13  LEU  17          3HD1      LEU  17  -3.814  -3.541  -2.717
  148   HD21  LEU  17          3HD2      LEU  17  -1.121  -1.619  -5.407
  149   HD22  LEU  17          1HD2      LEU  17  -1.165  -3.383  -5.387
  150   HD23  LEU  17          2HD2      LEU  17  -0.515  -2.501  -4.006
  151    HA   PRO  18           HA       PRO  18  -7.472  -4.832  -7.792
  152    HB2  PRO  18           2HB      PRO  18  -8.081  -7.353  -7.154
  153    HB3  PRO  18           1HB      PRO  18  -6.781  -6.991  -8.294
  154    HG2  PRO  18           2HG      PRO  18  -6.617  -7.879  -5.458
  155    HG3  PRO  18           1HG      PRO  18  -5.515  -8.209  -6.804
  156    HD2  PRO  18           2HD      PRO  18  -5.218  -6.221  -4.784
  157    HD3  PRO  18           1HD      PRO  18  -4.211  -6.441  -6.228
  158    HA   PRO  19           HA       PRO  19 -10.313  -3.739  -4.471
  159    HB2  PRO  19           2HB      PRO  19 -12.358  -4.811  -6.364
  160    HB3  PRO  19           1HB      PRO  19 -12.289  -3.241  -5.553
  161    HG2  PRO  19           2HG      PRO  19 -11.717  -3.443  -8.143
  162    HG3  PRO  19           1HG      PRO  19 -10.769  -2.369  -7.092
  163    HD2  PRO  19           2HD      PRO  19 -10.066  -5.084  -8.158
  164    HD3  PRO  19           1HD      PRO  19  -9.041  -3.644  -7.973
  165    H    GLY  20           H        GLY  20 -11.514  -4.794  -2.848
  166    HA2  GLY  20           2HA      GLY  20 -12.688  -7.241  -2.803
  167    HA3  GLY  20           1HA      GLY  20 -10.986  -7.636  -2.655
  168    H    LEU  21           H        LEU  21 -10.667  -5.015  -1.127
  169    HA   LEU  21           HA       LEU  21 -12.051  -5.600   1.362
  170    HB2  LEU  21           2HB      LEU  21 -10.102  -5.836   2.719
  171    HB3  LEU  21           1HB      LEU  21 -10.001  -7.008   1.421
  172    HG   LEU  21           HG       LEU  21  -8.456  -4.406   1.575
  173   HD11  LEU  21          1HD1      LEU  21  -7.714  -6.045   3.226
  174   HD12  LEU  21          2HD1      LEU  21  -6.507  -5.821   1.960
  175   HD13  LEU  21          3HD1      LEU  21  -7.533  -7.256   1.956
  176   HD21  LEU  21          3HD2      LEU  21  -8.907  -5.041  -0.746
  177   HD22  LEU  21          1HD2      LEU  21  -8.275  -6.659  -0.438
  178   HD23  LEU  21          2HD2      LEU  21  -7.202  -5.260  -0.354
  179    H    THR  22           H        THR  22 -11.430  -3.986   3.093
  180    HA   THR  22           HA       THR  22 -11.384  -1.313   1.878
  181    HB   THR  22           HB       THR  22 -12.220  -2.138   4.680
  182    HG1  THR  22           HG1      THR  22 -14.121  -2.509   3.838
  183   HG21  THR  22          3HG2      THR  22 -12.564   0.489   3.216
  184   HG22  THR  22          1HG2      THR  22 -11.492   0.198   4.588
  185   HG23  THR  22          2HG2      THR  22 -13.239   0.099   4.798
  186    H    LYS  23           H        LYS  23 -10.115   0.372   2.826
  187    HA   LYS  23           HA       LYS  23  -7.467  -0.074   3.212
  188    HB2  LYS  23           2HB      LYS  23  -7.359   2.184   4.234
  189    HB3  LYS  23           1HB      LYS  23  -8.337   2.123   2.774
  190    HG2  LYS  23           2HG      LYS  23 -10.340   1.863   4.378
  191    HG3  LYS  23           1HG      LYS  23  -9.226   2.430   5.623
  192    HD2  LYS  23           2HD      LYS  23 -10.008   3.888   3.094
  193    HD3  LYS  23           1HD      LYS  23 -10.490   4.297   4.740
  194    HE2  LYS  23           2HE      LYS  23  -8.161   4.767   5.313
  195    HE3  LYS  23           1HE      LYS  23  -7.660   4.335   3.678
  196    HZ1  LYS  23           3HZ      LYS  23  -7.845   6.724   3.957
  197    HZ2  LYS  23           1HZ      LYS  23  -9.471   6.577   4.391
  198    HZ3  LYS  23           2HZ      LYS  23  -8.974   6.170   2.828
  199    H    GLU  24           H        GLU  24  -9.929  -0.448   5.649
  200    HA   GLU  24           HA       GLU  24  -8.562  -0.321   8.032
  201    HB2  GLU  24           2HB      GLU  24 -10.601  -2.437   7.304
  202    HB3  GLU  24           1HB      GLU  24 -10.195  -1.894   8.927
  203    HG2  GLU  24           2HG      GLU  24 -11.109   0.306   8.444
  204    HG3  GLU  24           1HG      GLU  24 -11.460  -0.188   6.787
  205    H    GLN  25           H        GLN  25  -9.020  -3.362   6.176
  206    HA   GLN  25           HA       GLN  25  -6.837  -4.628   7.669
  207    HB2  GLN  25           2HB      GLN  25  -8.584  -5.822   5.500
  208    HB3  GLN  25           1HB      GLN  25  -7.556  -6.694   6.629
  209    HG2  GLN  25           2HG      GLN  25  -8.999  -5.929   8.484
  210    HG3  GLN  25           1HG      GLN  25 -10.047  -5.139   7.303
  211   HE21  GLN  25          1HE2      GLN  25 -11.273  -6.438   5.890
  212   HE22  GLN  25          2HE2      GLN  25 -11.589  -8.102   6.227
  213    H    LEU  26           H        LEU  26  -7.124  -2.784   4.950
  214    HA   LEU  26           HA       LEU  26  -5.270  -4.246   3.263
  215    HB2  LEU  26           2HB      LEU  26  -7.045  -3.207   2.130
  216    HB3  LEU  26           1HB      LEU  26  -6.831  -1.700   2.984
  217    HG   LEU  26           HG       LEU  26  -4.627  -1.445   1.739
  218   HD11  LEU  26          1HD1      LEU  26  -4.301  -3.765   1.098
  219   HD12  LEU  26          2HD1      LEU  26  -4.381  -2.741  -0.335
  220   HD13  LEU  26          3HD1      LEU  26  -5.771  -3.726   0.122
  221   HD21  LEU  26          3HD2      LEU  26  -7.169  -1.532   0.110
  222   HD22  LEU  26          1HD2      LEU  26  -5.703  -0.642  -0.303
  223   HD23  LEU  26          2HD2      LEU  26  -6.632  -0.194   1.126
  224    H    GLU  27           H        GLU  27  -5.206  -1.324   5.294
  225    HA   GLU  27           HA       GLU  27  -2.684  -0.388   4.337
  226    HB2  GLU  27           2HB      GLU  27  -2.768   1.215   6.152
  227    HB3  GLU  27           1HB      GLU  27  -4.360   1.085   5.415
  228    HG2  GLU  27           2HG      GLU  27  -5.151  -0.274   7.244
  229    HG3  GLU  27           1HG      GLU  27  -3.536  -0.325   7.948
  230    H    GLU  28           H        GLU  28  -3.584  -2.680   6.811
  231    HA   GLU  28           HA       GLU  28  -1.490  -2.397   8.609
  232    HB2  GLU  28           2HB      GLU  28  -1.998  -4.703   9.331
  233    HB3  GLU  28           1HB      GLU  28  -3.430  -3.707   9.150
  234    HG2  GLU  28           2HG      GLU  28  -3.895  -4.768   6.993
  235    HG3  GLU  28           1HG      GLU  28  -2.460  -5.775   7.184
  236    H    GLN  29           H        GLN  29  -1.446  -4.120   5.529
  237    HA   GLN  29           HA       GLN  29   1.320  -4.976   6.074
  238    HB2  GLN  29           2HB      GLN  29   1.107  -6.310   3.972
  239    HB3  GLN  29           1HB      GLN  29  -0.010  -6.777   5.245
  240    HG2  GLN  29           2HG      GLN  29  -0.997  -4.813   3.249
  241    HG3  GLN  29           1HG      GLN  29  -0.749  -6.467   2.693
  242   HE21  GLN  29          1HE2      GLN  29  -3.223  -4.929   3.050
  243   HE22  GLN  29          2HE2      GLN  29  -4.201  -5.870   4.120
  244    H    LEU  30           H        LEU  30  -0.234  -2.381   4.640
  245    HA   LEU  30           HA       LEU  30   1.771  -2.043   2.524
  246    HB2  LEU  30           2HB      LEU  30  -0.685  -0.393   3.137
  247    HB3  LEU  30           1HB      LEU  30   0.392  -0.150   1.773
  248    HG   LEU  30           HG       LEU  30  -1.445  -2.498   2.257
  249   HD11  LEU  30          1HD1      LEU  30  -2.512  -0.490   1.359
  250   HD12  LEU  30          2HD1      LEU  30  -2.483  -1.796   0.175
  251   HD13  LEU  30          3HD1      LEU  30  -1.343  -0.456   0.036
  252   HD21  LEU  30          3HD2      LEU  30  -0.610  -3.426   0.155
  253   HD22  LEU  30          1HD2      LEU  30   0.669  -3.327   1.365
  254   HD23  LEU  30          2HD2      LEU  30   0.597  -2.143   0.060
  255    H    ARG  31           H        ARG  31   1.166  -0.925   5.738
  256    HA   ARG  31           HA       ARG  31   3.363   1.005   5.385
  257    HB2  ARG  31           2HB      ARG  31   2.172   2.592   6.929
  258    HB3  ARG  31           1HB      ARG  31   1.447   2.397   5.343
  259    HG2  ARG  31           2HG      ARG  31  -0.379   2.425   6.773
  260    HG3  ARG  31           1HG      ARG  31  -0.128   0.707   6.486
  261    HD2  ARG  31           2HD      ARG  31   1.004   0.486   8.627
  262    HD3  ARG  31           1HD      ARG  31   0.877   2.224   8.901
  263    HE   ARG  31           HE       ARG  31  -1.702   1.445   8.575
  264   HH11  ARG  31          1HH1      ARG  31   0.855   0.434  10.656
  265   HH12  ARG  31          2HH1      ARG  31  -0.221  -0.072  11.906
  266   HH21  ARG  31          1HH2      ARG  31  -3.064   0.821  10.194
  267   HH22  ARG  31          2HH2      ARG  31  -2.419   0.130  11.645
  268    HA   PRO  32           HA       PRO  32   3.593  -1.440   9.494
  269    HB2  PRO  32           2HB      PRO  32   4.791  -3.754   8.946
  270    HB3  PRO  32           1HB      PRO  32   3.070  -3.533   8.600
  271    HG2  PRO  32           2HG      PRO  32   5.410  -3.402   6.725
  272    HG3  PRO  32           1HG      PRO  32   3.835  -4.186   6.493
  273    HD2  PRO  32           2HD      PRO  32   4.505  -1.676   5.522
  274    HD3  PRO  32           1HD      PRO  32   2.845  -2.240   5.801
  275    H    LEU  33           H        LEU  33   5.411   0.492   8.148
  276    HA   LEU  33           HA       LEU  33   8.104  -0.505   8.477
  277    HB2  LEU  33           2HB      LEU  33   7.024   2.228   7.788
  278    HB3  LEU  33           1HB      LEU  33   8.732   1.885   7.936
  279    HG   LEU  33           HG       LEU  33   8.499   0.221   6.076
  280   HD11  LEU  33          1HD1      LEU  33   6.128  -0.266   6.241
  281   HD12  LEU  33          2HD1      LEU  33   6.517   0.349   4.635
  282   HD13  LEU  33          3HD1      LEU  33   5.733   1.400   5.816
  283   HD21  LEU  33          3HD2      LEU  33   9.357   2.452   5.662
  284   HD22  LEU  33          1HD2      LEU  33   7.718   3.074   5.471
  285   HD23  LEU  33          2HD2      LEU  33   8.365   1.918   4.305
  286    HA   PRO  34           HA       PRO  34   9.036   0.519  12.654
  287    HB2  PRO  34           2HB      PRO  34  11.412   2.040  11.699
  288    HB3  PRO  34           1HB      PRO  34  11.320   0.688  12.831
  289    HG2  PRO  34           2HG      PRO  34  12.234   0.320  10.353
  290    HG3  PRO  34           1HG      PRO  34  11.208  -0.900  11.133
  291    HD2  PRO  34           2HD      PRO  34  10.493   1.128   9.049
  292    HD3  PRO  34           1HD      PRO  34   9.964  -0.560   9.212
  293    H    ALA  35           H        ALA  35   9.882   3.332  10.606
  294    HA   ALA  35           HA       ALA  35   8.069   5.043  12.104
  295    HB1  ALA  35           3HB      ALA  35  11.030   5.661  12.040
  296    HB2  ALA  35           1HB      ALA  35  10.120   5.139  13.457
  297    HB3  ALA  35           2HB      ALA  35   9.767   6.695  12.706
  298    H    HIS  36           H        HIS  36   7.022   6.226  10.591
  299    HA   HIS  36           HA       HIS  36   8.317   7.596   8.456
  300    HB2  HIS  36           2HB      HIS  36   7.620   6.267   6.564
  301    HB3  HIS  36           1HB      HIS  36   8.503   5.210   7.664
  302    HD1  HIS  36           HD1      HIS  36   5.627   5.126   5.642
  303    HD2  HIS  36           HD2      HIS  36   6.404   3.939   9.551
  304    HE1  HIS  36           HE1      HIS  36   3.827   3.473   6.218
  305    HE2  HIS  36           HE2      HIS  36   4.211   2.912   8.645
  306    H    ASP  37           H        ASP  37   6.546   8.049   6.643
  307    HA   ASP  37           HA       ASP  37   3.969   8.666   7.924
  308    HB2  ASP  37           2HB      ASP  37   5.221  10.582   6.985
  309    HB3  ASP  37           1HB      ASP  37   5.257   9.790   5.413
  310    H    TYR  38           H        TYR  38   2.009   8.036   6.836
  311    HA   TYR  38           HA       TYR  38   2.404   5.976   4.757
  312    HB2  TYR  38           2HB      TYR  38   0.037   5.222   5.532
  313    HB3  TYR  38           1HB      TYR  38   1.442   4.802   6.498
  314    HD1  TYR  38           HD1      TYR  38  -1.495   7.056   6.305
  315    HD2  TYR  38           HD2      TYR  38   1.686   5.589   8.731
  316    HE1  TYR  38           HE1      TYR  38  -2.553   8.045   8.292
  317    HE2  TYR  38           HE2      TYR  38   0.633   6.580  10.717
  318    HH   TYR  38           HH       TYR  38  -2.559   7.718  10.732
  319    H    PHE  39           H        PHE  39   1.126   5.909   2.946
  320    HA   PHE  39           HA       PHE  39   0.212   8.529   2.083
  321    HB2  PHE  39           2HB      PHE  39   1.639   6.445   0.881
  322    HB3  PHE  39           1HB      PHE  39   0.075   6.403   0.082
  323    HD1  PHE  39           HD1      PHE  39  -0.695   9.184  -0.154
  324    HD2  PHE  39           HD2      PHE  39   3.160   7.412  -0.546
  325    HE1  PHE  39           HE1      PHE  39   0.002  11.027  -1.623
  326    HE2  PHE  39           HE2      PHE  39   3.861   9.258  -2.012
  327    HZ   PHE  39           HZ       PHE  39   2.281  11.066  -2.552
  328    H    GLU  40           H        GLU  40  -1.498   7.605  -0.029
  329    HA   GLU  40           HA       GLU  40  -3.966   7.328   1.475
  330    HB2  GLU  40           2HB      GLU  40  -5.038   7.777  -0.743
  331    HB3  GLU  40           1HB      GLU  40  -3.940   9.039  -0.202
  332    HG2  GLU  40           2HG      GLU  40  -2.198   8.161  -1.691
  333    HG3  GLU  40           1HG      GLU  40  -3.309   6.908  -2.240
  334    H    PHE  41           H        PHE  41  -5.442   5.695   1.282
  335    HA   PHE  41           HA       PHE  41  -4.672   3.311  -0.287
  336    HB2  PHE  41           2HB      PHE  41  -6.139   3.287   2.370
  337    HB3  PHE  41           1HB      PHE  41  -5.558   1.891   1.468
  338    HD1  PHE  41           HD1      PHE  41  -3.057   1.582   1.195
  339    HD2  PHE  41           HD2      PHE  41  -4.754   4.382   3.923
  340    HE1  PHE  41           HE1      PHE  41  -0.931   1.669   2.424
  341    HE2  PHE  41           HE2      PHE  41  -2.625   4.470   5.155
  342    HZ   PHE  41           HZ       PHE  41  -0.713   3.114   4.406
  343    H    PHE  42           H        PHE  42  -6.565   1.915  -0.901
  344    HA   PHE  42           HA       PHE  42  -8.878   3.620  -1.544
  345    HB2  PHE  42           2HB      PHE  42  -9.363   2.118  -3.371
  346    HB3  PHE  42           1HB      PHE  42  -7.667   2.569  -3.447
  347    HD1  PHE  42           HD2      PHE  42  -5.917   0.921  -2.831
  348    HD2  PHE  42           HD1      PHE  42 -10.035  -0.152  -3.053
  349    HE1  PHE  42           HE2      PHE  42  -5.289  -1.452  -2.934
  350    HE2  PHE  42           HE1      PHE  42  -9.410  -2.530  -3.156
  351    HZ   PHE  42           HZ       PHE  42  -7.036  -3.183  -3.096
  352    H    ALA  43           H        ALA  43 -11.033   2.697  -1.495
  353    HA   ALA  43           HA       ALA  43 -11.364   0.423   0.363
  354    HB1  ALA  43           3HB      ALA  43 -11.794   2.520   1.568
  355    HB2  ALA  43           1HB      ALA  43 -13.259   1.547   1.411
  356    HB3  ALA  43           2HB      ALA  43 -13.018   2.954   0.375
  357    H    ALA  44           H        ALA  44 -11.837  -1.034  -1.259
  358    HA   ALA  44           HA       ALA  44 -14.431  -0.675  -2.600
  359    HB1  ALA  44           3HB      ALA  44 -12.729  -0.047  -4.236
  360    HB2  ALA  44           1HB      ALA  44 -13.536  -1.544  -4.707
  361    HB3  ALA  44           2HB      ALA  44 -11.919  -1.596  -4.004
  362    H    ASP  45           H        ASP  45 -15.701  -2.349  -2.161
  363    HA   ASP  45           HA       ASP  45 -14.680  -4.663  -0.804
  364    HB2  ASP  45           2HB      ASP  45 -17.068  -5.334  -0.685
  365    HB3  ASP  45           1HB      ASP  45 -16.788  -3.693  -0.109
  366    H    LEU  46           H        LEU  46 -15.363  -6.892  -1.399
  367    HA   LEU  46           HA       LEU  46 -14.717  -7.410  -4.195
  368    HB2  LEU  46           2HB      LEU  46 -14.523  -9.779  -3.437
  369    HB3  LEU  46           1HB      LEU  46 -13.467  -8.651  -2.602
  370    HG   LEU  46           HG       LEU  46 -15.260  -8.637  -0.743
  371   HD11  LEU  46          1HD1      LEU  46 -16.063 -11.183  -2.148
  372   HD12  LEU  46          2HD1      LEU  46 -17.056  -9.739  -1.952
  373   HD13  LEU  46          3HD1      LEU  46 -16.586 -10.682  -0.540
  374   HD21  LEU  46          3HD2      LEU  46 -13.629 -11.129  -1.243
  375   HD22  LEU  46          1HD2      LEU  46 -14.269 -10.603   0.315
  376   HD23  LEU  46          2HD2      LEU  46 -13.045  -9.637  -0.507
  377    H    SER  47           H        SER  47 -17.500  -6.624  -2.874
  378    HA   SER  47           HA       SER  47 -19.166  -8.736  -4.044
  379    HB2  SER  47           2HB      SER  47 -20.047  -6.234  -2.571
  380    HB3  SER  47           1HB      SER  47 -21.030  -7.650  -2.942
  381    HG   SER  47           HG       SER  47 -19.164  -7.249  -0.941
  382    H    LEU  48           H        LEU  48 -17.960  -5.606  -4.722
  383    HA   LEU  48           HA       LEU  48 -19.924  -4.967  -6.769
  384    HB2  LEU  48           2HB      LEU  48 -19.058  -3.176  -5.388
  385    HB3  LEU  48           1HB      LEU  48 -17.411  -3.582  -5.825
  386    HG   LEU  48           HG       LEU  48 -17.961  -2.940  -8.194
  387   HD11  LEU  48          1HD1      LEU  48 -20.494  -1.880  -6.940
  388   HD12  LEU  48          2HD1      LEU  48 -20.379  -3.198  -8.106
  389   HD13  LEU  48          3HD1      LEU  48 -19.945  -1.558  -8.584
  390   HD21  LEU  48          3HD2      LEU  48 -18.261  -0.817  -6.072
  391   HD22  LEU  48          1HD2      LEU  48 -17.859  -0.521  -7.763
  392   HD23  LEU  48          2HD2      LEU  48 -16.749  -1.429  -6.740
  393    H    TYR  49           H        TYR  49 -19.662  -5.262  -8.933
  394    HA   TYR  49           HA       TYR  49 -17.211  -6.476  -9.919
  395    HB2  TYR  49           2HB      TYR  49 -19.838  -5.816 -11.271
  396    HB3  TYR  49           1HB      TYR  49 -18.464  -6.528 -12.114
  397    HD1  TYR  49           HD2      TYR  49 -17.447  -8.658 -10.818
  398    HD2  TYR  49           HD1      TYR  49 -21.475  -7.305 -10.529
  399    HE1  TYR  49           HE2      TYR  49 -18.142 -10.901 -10.096
  400    HE2  TYR  49           HE1      TYR  49 -22.179  -9.549  -9.804
  401    HH   TYR  49           HH       TYR  49 -21.373 -11.891  -9.995
  402    HA   PRO  50           HA       PRO  50 -15.174  -2.671 -10.549
  403    HB2  PRO  50           2HB      PRO  50 -13.533  -3.438 -12.675
  404    HB3  PRO  50           1HB      PRO  50 -13.194  -3.688 -10.960
  405    HG2  PRO  50           2HG      PRO  50 -14.362  -5.586 -12.957
  406    HG3  PRO  50           1HG      PRO  50 -13.188  -5.899 -11.664
  407    HD2  PRO  50           2HD      PRO  50 -15.749  -6.597 -11.381
  408    HD3  PRO  50           1HD      PRO  50 -14.836  -5.929 -10.009
  409    H    HIS  51           H        HIS  51 -16.661  -1.199 -11.308
  410    HA   HIS  51           HA       HIS  51 -16.806  -0.852 -14.235
  411    HB2  HIS  51           2HB      HIS  51 -18.297   0.659 -12.062
  412    HB3  HIS  51           1HB      HIS  51 -18.558   0.802 -13.797
  413    HD1  HIS  51           HD1      HIS  51 -19.956  -0.785 -10.939
  414    HD2  HIS  51           HD2      HIS  51 -19.385  -1.904 -14.900
  415    HE1  HIS  51           HE1      HIS  51 -21.547  -2.681 -11.339
  416    HE2  HIS  51           HE2      HIS  51 -21.337  -3.188 -13.793
  417    H    LEU  52           H        LEU  52 -16.070   0.938 -11.246
  418    HA   LEU  52           HA       LEU  52 -14.220   2.686 -12.719
  419    HB2  LEU  52           2HB      LEU  52 -15.268   2.809  -9.880
  420    HB3  LEU  52           1HB      LEU  52 -14.025   3.877 -10.496
  421    HG   LEU  52           HG       LEU  52 -16.093   5.069 -10.522
  422   HD11  LEU  52          1HD1      LEU  52 -15.419   4.198 -13.330
  423   HD12  LEU  52          2HD1      LEU  52 -14.626   5.480 -12.414
  424   HD13  LEU  52          3HD1      LEU  52 -16.318   5.648 -12.879
  425   HD21  LEU  52          3HD2      LEU  52 -17.633   3.173 -10.459
  426   HD22  LEU  52          1HD2      LEU  52 -17.260   2.804 -12.145
  427   HD23  LEU  52          2HD2      LEU  52 -18.072   4.315 -11.728
  428    H    TYR  53           H        TYR  53 -12.116   3.155 -11.306
  429    HA   TYR  53           HA       TYR  53 -11.088   0.618 -10.215
  430    HB2  TYR  53           2HB      TYR  53  -9.668   2.259 -12.334
  431    HB3  TYR  53           1HB      TYR  53  -9.028   0.818 -11.547
  432    HD1  TYR  53           HD1      TYR  53 -10.091  -1.407 -11.995
  433    HD2  TYR  53           HD2      TYR  53 -11.211   2.090 -14.154
  434    HE1  TYR  53           HE1      TYR  53 -11.167  -2.811 -13.703
  435    HE2  TYR  53           HE2      TYR  53 -12.286   0.694 -15.870
  436    HH   TYR  53           HH       TYR  53 -12.787  -2.712 -15.419
  437    H    SER  54           H        SER  54  -9.406   0.799  -8.711
  438    HA   SER  54           HA       SER  54  -8.276   3.396  -8.075
  439    HB2  SER  54           2HB      SER  54  -9.046   3.417  -5.741
  440    HB3  SER  54           1HB      SER  54 -10.416   3.467  -6.850
  441    HG   SER  54           HG       SER  54 -11.055   1.574  -6.160
  442    H    ARG  55           H        ARG  55  -6.647   3.280  -6.355
  443    HA   ARG  55           HA       ARG  55  -5.736   0.704  -5.453
  444    HB2  ARG  55           2HB      ARG  55  -3.346   1.304  -6.476
  445    HB3  ARG  55           1HB      ARG  55  -4.526   0.345  -7.351
  446    HG2  ARG  55           2HG      ARG  55  -3.518   1.968  -8.823
  447    HG3  ARG  55           1HG      ARG  55  -5.224   2.339  -8.596
  448    HD2  ARG  55           2HD      ARG  55  -4.687   4.141  -7.085
  449    HD3  ARG  55           1HD      ARG  55  -2.978   3.701  -7.103
  450    HE   ARG  55           HE       ARG  55  -3.490   4.176  -9.706
  451   HH11  ARG  55          1HH1      ARG  55  -4.176   6.037  -6.884
  452   HH12  ARG  55          2HH1      ARG  55  -3.947   7.542  -7.698
  453   HH21  ARG  55          1HH2      ARG  55  -3.223   6.099 -10.732
  454   HH22  ARG  55          2HH2      ARG  55  -3.414   7.582  -9.857
  455    H    ALA  56           H        ALA  56  -3.350   1.094  -4.438
  456    HA   ALA  56           HA       ALA  56  -3.624   3.488  -2.723
  457    HB1  ALA  56           3HB      ALA  56  -2.811   2.150  -0.847
  458    HB2  ALA  56           1HB      ALA  56  -2.723   0.729  -1.890
  459    HB3  ALA  56           2HB      ALA  56  -4.287   1.463  -1.530
  460    H    TYR  57           H        TYR  57  -1.527   3.970  -1.502
  461    HA   TYR  57           HA       TYR  57   0.886   3.268  -3.024
  462    HB2  TYR  57           2HB      TYR  57  -0.074   6.079  -2.479
  463    HB3  TYR  57           1HB      TYR  57   1.610   5.716  -2.841
  464    HD1  TYR  57           HD2      TYR  57   2.164   4.632  -5.060
  465    HD2  TYR  57           HD1      TYR  57  -1.672   6.286  -4.228
  466    HE1  TYR  57           HE2      TYR  57   1.688   4.725  -7.469
  467    HE2  TYR  57           HE1      TYR  57  -2.155   6.382  -6.637
  468    HH   TYR  57           HH       TYR  57  -0.287   4.776  -8.966
  469    H    ILE  58           H        ILE  58   2.905   3.890  -1.897
  470    HA   ILE  58           HA       ILE  58   2.592   3.957   1.044
  471    HB   ILE  58           HB       ILE  58   4.823   2.579  -0.481
  472   HG12  ILE  58          2HG1      ILE  58   2.443   1.340   0.940
  473   HG13  ILE  58          1HG1      ILE  58   2.652   1.427  -0.807
  474   HG21  ILE  58          1HG2      ILE  58   5.412   1.609   1.694
  475   HG22  ILE  58          2HG2      ILE  58   4.115   2.525   2.460
  476   HG23  ILE  58          3HG2      ILE  58   5.486   3.371   1.739
  477   HD11  ILE  58          3HD1      ILE  58   4.651   0.013  -0.617
  478   HD12  ILE  58          1HD1      ILE  58   3.202  -0.776   0.006
  479   HD13  ILE  58          2HD1      ILE  58   4.387  -0.098   1.123
  480    H    ASN  59           H        ASN  59   4.096   5.242   2.214
  481    HA   ASN  59           HA       ASN  59   5.750   7.048   0.562
  482    HB2  ASN  59           2HB      ASN  59   3.741   8.140   1.589
  483    HB3  ASN  59           1HB      ASN  59   4.399   7.760   3.176
  484   HD21  ASN  59          1HD2      ASN  59   4.498   9.963   3.693
  485   HD22  ASN  59          2HD2      ASN  59   5.708  10.999   3.027
  486    H    PHE  60           H        PHE  60   7.859   7.015   0.957
  487    HA   PHE  60           HA       PHE  60   8.840   5.747   3.435
  488    HB2  PHE  60           2HB      PHE  60   9.987   5.891   0.654
  489    HB3  PHE  60           1HB      PHE  60  11.007   5.521   2.040
  490    HD1  PHE  60           HD2      PHE  60   8.065   4.360   0.107
  491    HD2  PHE  60           HD1      PHE  60  11.028   3.379   3.007
  492    HE1  PHE  60           HE2      PHE  60   7.414   1.991  -0.026
  493    HE2  PHE  60           HE1      PHE  60  10.381   1.015   2.876
  494    HZ   PHE  60           HZ       PHE  60   8.571   0.312   1.358
  495    H    ARG  61           H        ARG  61  10.452   6.703   4.662
  496    HA   ARG  61           HA       ARG  61  11.154   9.489   3.952
  497    HB2  ARG  61           2HB      ARG  61  10.674   8.461   6.761
  498    HB3  ARG  61           1HB      ARG  61  10.969  10.124   6.278
  499    HG2  ARG  61           2HG      ARG  61   8.518   8.471   5.673
  500    HG3  ARG  61           1HG      ARG  61   8.633   9.842   6.777
  501    HD2  ARG  61           2HD      ARG  61   8.979   9.923   3.776
  502    HD3  ARG  61           1HD      ARG  61   7.583  10.504   4.681
  503    HE   ARG  61           HE       ARG  61   9.199  12.118   5.725
  504   HH11  ARG  61          1HH1      ARG  61   9.723  10.835   2.567
  505   HH12  ARG  61          2HH1      ARG  61  10.616  12.217   2.042
  506   HH21  ARG  61          1HH2      ARG  61  10.318  13.880   5.047
  507   HH22  ARG  61          2HH2      ARG  61  10.963  13.932   3.442
  508    H    ASN  62           H        ASN  62  12.478   6.559   4.117
  509    HA   ASN  62           HA       ASN  62  15.106   7.506   4.939
  510    HB2  ASN  62           2HB      ASN  62  13.885   6.695   7.015
  511    HB3  ASN  62           1HB      ASN  62  13.886   5.091   6.297
  512   HD21  ASN  62          1HD2      ASN  62  15.154   4.144   7.801
  513   HD22  ASN  62          2HD2      ASN  62  16.823   4.534   8.037
  514    HA   PRO  63           HA       PRO  63  16.229   4.764   1.527
  515    HB2  PRO  63           2HB      PRO  63  18.912   4.544   2.240
  516    HB3  PRO  63           1HB      PRO  63  18.221   5.820   1.235
  517    HG2  PRO  63           2HG      PRO  63  18.854   5.846   4.163
  518    HG3  PRO  63           1HG      PRO  63  19.081   7.123   2.953
  519    HD2  PRO  63           2HD      PRO  63  17.042   7.208   4.678
  520    HD3  PRO  63           1HD      PRO  63  16.834   7.734   2.993
  521    H    ASP  64           H        ASP  64  17.393   4.034   4.831
  522    HA   ASP  64           HA       ASP  64  17.972   1.329   4.539
  523    HB2  ASP  64           2HB      ASP  64  16.759   2.733   6.934
  524    HB3  ASP  64           1HB      ASP  64  17.504   1.137   6.968
  525    H    ASP  65           H        ASP  65  14.888   2.735   5.659
  526    HA   ASP  65           HA       ASP  65  13.349   0.434   5.751
  527    HB2  ASP  65           2HB      ASP  65  12.511   3.253   5.012
  528    HB3  ASP  65           1HB      ASP  65  11.400   1.962   5.450
  529    H    ILE  66           H        ILE  66  14.006   2.551   2.982
  530    HA   ILE  66           HA       ILE  66  12.312   1.448   1.074
  531    HB   ILE  66           HB       ILE  66  15.055   2.668   0.749
  532   HG12  ILE  66          2HG1      ILE  66  12.278   3.770   0.236
  533   HG13  ILE  66          1HG1      ILE  66  13.293   4.158   1.620
  534   HG21  ILE  66          1HG2      ILE  66  14.504   2.934  -1.654
  535   HG22  ILE  66          2HG2      ILE  66  13.085   1.916  -1.411
  536   HG23  ILE  66          3HG2      ILE  66  14.699   1.249  -1.171
  537   HD11  ILE  66          3HD1      ILE  66  13.350   5.934  -0.018
  538   HD12  ILE  66          1HD1      ILE  66  13.887   4.802  -1.260
  539   HD13  ILE  66          2HD1      ILE  66  14.935   5.173   0.109
  540    H    LEU  67           H        LEU  67  15.798   0.645   1.396
  541    HA   LEU  67           HA       LEU  67  15.654  -1.513  -0.430
  542    HB2  LEU  67           2HB      LEU  67  17.940  -2.084   0.393
  543    HB3  LEU  67           1HB      LEU  67  17.746  -0.428  -0.137
  544    HG   LEU  67           HG       LEU  67  17.420   0.114   2.383
  545   HD11  LEU  67          1HD1      LEU  67  18.822  -2.551   2.596
  546   HD12  LEU  67          2HD1      LEU  67  17.219  -2.154   3.214
  547   HD13  LEU  67          3HD1      LEU  67  18.644  -1.376   3.901
  548   HD21  LEU  67          3HD2      LEU  67  19.316   0.876   1.083
  549   HD22  LEU  67          1HD2      LEU  67  20.110  -0.689   1.271
  550   HD23  LEU  67          2HD2      LEU  67  19.849   0.346   2.676
  551    H    LEU  68           H        LEU  68  15.074  -1.319   2.981
  552    HA   LEU  68           HA       LEU  68  15.283  -4.093   3.592
  553    HB2  LEU  68           2HB      LEU  68  15.437  -2.566   5.394
  554    HB3  LEU  68           1HB      LEU  68  13.957  -1.747   4.931
  555    HG   LEU  68           HG       LEU  68  12.638  -3.708   5.629
  556   HD11  LEU  68          1HD1      LEU  68  15.278  -4.850   6.554
  557   HD12  LEU  68          2HD1      LEU  68  14.302  -5.456   5.217
  558   HD13  LEU  68          3HD1      LEU  68  13.683  -5.537   6.865
  559   HD21  LEU  68          3HD2      LEU  68  14.539  -2.666   7.734
  560   HD22  LEU  68          1HD2      LEU  68  13.006  -3.480   8.046
  561   HD23  LEU  68          2HD2      LEU  68  13.022  -1.922   7.225
  562    H    PHE  69           H        PHE  69  12.361  -2.041   3.264
  563    HA   PHE  69           HA       PHE  69  10.636  -4.289   3.451
  564    HB2  PHE  69           2HB      PHE  69  10.245  -1.371   2.964
  565    HB3  PHE  69           1HB      PHE  69   8.899  -2.474   2.676
  566    HD1  PHE  69           HD1      PHE  69  11.270  -1.235   5.238
  567    HD2  PHE  69           HD2      PHE  69   7.721  -3.467   4.473
  568    HE1  PHE  69           HE1      PHE  69  10.801  -1.314   7.647
  569    HE2  PHE  69           HE2      PHE  69   7.247  -3.541   6.886
  570    HZ   PHE  69           HZ       PHE  69   8.790  -2.463   8.475
  571    H    ARG  70           H        ARG  70  11.851  -2.461   0.660
  572    HA   ARG  70           HA       ARG  70  10.260  -3.619  -1.325
  573    HB2  ARG  70           2HB      ARG  70  11.886  -1.795  -1.736
  574    HB3  ARG  70           1HB      ARG  70  13.211  -2.921  -1.496
  575    HG2  ARG  70           2HG      ARG  70  11.165  -3.392  -3.643
  576    HG3  ARG  70           1HG      ARG  70  12.508  -2.280  -3.901
  577    HD2  ARG  70           2HD      ARG  70  14.107  -4.060  -3.509
  578    HD3  ARG  70           1HD      ARG  70  12.812  -5.178  -3.091
  579    HE   ARG  70           HE       ARG  70  12.739  -4.027  -5.761
  580   HH11  ARG  70          1HH1      ARG  70  13.521  -6.732  -3.762
  581   HH12  ARG  70          2HH1      ARG  70  13.605  -7.823  -5.096
  582   HH21  ARG  70          1HH2      ARG  70  12.872  -5.453  -7.450
  583   HH22  ARG  70          2HH2      ARG  70  13.250  -7.113  -7.144
  584    H    ASP  71           H        ASP  71  13.164  -4.861   0.258
  585    HA   ASP  71           HA       ASP  71  13.491  -7.167  -1.363
  586    HB2  ASP  71           2HB      ASP  71  15.306  -6.151  -0.036
  587    HB3  ASP  71           1HB      ASP  71  14.481  -6.615   1.447
  588    H    ARG  72           H        ARG  72  11.291  -6.505   1.217
  589    HA   ARG  72           HA       ARG  72  10.704  -9.393   1.472
  590    HB2  ARG  72           2HB      ARG  72   9.860  -8.879   3.768
  591    HB3  ARG  72           1HB      ARG  72  11.587  -8.618   3.562
  592    HG2  ARG  72           2HG      ARG  72  11.186  -6.205   3.324
  593    HG3  ARG  72           1HG      ARG  72   9.461  -6.477   3.572
  594    HD2  ARG  72           2HD      ARG  72  11.630  -7.158   5.563
  595    HD3  ARG  72           1HD      ARG  72  10.631  -5.706   5.616
  596    HE   ARG  72           HE       ARG  72   8.934  -7.925   5.548
  597   HH11  ARG  72          1HH1      ARG  72  11.259  -6.511   7.685
  598   HH12  ARG  72          2HH1      ARG  72  10.458  -7.085   9.103
  599   HH21  ARG  72          1HH2      ARG  72   7.946  -8.680   7.371
  600   HH22  ARG  72          2HH2      ARG  72   8.610  -8.316   8.927
  601    H    PHE  73           H        PHE  73   9.513  -6.827  -0.066
  602    HA   PHE  73           HA       PHE  73   6.743  -7.779   0.194
  603    HB2  PHE  73           2HB      PHE  73   7.690  -4.973   0.652
  604    HB3  PHE  73           1HB      PHE  73   6.097  -5.247  -0.035
  605    HD1  PHE  73           HD1      PHE  73   4.381  -6.478   1.270
  606    HD2  PHE  73           HD2      PHE  73   8.120  -5.355   2.971
  607    HE1  PHE  73           HE1      PHE  73   3.456  -6.826   3.521
  608    HE2  PHE  73           HE2      PHE  73   7.198  -5.705   5.228
  609    HZ   PHE  73           HZ       PHE  73   4.865  -6.444   5.503
  610    H    ASP  74           H        ASP  74   9.214  -7.166  -1.898
  611    HA   ASP  74           HA       ASP  74   8.164  -5.784  -4.051
  612    HB2  ASP  74           2HB      ASP  74   9.771  -6.984  -5.450
  613    HB3  ASP  74           1HB      ASP  74  10.502  -6.547  -3.908
  614    H    GLY  75           H        GLY  75   7.276  -8.933  -2.939
  615    HA2  GLY  75           2HA      GLY  75   5.126  -9.093  -4.873
  616    HA3  GLY  75           1HA      GLY  75   6.342 -10.356  -5.036
  617    H    TYR  76           H        TYR  76   4.571  -8.771  -2.377
  618    HA   TYR  76           HA       TYR  76   4.505 -11.270  -0.882
  619    HB2  TYR  76           2HB      TYR  76   5.013  -9.582   0.583
  620    HB3  TYR  76           1HB      TYR  76   4.086  -8.383  -0.303
  621    HD1  TYR  76           HD2      TYR  76   3.599 -11.374   1.909
  622    HD2  TYR  76           HD1      TYR  76   2.077  -7.639   0.553
  623    HE1  TYR  76           HE2      TYR  76   1.805 -11.503   3.584
  624    HE2  TYR  76           HE1      TYR  76   0.285  -7.760   2.210
  625    HH   TYR  76           HH       TYR  76  -0.896  -9.398   3.542
  626    H    ILE  77           H        ILE  77   2.811 -12.622  -0.783
  627    HA   ILE  77           HA       ILE  77   0.289 -11.813  -2.060
  628    HB   ILE  77           HB       ILE  77   1.350 -14.556  -1.343
  629   HG12  ILE  77          2HG1      ILE  77   2.447 -13.481  -3.282
  630   HG13  ILE  77          1HG1      ILE  77   1.504 -14.888  -3.763
  631   HG21  ILE  77          1HG2      ILE  77  -1.074 -14.539  -1.102
  632   HG22  ILE  77          2HG2      ILE  77  -0.607 -15.455  -2.534
  633   HG23  ILE  77          3HG2      ILE  77  -1.248 -13.820  -2.705
  634   HD11  ILE  77          3HD1      ILE  77   1.251 -13.058  -5.335
  635   HD12  ILE  77          1HD1      ILE  77   0.657 -12.015  -4.044
  636   HD13  ILE  77          2HD1      ILE  77  -0.281 -13.423  -4.541
  637    H    PHE  78           H        PHE  78  -1.393 -11.290  -0.859
  638    HA   PHE  78           HA       PHE  78  -1.660 -12.414   1.862
  639    HB2  PHE  78           2HB      PHE  78  -1.393 -10.007   1.923
  640    HB3  PHE  78           1HB      PHE  78  -2.662  -9.790   0.723
  641    HD1  PHE  78           HD1      PHE  78  -2.088 -11.129   4.164
  642    HD2  PHE  78           HD2      PHE  78  -4.858  -9.394   1.418
  643    HE1  PHE  78           HE1      PHE  78  -3.749 -10.923   5.966
  644    HE2  PHE  78           HE2      PHE  78  -6.515  -9.189   3.224
  645    HZ   PHE  78           HZ       PHE  78  -5.965  -9.953   5.499
  646    H    LEU  79           H        LEU  79  -3.432 -13.622   2.322
  647    HA   LEU  79           HA       LEU  79  -5.477 -13.880   0.199
  648    HB2  LEU  79           2HB      LEU  79  -4.397 -15.923   2.140
  649    HB3  LEU  79           1HB      LEU  79  -5.819 -16.196   1.149
  650    HG   LEU  79           HG       LEU  79  -3.086 -15.576   0.007
  651   HD11  LEU  79          1HD1      LEU  79  -3.051 -17.700   1.244
  652   HD12  LEU  79          2HD1      LEU  79  -2.885 -17.941  -0.493
  653   HD13  LEU  79          3HD1      LEU  79  -4.428 -18.266   0.298
  654   HD21  LEU  79          3HD2      LEU  79  -4.967 -15.014  -1.451
  655   HD22  LEU  79          1HD2      LEU  79  -5.603 -16.650  -1.274
  656   HD23  LEU  79          2HD2      LEU  79  -4.055 -16.384  -2.081
  657    H    ASP  80           H        ASP  80  -7.494 -13.371   0.666
  658    HA   ASP  80           HA       ASP  80  -8.321 -12.748   3.381
  659    HB2  ASP  80           2HB      ASP  80  -8.938 -11.285   1.481
  660    HB3  ASP  80           1HB      ASP  80  -9.835 -12.610   0.751
  661    H    SER  81           H        SER  81 -10.624 -13.562   4.031
  662    HA   SER  81           HA       SER  81 -10.642 -16.358   4.290
  663    HB2  SER  81           2HB      SER  81 -12.982 -14.442   4.536
  664    HB3  SER  81           1HB      SER  81 -12.954 -16.104   5.132
  665    HG   SER  81           HG       SER  81 -10.921 -15.239   6.275
  666    H    LYS  82           H        LYS  82 -12.075 -14.284   1.844
  667    HA   LYS  82           HA       LYS  82 -13.681 -16.300   0.603
  668    HB2  LYS  82           2HB      LYS  82 -12.589 -13.742  -0.597
  669    HB3  LYS  82           1HB      LYS  82 -13.904 -14.713  -1.245
  670    HG2  LYS  82           2HG      LYS  82 -13.937 -13.239   1.390
  671    HG3  LYS  82           1HG      LYS  82 -14.714 -12.707  -0.102
  672    HD2  LYS  82           2HD      LYS  82 -16.105 -14.771  -0.059
  673    HD3  LYS  82           1HD      LYS  82 -15.377 -15.191   1.495
  674    HE2  LYS  82           2HE      LYS  82 -16.990 -12.701   0.911
  675    HE3  LYS  82           1HE      LYS  82 -17.570 -14.123   1.774
  676    HZ1  LYS  82           3HZ      LYS  82 -15.919 -13.715   3.489
  677    HZ2  LYS  82           1HZ      LYS  82 -16.924 -12.368   3.295
  678    HZ3  LYS  82           2HZ      LYS  82 -15.355 -12.352   2.663
  679    H    GLY  83           H        GLY  83 -10.370 -16.022   0.791
  680    HA2  GLY  83           2HA      GLY  83  -8.663 -17.169  -0.247
  681    HA3  GLY  83           1HA      GLY  83  -9.880 -18.040  -1.157
  682    H    LEU  84           H        LEU  84  -9.112 -14.573  -1.078
  683    HA   LEU  84           HA       LEU  84  -8.671 -14.661  -3.990
  684    HB2  LEU  84           2HB      LEU  84  -9.359 -12.312  -2.212
  685    HB3  LEU  84           1HB      LEU  84  -9.135 -12.237  -3.951
  686    HG   LEU  84           HG       LEU  84 -11.332 -13.741  -2.509
  687   HD11  LEU  84          1HD1      LEU  84 -12.823 -12.085  -3.500
  688   HD12  LEU  84          2HD1      LEU  84 -11.440 -11.245  -4.206
  689   HD13  LEU  84          3HD1      LEU  84 -11.631 -11.315  -2.454
  690   HD21  LEU  84          3HD2      LEU  84 -10.825 -13.404  -5.471
  691   HD22  LEU  84          1HD2      LEU  84 -12.250 -14.150  -4.746
  692   HD23  LEU  84          2HD2      LEU  84 -10.669 -14.902  -4.551
  693    H    GLU  85           H        GLU  85  -6.643 -14.452  -4.702
  694    HA   GLU  85           HA       GLU  85  -4.443 -13.855  -2.986
  695    HB2  GLU  85           2HB      GLU  85  -4.628 -14.139  -5.991
  696    HB3  GLU  85           1HB      GLU  85  -3.115 -13.907  -5.130
  697    HG2  GLU  85           2HG      GLU  85  -3.431 -16.006  -3.952
  698    HG3  GLU  85           1HG      GLU  85  -4.996 -16.227  -4.736
  699    H    TYR  86           H        TYR  86  -4.058 -11.832  -2.245
  700    HA   TYR  86           HA       TYR  86  -4.256  -9.572  -4.124
  701    HB2  TYR  86           2HB      TYR  86  -3.886  -9.578  -1.114
  702    HB3  TYR  86           1HB      TYR  86  -4.020  -8.136  -2.119
  703    HD1  TYR  86           HD1      TYR  86  -6.185  -7.745  -3.397
  704    HD2  TYR  86           HD2      TYR  86  -5.831 -10.690  -0.337
  705    HE1  TYR  86           HE1      TYR  86  -8.635  -7.824  -3.192
  706    HE2  TYR  86           HE2      TYR  86  -8.276 -10.771  -0.129
  707    HH   TYR  86           HH       TYR  86 -10.370  -9.362  -2.400
  708    HA   PRO  87           HA       PRO  87   0.236 -10.259  -4.194
  709    HB2  PRO  87           2HB      PRO  87   0.664  -9.596  -6.753
  710    HB3  PRO  87           1HB      PRO  87  -0.098 -11.127  -6.308
  711    HG2  PRO  87           2HG      PRO  87  -1.341  -8.627  -7.369
  712    HG3  PRO  87           1HG      PRO  87  -1.765 -10.318  -7.689
  713    HD2  PRO  87           2HD      PRO  87  -3.064  -8.613  -5.879
  714    HD3  PRO  87           1HD      PRO  87  -3.215 -10.380  -5.937
  715    H    ALA  88           H        ALA  88   0.939  -8.627  -2.846
  716    HA   ALA  88           HA       ALA  88   0.965  -5.861  -3.591
  717    HB1  ALA  88           3HB      ALA  88   2.500  -7.316  -1.434
  718    HB2  ALA  88           1HB      ALA  88   0.918  -6.558  -1.250
  719    HB3  ALA  88           2HB      ALA  88   2.337  -5.565  -1.584
  720    H    VAL  89           H        VAL  89   2.042  -5.580  -5.528
  721    HA   VAL  89           HA       VAL  89   4.824  -6.517  -5.727
  722    HB   VAL  89           HB       VAL  89   3.116  -5.199  -7.856
  723   HG11  VAL  89          1HG1      VAL  89   5.775  -6.631  -8.016
  724   HG12  VAL  89          2HG1      VAL  89   5.481  -4.912  -8.288
  725   HG13  VAL  89          3HG1      VAL  89   4.827  -6.106  -9.408
  726   HG21  VAL  89          3HG2      VAL  89   2.146  -7.342  -7.196
  727   HG22  VAL  89          1HG2      VAL  89   3.710  -8.133  -7.407
  728   HG23  VAL  89          2HG2      VAL  89   2.866  -7.460  -8.802
  729    H    VAL  90           H        VAL  90   6.081  -5.120  -4.596
  730    HA   VAL  90           HA       VAL  90   5.619  -2.249  -4.695
  731    HB   VAL  90           HB       VAL  90   7.722  -3.840  -3.203
  732   HG11  VAL  90          1HG1      VAL  90   6.919  -0.937  -2.936
  733   HG12  VAL  90          2HG1      VAL  90   8.453  -1.545  -3.560
  734   HG13  VAL  90          3HG1      VAL  90   8.031  -1.795  -1.866
  735   HG21  VAL  90          3HG2      VAL  90   5.472  -4.378  -2.455
  736   HG22  VAL  90          1HG2      VAL  90   5.100  -2.664  -2.259
  737   HG23  VAL  90          2HG2      VAL  90   6.311  -3.430  -1.228
  738    H    GLU  91           H        GLU  91   6.903  -0.737  -5.669
  739    HA   GLU  91           HA       GLU  91   9.493  -1.419  -6.786
  740    HB2  GLU  91           2HB      GLU  91   8.894  -0.667  -9.080
  741    HB3  GLU  91           1HB      GLU  91   8.089  -2.155  -8.605
  742    HG2  GLU  91           2HG      GLU  91   6.035  -0.944  -8.167
  743    HG3  GLU  91           1HG      GLU  91   6.829   0.584  -8.544
  744    H    PHE  92           H        PHE  92  10.575   0.514  -7.756
  745    HA   PHE  92           HA       PHE  92  10.221   2.742  -5.975
  746    HB2  PHE  92           2HB      PHE  92  12.223   3.662  -7.007
  747    HB3  PHE  92           1HB      PHE  92  12.462   1.954  -6.654
  748    HD1  PHE  92           HD1      PHE  92  12.336   0.289  -8.527
  749    HD2  PHE  92           HD2      PHE  92  12.393   4.493  -9.219
  750    HE1  PHE  92           HE1      PHE  92  12.987  -0.105 -10.868
  751    HE2  PHE  92           HE2      PHE  92  13.044   4.103 -11.557
  752    HZ   PHE  92           HZ       PHE  92  13.344   1.802 -12.384
  753    H    ALA  93           H        ALA  93   9.966   4.961  -6.590
  754    HA   ALA  93           HA       ALA  93   8.244   5.363  -8.928
  755    HB1  ALA  93           3HB      ALA  93   7.447   6.184  -6.752
  756    HB2  ALA  93           1HB      ALA  93   7.657   7.498  -7.909
  757    HB3  ALA  93           2HB      ALA  93   8.853   7.242  -6.639
  758    HA   PRO  94           HA       PRO  94  11.873   6.811 -11.175
  759    HB2  PRO  94           2HB      PRO  94   9.760   7.826 -13.021
  760    HB3  PRO  94           1HB      PRO  94  11.169   6.812 -13.363
  761    HG2  PRO  94           2HG      PRO  94   8.732   5.746 -13.297
  762    HG3  PRO  94           1HG      PRO  94  10.117   4.872 -12.615
  763    HD2  PRO  94           2HD      PRO  94   7.965   6.412 -11.199
  764    HD3  PRO  94           1HD      PRO  94   8.718   4.864 -10.761
  765    H    PHE  95           H        PHE  95  12.919   8.587 -10.500
  766    HA   PHE  95           HA       PHE  95  11.658  11.071  -9.878
  767    HB2  PHE  95           2HB      PHE  95  13.974  11.936  -9.631
  768    HB3  PHE  95           1HB      PHE  95  13.713  10.442  -8.741
  769    HD1  PHE  95           HD2      PHE  95  14.712   8.327  -9.545
  770    HD2  PHE  95           HD1      PHE  95  15.553  12.056 -11.438
  771    HE1  PHE  95           HE2      PHE  95  16.668   7.327 -10.651
  772    HE2  PHE  95           HE1      PHE  95  17.509  11.054 -12.543
  773    HZ   PHE  95           HZ       PHE  95  18.066   8.687 -12.151
  774    H    GLN  96           H        GLN  96  11.548  12.979 -11.060
  775    HA   GLN  96           HA       GLN  96  12.711  13.373 -13.619
  776    HB2  GLN  96           2HB      GLN  96  11.250  11.602 -14.356
  777    HB3  GLN  96           1HB      GLN  96   9.870  12.326 -13.551
  778    HG2  GLN  96           2HG      GLN  96   9.751  12.624 -15.958
  779    HG3  GLN  96           1HG      GLN  96   9.884  14.175 -15.134
  780   HE21  GLN  96          1HE2      GLN  96  11.619  15.464 -15.552
  781   HE22  GLN  96          2HE2      GLN  96  12.838  15.094 -16.716
  782    H    LYS  97           H        LYS  97  12.692  15.509 -14.015
  783    HA   LYS  97           HA       LYS  97  11.219  17.379 -12.486
  784    HB2  LYS  97           2HB      LYS  97  12.678  17.676 -15.119
  785    HB3  LYS  97           1HB      LYS  97  11.990  19.029 -14.231
  786    HG2  LYS  97           2HG      LYS  97  14.160  17.177 -13.240
  787    HG3  LYS  97           1HG      LYS  97  14.384  18.829 -13.823
  788    HD2  LYS  97           2HD      LYS  97  12.909  19.624 -11.983
  789    HD3  LYS  97           1HD      LYS  97  12.825  17.968 -11.374
  790    HE2  LYS  97           2HE      LYS  97  14.481  19.221 -10.121
  791    HE3  LYS  97           1HE      LYS  97  15.280  17.982 -11.086
  792    HZ1  LYS  97           3HZ      LYS  97  15.067  20.853 -11.813
  793    HZ2  LYS  97           1HZ      LYS  97  15.863  19.663 -12.710
  794    HZ3  LYS  97           2HZ      LYS  97  16.444  20.104 -11.185
  Start of MODEL   10
    1    H1   MET   1           1H       MET   1  -0.031  10.266   9.004
    2    H2   MET   1           2H       MET   1  -0.664   9.408  10.318
    3    H3   MET   1           3H       MET   1   0.996   9.704  10.228
    4    HA   MET   1           HA       MET   1  -1.109  11.776  10.519
    5    HB2  MET   1           2HB      MET   1   0.861  10.696  12.551
    6    HB3  MET   1           1HB      MET   1  -0.207  12.071  12.811
    7    HG2  MET   1           2HG      MET   1  -1.077  10.045  13.850
    8    HG3  MET   1           1HG      MET   1  -2.150  10.629  12.578
    9    HE1  MET   1           3HE      MET   1  -3.363   8.229  12.670
   10    HE2  MET   1           1HE      MET   1  -2.213   7.653  13.881
   11    HE3  MET   1           2HE      MET   1  -2.513   6.704  12.425
   12    H    GLY   2           H        GLY   2   1.978  11.096   9.343
   13    HA2  GLY   2           2HA      GLY   2   3.414  13.405  10.170
   14    HA3  GLY   2           1HA      GLY   2   3.818  12.367   8.816
   15    H    HIS   3           H        HIS   3   1.889  15.131   9.821
   16    HA   HIS   3           HA       HIS   3   0.809  15.858   7.338
   17    HB2  HIS   3           2HB      HIS   3   1.589  17.648   9.657
   18    HB3  HIS   3           1HB      HIS   3   0.534  18.109   8.324
   19    HD1  HIS   3           HD1      HIS   3   0.290  17.096  11.683
   20    HD2  HIS   3           HD2      HIS   3  -1.758  16.060   8.221
   21    HE1  HIS   3           HE1      HIS   3  -1.888  16.121  12.457
   22    HE2  HIS   3           HE2      HIS   3  -3.065  15.411  10.353
   23    H    HIS   4           H        HIS   4   1.717  16.597   5.528
   24    HA   HIS   4           HA       HIS   4   3.167  17.502   4.040
   25    HB2  HIS   4           2HB      HIS   4   4.108  19.074   6.448
   26    HB3  HIS   4           1HB      HIS   4   4.603  19.404   4.790
   27    HD1  HIS   4           HD1      HIS   4   2.058  20.273   7.221
   28    HD2  HIS   4           HD2      HIS   4   2.310  20.105   3.076
   29    HE1  HIS   4           HE1      HIS   4   0.121  21.624   6.372
   30    HE2  HIS   4           HE2      HIS   4   0.203  21.371   3.872
   31    H    HIS   5           H        HIS   5   3.853  15.042   5.349
   32    HA   HIS   5           HA       HIS   5   6.448  14.570   6.006
   33    HB2  HIS   5           2HB      HIS   5   6.205  12.411   4.654
   34    HB3  HIS   5           1HB      HIS   5   4.986  12.718   5.885
   35    HD1  HIS   5           HD1      HIS   5   5.440  12.709   2.136
   36    HD2  HIS   5           HD2      HIS   5   2.389  12.962   4.949
   37    HE1  HIS   5           HE1      HIS   5   3.306  12.493   0.836
   38    HE2  HIS   5           HE2      HIS   5   1.479  12.801   2.535
   39    H    HIS   6           H        HIS   6   8.366  15.176   5.156
   40    HA   HIS   6           HA       HIS   6   8.696  15.244   2.239
   41    HB2  HIS   6           2HB      HIS   6   9.832  17.481   2.406
   42    HB3  HIS   6           1HB      HIS   6   8.100  17.510   2.703
   43    HD1  HIS   6           HD1      HIS   6   7.342  18.554   4.841
   44    HD2  HIS   6           HD2      HIS   6  11.414  17.726   4.860
   45    HE1  HIS   6           HE1      HIS   6   8.231  19.589   6.943
   46    HE2  HIS   6           HE2      HIS   6  10.687  19.066   6.952
   47    H    HIS   7           H        HIS   7  10.501  14.271   1.629
   48    HA   HIS   7           HA       HIS   7  13.026  14.681   2.965
   49    HB2  HIS   7           2HB      HIS   7  11.588  12.056   3.161
   50    HB3  HIS   7           1HB      HIS   7  13.330  12.026   2.921
   51    HD1  HIS   7           HD1      HIS   7  14.788  13.122   4.831
   52    HD2  HIS   7           HD2      HIS   7  10.766  12.627   5.737
   53    HE1  HIS   7           HE1      HIS   7  14.634  13.338   7.326
   54    HE2  HIS   7           HE2      HIS   7  12.236  12.800   7.857
   55    H    HIS   8           H        HIS   8  14.850  13.848   1.682
   56    HA   HIS   8           HA       HIS   8  14.230  13.701  -1.151
   57    HB2  HIS   8           2HB      HIS   8  16.776  13.933   0.419
   58    HB3  HIS   8           1HB      HIS   8  16.841  13.402  -1.259
   59    HD1  HIS   8           HD1      HIS   8  15.608  15.132  -2.995
   60    HD2  HIS   8           HD2      HIS   8  16.776  16.641   0.701
   61    HE1  HIS   8           HE1      HIS   8  15.702  17.625  -3.283
   62    HE2  HIS   8           HE2      HIS   8  16.462  18.515  -1.057
   63    H    SER   9           H        SER   9  13.057  11.733  -1.123
   64    HA   SER   9           HA       SER   9  14.799   9.367  -1.328
   65    HB2  SER   9           2HB      SER   9  13.190   7.969  -0.146
   66    HB3  SER   9           1HB      SER   9  13.639   9.318   0.898
   67    HG   SER   9           HG       SER   9  11.486   9.359   1.021
   68    H    HIS  10           H        HIS  10  13.421   7.494  -2.349
   69    HA   HIS  10           HA       HIS  10  11.879   8.644  -4.578
   70    HB2  HIS  10           2HB      HIS  10  13.177   5.917  -4.313
   71    HB3  HIS  10           1HB      HIS  10  12.268   6.472  -5.716
   72    HD1  HIS  10           HD1      HIS  10  15.615   6.141  -4.603
   73    HD2  HIS  10           HD2      HIS  10  13.549   9.031  -6.754
   74    HE1  HIS  10           HE1      HIS  10  17.373   7.476  -5.787
   75    HE2  HIS  10           HE2      HIS  10  16.114   9.339  -6.908
   76    H    MET  11           H        MET  11   9.748   8.358  -4.684
   77    HA   MET  11           HA       MET  11   8.337   7.144  -2.535
   78    HB2  MET  11           2HB      MET  11   7.327   8.147  -5.210
   79    HB3  MET  11           1HB      MET  11   6.308   7.729  -3.838
   80    HG2  MET  11           2HG      MET  11   7.301   9.507  -2.519
   81    HG3  MET  11           1HG      MET  11   8.404   9.897  -3.835
   82    HE1  MET  11           3HE      MET  11   7.641  12.446  -3.636
   83    HE2  MET  11           1HE      MET  11   6.515  12.025  -2.344
   84    HE3  MET  11           2HE      MET  11   5.961  12.973  -3.724
   85    H    VAL  12           H        VAL  12   8.501   4.979  -2.308
   86    HA   VAL  12           HA       VAL  12   8.374   3.218  -4.608
   87    HB   VAL  12           HB       VAL  12   8.460   2.389  -1.705
   88   HG11  VAL  12          1HG1      VAL  12   9.383   0.982  -4.211
   89   HG12  VAL  12          2HG1      VAL  12   7.906   0.631  -3.318
   90   HG13  VAL  12          3HG1      VAL  12   9.475   0.352  -2.565
   91   HG21  VAL  12          3HG2      VAL  12  10.797   3.003  -3.525
   92   HG22  VAL  12          1HG2      VAL  12  10.907   2.293  -1.912
   93   HG23  VAL  12          2HG2      VAL  12  10.303   3.937  -2.113
   94    H    VAL  13           H        VAL  13   6.410   2.959  -5.479
   95    HA   VAL  13           HA       VAL  13   4.018   3.126  -3.812
   96    HB   VAL  13           HB       VAL  13   2.773   3.374  -5.878
   97   HG11  VAL  13          1HG1      VAL  13   3.805   5.375  -4.971
   98   HG12  VAL  13          2HG1      VAL  13   3.808   5.442  -6.735
   99   HG13  VAL  13          3HG1      VAL  13   5.292   5.048  -5.863
  100   HG21  VAL  13          3HG2      VAL  13   5.398   2.885  -7.307
  101   HG22  VAL  13          1HG2      VAL  13   3.880   3.361  -8.072
  102   HG23  VAL  13          2HG2      VAL  13   4.014   1.791  -7.278
  103    H    ILE  14           H        ILE  14   2.268   1.631  -3.997
  104    HA   ILE  14           HA       ILE  14   3.134  -1.126  -4.595
  105    HB   ILE  14           HB       ILE  14   2.505  -0.658  -2.245
  106   HG12  ILE  14          2HG1      ILE  14   0.646  -2.483  -2.114
  107   HG13  ILE  14          1HG1      ILE  14   0.871  -2.606  -3.855
  108   HG21  ILE  14          1HG2      ILE  14  -0.242  -0.083  -3.349
  109   HG22  ILE  14          2HG2      ILE  14   0.849   1.077  -2.595
  110   HG23  ILE  14          3HG2      ILE  14   0.166  -0.239  -1.639
  111   HD11  ILE  14          3HD1      ILE  14   2.976  -3.034  -1.751
  112   HD12  ILE  14          1HD1      ILE  14   3.232  -3.130  -3.495
  113   HD13  ILE  14          2HD1      ILE  14   2.159  -4.277  -2.695
  114    H    ARG  15           H        ARG  15   2.123  -2.243  -6.213
  115    HA   ARG  15           HA       ARG  15  -0.505  -1.326  -7.145
  116    HB2  ARG  15           2HB      ARG  15   0.315  -1.564  -9.545
  117    HB3  ARG  15           1HB      ARG  15   0.839  -0.149  -8.655
  118    HG2  ARG  15           2HG      ARG  15   2.763  -0.789  -9.752
  119    HG3  ARG  15           1HG      ARG  15   2.979  -1.526  -8.165
  120    HD2  ARG  15           2HD      ARG  15   2.399  -3.682  -8.996
  121    HD3  ARG  15           1HD      ARG  15   1.819  -3.012 -10.523
  122    HE   ARG  15           HE       ARG  15   4.579  -2.428 -10.049
  123   HH11  ARG  15          1HH1      ARG  15   2.444  -4.876 -11.197
  124   HH12  ARG  15          2HH1      ARG  15   3.633  -5.578 -12.229
  125   HH21  ARG  15          1HH2      ARG  15   6.090  -3.331 -11.360
  126   HH22  ARG  15          2HH2      ARG  15   5.687  -4.714 -12.322
  127    H    ARG  16           H        ARG  16  -1.175  -2.890  -9.134
  128    HA   ARG  16           HA       ARG  16  -2.003  -4.946  -9.657
  129    HB2  ARG  16           2HB      ARG  16   0.398  -5.800  -8.086
  130    HB3  ARG  16           1HB      ARG  16  -0.837  -6.995  -8.439
  131    HG2  ARG  16           2HG      ARG  16   0.320  -5.333 -10.648
  132    HG3  ARG  16           1HG      ARG  16   1.190  -6.736 -10.029
  133    HD2  ARG  16           2HD      ARG  16  -0.132  -7.372 -11.959
  134    HD3  ARG  16           1HD      ARG  16  -0.765  -8.153 -10.511
  135    HE   ARG  16           HE       ARG  16  -2.021  -5.694 -11.521
  136   HH11  ARG  16          1HH1      ARG  16  -2.223  -9.054 -10.775
  137   HH12  ARG  16          2HH1      ARG  16  -3.932  -9.125 -11.019
  138   HH21  ARG  16          1HH2      ARG  16  -4.215  -5.787 -11.820
  139   HH22  ARG  16          2HH2      ARG  16  -5.055  -7.287 -11.609
  140    H    LEU  17           H        LEU  17  -2.784  -3.332  -7.241
  141    HA   LEU  17           HA       LEU  17  -3.820  -5.292  -5.363
  142    HB2  LEU  17           2HB      LEU  17  -3.775  -2.297  -5.496
  143    HB3  LEU  17           1HB      LEU  17  -4.916  -3.088  -4.426
  144    HG   LEU  17           HG       LEU  17  -2.841  -2.376  -3.278
  145   HD11  LEU  17          1HD1      LEU  17  -4.175  -4.249  -2.421
  146   HD12  LEU  17          2HD1      LEU  17  -2.460  -4.449  -2.071
  147   HD13  LEU  17          3HD1      LEU  17  -3.206  -5.375  -3.376
  148   HD21  LEU  17          3HD2      LEU  17  -1.496  -4.444  -5.019
  149   HD22  LEU  17          1HD2      LEU  17  -0.754  -3.576  -3.674
  150   HD23  LEU  17          2HD2      LEU  17  -1.264  -2.698  -5.115
  151    HA   PRO  18           HA       PRO  18  -7.806  -5.249  -7.544
  152    HB2  PRO  18           2HB      PRO  18  -8.535  -7.749  -6.956
  153    HB3  PRO  18           1HB      PRO  18  -7.261  -7.434  -8.141
  154    HG2  PRO  18           2HG      PRO  18  -7.031  -8.367  -5.315
  155    HG3  PRO  18           1HG      PRO  18  -6.048  -8.797  -6.726
  156    HD2  PRO  18           2HD      PRO  18  -5.405  -6.883  -4.749
  157    HD3  PRO  18           1HD      PRO  18  -4.580  -7.112  -6.303
  158    HA   PRO  19           HA       PRO  19 -10.393  -4.002  -4.093
  159    HB2  PRO  19           2HB      PRO  19 -12.609  -5.115  -5.758
  160    HB3  PRO  19           1HB      PRO  19 -12.447  -3.517  -5.022
  161    HG2  PRO  19           2HG      PRO  19 -12.081  -3.829  -7.640
  162    HG3  PRO  19           1HG      PRO  19 -11.039  -2.734  -6.707
  163    HD2  PRO  19           2HD      PRO  19 -10.465  -5.492  -7.733
  164    HD3  PRO  19           1HD      PRO  19  -9.401  -4.071  -7.661
  165    H    GLY  20           H        GLY  20 -10.526  -5.138  -2.247
  166    HA2  GLY  20           2HA      GLY  20 -12.009  -7.639  -2.146
  167    HA3  GLY  20           1HA      GLY  20 -10.297  -7.777  -1.784
  168    H    LEU  21           H        LEU  21  -9.476  -6.696   0.071
  169    HA   LEU  21           HA       LEU  21 -11.453  -6.224   2.164
  170    HB2  LEU  21           2HB      LEU  21  -9.702  -6.341   3.748
  171    HB3  LEU  21           1HB      LEU  21  -9.438  -7.641   2.608
  172    HG   LEU  21           HG       LEU  21  -7.901  -5.032   2.697
  173   HD11  LEU  21          1HD1      LEU  21  -7.415  -6.466   4.600
  174   HD12  LEU  21          2HD1      LEU  21  -6.043  -6.407   3.492
  175   HD13  LEU  21          3HD1      LEU  21  -7.096  -7.823   3.518
  176   HD21  LEU  21          3HD2      LEU  21  -6.354  -6.179   1.119
  177   HD22  LEU  21          1HD2      LEU  21  -7.938  -5.823   0.428
  178   HD23  LEU  21          2HD2      LEU  21  -7.549  -7.465   0.943
  179    H    THR  22           H        THR  22 -11.746  -4.280   3.233
  180    HA   THR  22           HA       THR  22 -11.329  -1.944   1.644
  181    HB   THR  22           HB       THR  22 -12.432  -2.169   4.465
  182    HG1  THR  22           HG1      THR  22 -14.324  -2.601   3.550
  183   HG21  THR  22          3HG2      THR  22 -13.490   0.002   4.022
  184   HG22  THR  22          1HG2      THR  22 -12.697   0.075   2.446
  185   HG23  THR  22          2HG2      THR  22 -11.733   0.126   3.924
  186    H    LYS  23           H        LYS  23 -10.243  -0.001   2.293
  187    HA   LYS  23           HA       LYS  23  -7.617  -0.129   2.825
  188    HB2  LYS  23           2HB      LYS  23  -7.725   2.255   3.491
  189    HB3  LYS  23           1HB      LYS  23  -8.675   1.892   2.057
  190    HG2  LYS  23           2HG      LYS  23 -10.705   1.793   3.507
  191    HG3  LYS  23           1HG      LYS  23  -9.711   2.347   4.854
  192    HD2  LYS  23           2HD      LYS  23 -10.210   3.833   2.268
  193    HD3  LYS  23           1HD      LYS  23 -10.921   4.207   3.837
  194    HE2  LYS  23           2HE      LYS  23  -8.670   4.679   4.726
  195    HE3  LYS  23           1HE      LYS  23  -7.982   4.333   3.138
  196    HZ1  LYS  23           3HZ      LYS  23  -8.243   6.693   3.441
  197    HZ2  LYS  23           1HZ      LYS  23  -9.889   6.513   3.787
  198    HZ3  LYS  23           2HZ      LYS  23  -9.307   6.164   2.237
  199    H    GLU  24           H        GLU  24 -10.089   0.032   5.374
  200    HA   GLU  24           HA       GLU  24  -8.331   0.646   7.502
  201    HB2  GLU  24           2HB      GLU  24 -11.046  -0.683   7.618
  202    HB3  GLU  24           1HB      GLU  24 -10.210   0.078   8.971
  203    HG2  GLU  24           2HG      GLU  24 -10.263   2.230   7.730
  204    HG3  GLU  24           1HG      GLU  24 -11.216   1.443   6.475
  205    H    GLN  25           H        GLN  25  -8.743  -2.274   5.841
  206    HA   GLN  25           HA       GLN  25  -7.074  -3.639   7.873
  207    HB2  GLN  25           2HB      GLN  25  -8.926  -4.878   5.815
  208    HB3  GLN  25           1HB      GLN  25  -7.813  -5.786   6.829
  209    HG2  GLN  25           2HG      GLN  25  -9.017  -4.920   8.824
  210    HG3  GLN  25           1HG      GLN  25 -10.189  -4.175   7.736
  211   HE21  GLN  25          1HE2      GLN  25 -11.596  -5.508   6.567
  212   HE22  GLN  25          2HE2      GLN  25 -11.861  -7.155   7.003
  213    H    LEU  26           H        LEU  26  -7.668  -3.074   4.453
  214    HA   LEU  26           HA       LEU  26  -5.540  -4.336   3.260
  215    HB2  LEU  26           2HB      LEU  26  -7.129  -3.439   1.839
  216    HB3  LEU  26           1HB      LEU  26  -7.144  -1.885   2.644
  217    HG   LEU  26           HG       LEU  26  -4.833  -1.489   1.643
  218   HD11  LEU  26          1HD1      LEU  26  -5.585  -3.879  -0.042
  219   HD12  LEU  26          2HD1      LEU  26  -4.283  -3.821   1.146
  220   HD13  LEU  26          3HD1      LEU  26  -4.202  -2.813  -0.299
  221   HD21  LEU  26          3HD2      LEU  26  -7.157  -1.842  -0.254
  222   HD22  LEU  26          1HD2      LEU  26  -5.730  -0.844  -0.538
  223   HD23  LEU  26          2HD2      LEU  26  -6.849  -0.431   0.761
  224    H    GLU  27           H        GLU  27  -5.462  -1.459   5.232
  225    HA   GLU  27           HA       GLU  27  -2.936  -0.481   4.381
  226    HB2  GLU  27           2HB      GLU  27  -3.011   0.921   6.378
  227    HB3  GLU  27           1HB      GLU  27  -4.561   0.932   5.548
  228    HG2  GLU  27           2HG      GLU  27  -5.442  -0.668   7.190
  229    HG3  GLU  27           1HG      GLU  27  -3.890  -0.656   8.026
  230    H    GLU  28           H        GLU  28  -3.833  -3.009   6.647
  231    HA   GLU  28           HA       GLU  28  -1.768  -2.783   8.500
  232    HB2  GLU  28           2HB      GLU  28  -2.334  -4.961   9.272
  233    HB3  GLU  28           1HB      GLU  28  -3.821  -4.198   8.737
  234    HG2  GLU  28           2HG      GLU  28  -3.828  -5.490   6.714
  235    HG3  GLU  28           1HG      GLU  28  -2.238  -6.153   7.083
  236    H    GLN  29           H        GLN  29  -1.671  -4.355   5.343
  237    HA   GLN  29           HA       GLN  29   1.076  -5.264   5.871
  238    HB2  GLN  29           2HB      GLN  29   0.885  -6.398   3.635
  239    HB3  GLN  29           1HB      GLN  29  -0.222  -6.981   4.865
  240    HG2  GLN  29           2HG      GLN  29  -1.170  -4.873   2.980
  241    HG3  GLN  29           1HG      GLN  29  -1.021  -6.530   2.398
  242   HE21  GLN  29          1HE2      GLN  29  -3.400  -4.850   2.846
  243   HE22  GLN  29          2HE2      GLN  29  -4.407  -5.771   3.903
  244    H    LEU  30           H        LEU  30  -0.506  -2.617   4.456
  245    HA   LEU  30           HA       LEU  30   1.700  -2.065   2.608
  246    HB2  LEU  30           2HB      LEU  30  -0.906  -0.590   3.006
  247    HB3  LEU  30           1HB      LEU  30   0.297  -0.214   1.783
  248    HG   LEU  30           HG       LEU  30  -1.393  -2.717   1.958
  249   HD11  LEU  30          1HD1      LEU  30  -2.307  -1.962  -0.167
  250   HD12  LEU  30          2HD1      LEU  30  -1.295  -0.519  -0.108
  251   HD13  LEU  30          3HD1      LEU  30  -2.563  -0.757   1.095
  252   HD21  LEU  30          3HD2      LEU  30  -0.308  -3.421  -0.119
  253   HD22  LEU  30          1HD2      LEU  30   0.852  -3.301   1.203
  254   HD23  LEU  30          2HD2      LEU  30   0.782  -2.038  -0.027
  255    H    ARG  31           H        ARG  31   0.824  -1.283   5.794
  256    HA   ARG  31           HA       ARG  31   2.877   0.835   5.791
  257    HB2  ARG  31           2HB      ARG  31   1.552   2.096   7.486
  258    HB3  ARG  31           1HB      ARG  31   0.785   2.019   5.906
  259    HG2  ARG  31           2HG      ARG  31  -0.826   0.465   6.639
  260    HG3  ARG  31           1HG      ARG  31   0.071   0.104   8.113
  261    HD2  ARG  31           2HD      ARG  31  -1.135   2.803   7.504
  262    HD3  ARG  31           1HD      ARG  31  -1.959   1.548   8.426
  263    HE   ARG  31           HE       ARG  31   0.666   2.401   9.365
  264   HH11  ARG  31          1HH1      ARG  31  -2.759   2.506   9.740
  265   HH12  ARG  31          2HH1      ARG  31  -2.668   3.082  11.370
  266   HH21  ARG  31          1HH2      ARG  31   0.774   3.124  11.446
  267   HH22  ARG  31          2HH2      ARG  31  -0.684   3.395  12.341
  268    HA   PRO  32           HA       PRO  32   3.334  -2.074   9.539
  269    HB2  PRO  32           2HB      PRO  32   4.848  -4.117   8.703
  270    HB3  PRO  32           1HB      PRO  32   3.094  -4.129   8.472
  271    HG2  PRO  32           2HG      PRO  32   5.258  -3.459   6.505
  272    HG3  PRO  32           1HG      PRO  32   3.808  -4.455   6.273
  273    HD2  PRO  32           2HD      PRO  32   4.005  -1.818   5.506
  274    HD3  PRO  32           1HD      PRO  32   2.475  -2.630   5.886
  275    H    LEU  33           H        LEU  33   5.096  -0.164   7.574
  276    HA   LEU  33           HA       LEU  33   7.758  -0.744   8.526
  277    HB2  LEU  33           2HB      LEU  33   6.766   1.617   6.923
  278    HB3  LEU  33           1HB      LEU  33   8.445   1.224   7.233
  279    HG   LEU  33           HG       LEU  33   7.834  -1.039   6.053
  280   HD11  LEU  33          1HD1      LEU  33   6.179  -0.791   4.274
  281   HD12  LEU  33          2HD1      LEU  33   5.732   0.792   4.914
  282   HD13  LEU  33          3HD1      LEU  33   5.449  -0.660   5.873
  283   HD21  LEU  33          3HD2      LEU  33   8.271   1.562   4.590
  284   HD22  LEU  33          1HD2      LEU  33   8.471  -0.040   3.872
  285   HD23  LEU  33          2HD2      LEU  33   9.504   0.463   5.208
  286    HA   PRO  34           HA       PRO  34   7.320   2.059  11.991
  287    HB2  PRO  34           2HB      PRO  34   9.427   1.208  13.360
  288    HB3  PRO  34           1HB      PRO  34   8.089   0.099  13.028
  289    HG2  PRO  34           2HG      PRO  34  10.775   0.267  11.731
  290    HG3  PRO  34           1HG      PRO  34   9.791  -1.162  12.093
  291    HD2  PRO  34           2HD      PRO  34   9.955   0.217   9.611
  292    HD3  PRO  34           1HD      PRO  34   8.814  -1.074  10.041
  293    H    ALA  35           H        ALA  35   8.921   2.955   9.439
  294    HA   ALA  35           HA       ALA  35  10.514   4.989  10.838
  295    HB1  ALA  35           3HB      ALA  35  12.446   4.647   9.422
  296    HB2  ALA  35           1HB      ALA  35  11.622   3.339   8.572
  297    HB3  ALA  35           2HB      ALA  35  12.044   3.155  10.274
  298    H    HIS  36           H        HIS  36   8.013   4.714   8.827
  299    HA   HIS  36           HA       HIS  36   8.685   7.251   7.572
  300    HB2  HIS  36           2HB      HIS  36   8.278   6.700   5.341
  301    HB3  HIS  36           1HB      HIS  36   9.294   5.403   5.938
  302    HD1  HIS  36           HD1      HIS  36   8.627   3.497   4.521
  303    HD2  HIS  36           HD2      HIS  36   5.309   5.488   6.030
  304    HE1  HIS  36           HE1      HIS  36   6.634   2.236   3.671
  305    HE2  HIS  36           HE2      HIS  36   4.653   3.549   4.460
  306    H    ASP  37           H        ASP  37   6.993   8.546   6.920
  307    HA   ASP  37           HA       ASP  37   4.429   8.183   8.105
  308    HB2  ASP  37           2HB      ASP  37   5.450  10.110   6.005
  309    HB3  ASP  37           1HB      ASP  37   3.847  10.217   6.732
  310    H    TYR  38           H        TYR  38   2.629   7.187   7.265
  311    HA   TYR  38           HA       TYR  38   2.899   5.923   4.648
  312    HB2  TYR  38           2HB      TYR  38   0.963   4.576   5.267
  313    HB3  TYR  38           1HB      TYR  38   2.177   4.537   6.538
  314    HD1  TYR  38           HD2      TYR  38   1.787   5.742   8.666
  315    HD2  TYR  38           HD1      TYR  38  -1.223   5.502   5.660
  316    HE1  TYR  38           HE2      TYR  38   0.082   6.401  10.319
  317    HE2  TYR  38           HE1      TYR  38  -2.929   6.155   7.301
  318    HH   TYR  38           HH       TYR  38  -3.252   6.107   9.731
  319    H    PHE  39           H        PHE  39   0.700   5.695   3.421
  320    HA   PHE  39           HA       PHE  39  -0.334   8.432   2.977
  321    HB2  PHE  39           2HB      PHE  39   1.328   7.446   1.282
  322    HB3  PHE  39           1HB      PHE  39   0.054   6.318   0.843
  323    HD1  PHE  39           HD2      PHE  39   0.728   9.967   1.160
  324    HD2  PHE  39           HD1      PHE  39  -1.434   6.900  -0.859
  325    HE1  PHE  39           HE2      PHE  39  -0.139  11.630  -0.432
  326    HE2  PHE  39           HE1      PHE  39  -2.301   8.562  -2.456
  327    HZ   PHE  39           HZ       PHE  39  -1.653  10.929  -2.242
  328    H    GLU  40           H        GLU  40  -2.428   8.219   1.448
  329    HA   GLU  40           HA       GLU  40  -4.370   6.744   2.949
  330    HB2  GLU  40           2HB      GLU  40  -6.018   7.671   1.425
  331    HB3  GLU  40           1HB      GLU  40  -4.882   8.927   1.900
  332    HG2  GLU  40           2HG      GLU  40  -3.700   8.672  -0.224
  333    HG3  GLU  40           1HG      GLU  40  -4.833   7.411  -0.707
  334    H    PHE  41           H        PHE  41  -5.837   5.142   2.117
  335    HA   PHE  41           HA       PHE  41  -4.815   3.555  -0.155
  336    HB2  PHE  41           2HB      PHE  41  -5.968   2.407   2.405
  337    HB3  PHE  41           1HB      PHE  41  -5.314   1.497   1.046
  338    HD1  PHE  41           HD1      PHE  41  -2.836   1.806   0.488
  339    HD2  PHE  41           HD2      PHE  41  -4.573   3.094   4.163
  340    HE1  PHE  41           HE1      PHE  41  -0.600   1.887   1.514
  341    HE2  PHE  41           HE2      PHE  41  -2.340   3.168   5.192
  342    HZ   PHE  41           HZ       PHE  41  -0.350   2.569   3.869
  343    H    PHE  42           H        PHE  42  -6.448   2.313  -1.315
  344    HA   PHE  42           HA       PHE  42  -8.829   3.864  -1.632
  345    HB2  PHE  42           2HB      PHE  42  -9.358   2.383  -3.488
  346    HB3  PHE  42           1HB      PHE  42  -7.675   2.880  -3.561
  347    HD1  PHE  42           HD2      PHE  42  -5.875   1.258  -3.155
  348    HD2  PHE  42           HD1      PHE  42  -9.975   0.077  -3.101
  349    HE1  PHE  42           HE2      PHE  42  -5.200  -1.098  -3.337
  350    HE2  PHE  42           HE1      PHE  42  -9.299  -2.282  -3.283
  351    HZ   PHE  42           HZ       PHE  42  -6.912  -2.871  -3.403
  352    H    ALA  43           H        ALA  43 -10.971   3.313  -1.334
  353    HA   ALA  43           HA       ALA  43 -11.471   1.081   0.530
  354    HB1  ALA  43           3HB      ALA  43 -12.004   3.298   1.426
  355    HB2  ALA  43           1HB      ALA  43 -13.450   2.299   1.267
  356    HB3  ALA  43           2HB      ALA  43 -13.122   3.573   0.091
  357    H    ALA  44           H        ALA  44 -11.957  -0.627  -0.749
  358    HA   ALA  44           HA       ALA  44 -14.524  -0.672  -2.048
  359    HB1  ALA  44           3HB      ALA  44 -13.177   0.277  -3.856
  360    HB2  ALA  44           1HB      ALA  44 -13.714  -1.354  -4.263
  361    HB3  ALA  44           2HB      ALA  44 -12.050  -1.077  -3.740
  362    H    ASP  45           H        ASP  45 -15.376  -2.603  -1.473
  363    HA   ASP  45           HA       ASP  45 -13.564  -4.714  -0.602
  364    HB2  ASP  45           2HB      ASP  45 -15.509  -5.766   0.398
  365    HB3  ASP  45           1HB      ASP  45 -15.444  -4.067   0.851
  366    H    LEU  46           H        LEU  46 -14.610  -7.038  -1.037
  367    HA   LEU  46           HA       LEU  46 -14.095  -7.375  -3.849
  368    HB2  LEU  46           2HB      LEU  46 -14.060  -9.802  -3.295
  369    HB3  LEU  46           1HB      LEU  46 -12.937  -8.818  -2.378
  370    HG   LEU  46           HG       LEU  46 -14.742  -8.846  -0.518
  371   HD11  LEU  46          1HD1      LEU  46 -15.647 -11.229  -2.136
  372   HD12  LEU  46          2HD1      LEU  46 -16.577  -9.763  -1.821
  373   HD13  LEU  46          3HD1      LEU  46 -16.159 -10.843  -0.493
  374   HD21  LEU  46          3HD2      LEU  46 -12.590  -9.963  -0.328
  375   HD22  LEU  46          1HD2      LEU  46 -13.210 -11.352  -1.225
  376   HD23  LEU  46          2HD2      LEU  46 -13.870 -10.961   0.364
  377    H    SER  47           H        SER  47 -17.004  -7.331  -1.949
  378    HA   SER  47           HA       SER  47 -18.450  -9.138  -3.690
  379    HB2  SER  47           2HB      SER  47 -20.381  -8.733  -2.331
  380    HB3  SER  47           1HB      SER  47 -19.002  -8.841  -1.241
  381    HG   SER  47           HG       SER  47 -19.172  -6.767  -0.773
  382    H    LEU  48           H        LEU  48 -18.722  -5.637  -3.004
  383    HA   LEU  48           HA       LEU  48 -19.992  -5.307  -5.645
  384    HB2  LEU  48           2HB      LEU  48 -19.944  -3.424  -3.278
  385    HB3  LEU  48           1HB      LEU  48 -20.712  -3.083  -4.818
  386    HG   LEU  48           HG       LEU  48 -21.517  -5.256  -2.873
  387   HD11  LEU  48          1HD1      LEU  48 -23.558  -3.943  -2.603
  388   HD12  LEU  48          2HD1      LEU  48 -22.917  -2.710  -3.688
  389   HD13  LEU  48          3HD1      LEU  48 -22.134  -3.014  -2.137
  390   HD21  LEU  48          3HD2      LEU  48 -22.714  -4.504  -5.544
  391   HD22  LEU  48          1HD2      LEU  48 -23.408  -5.649  -4.397
  392   HD23  LEU  48          2HD2      LEU  48 -21.862  -6.002  -5.166
  393    H    TYR  49           H        TYR  49 -17.581  -5.735  -6.236
  394    HA   TYR  49           HA       TYR  49 -15.644  -3.734  -5.949
  395    HB2  TYR  49           2HB      TYR  49 -14.579  -4.761  -7.982
  396    HB3  TYR  49           1HB      TYR  49 -14.963  -5.905  -6.703
  397    HD1  TYR  49           HD2      TYR  49 -16.846  -7.502  -6.988
  398    HD2  TYR  49           HD1      TYR  49 -15.645  -4.904 -10.147
  399    HE1  TYR  49           HE2      TYR  49 -18.094  -8.880  -8.594
  400    HE2  TYR  49           HE1      TYR  49 -16.896  -6.281 -11.755
  401    HH   TYR  49           HH       TYR  49 -17.696  -8.711 -11.885
  402    HA   PRO  50           HA       PRO  50 -17.266  -0.516  -8.509
  403    HB2  PRO  50           2HB      PRO  50 -15.144   1.123  -8.609
  404    HB3  PRO  50           1HB      PRO  50 -15.998   0.810  -7.092
  405    HG2  PRO  50           2HG      PRO  50 -13.444  -0.396  -8.109
  406    HG3  PRO  50           1HG      PRO  50 -13.820   0.219  -6.487
  407    HD2  PRO  50           2HD      PRO  50 -13.906  -2.437  -7.155
  408    HD3  PRO  50           1HD      PRO  50 -14.893  -1.720  -5.866
  409    H    HIS  51           H        HIS  51 -16.803   0.775 -10.495
  410    HA   HIS  51           HA       HIS  51 -15.960  -0.932 -12.661
  411    HB2  HIS  51           2HB      HIS  51 -17.908   0.585 -12.846
  412    HB3  HIS  51           1HB      HIS  51 -16.842   1.972 -12.674
  413    HD1  HIS  51           HD1      HIS  51 -18.007  -0.575 -15.128
  414    HD2  HIS  51           HD2      HIS  51 -15.320   2.591 -14.973
  415    HE1  HIS  51           HE1      HIS  51 -17.372  -0.110 -17.512
  416    HE2  HIS  51           HE2      HIS  51 -15.625   1.692 -17.376
  417    H    LEU  52           H        LEU  52 -14.547   1.681 -10.830
  418    HA   LEU  52           HA       LEU  52 -12.273   1.819 -12.705
  419    HB2  LEU  52           2HB      LEU  52 -13.385   3.954 -12.263
  420    HB3  LEU  52           1HB      LEU  52 -13.124   3.746 -10.541
  421    HG   LEU  52           HG       LEU  52 -10.672   3.862 -10.914
  422   HD11  LEU  52          1HD1      LEU  52 -10.589   3.066 -13.214
  423   HD12  LEU  52          2HD1      LEU  52  -9.809   4.640 -13.069
  424   HD13  LEU  52          3HD1      LEU  52 -11.426   4.518 -13.762
  425   HD21  LEU  52          3HD2      LEU  52 -11.869   5.872 -10.272
  426   HD22  LEU  52          1HD2      LEU  52 -12.248   6.218 -11.961
  427   HD23  LEU  52          2HD2      LEU  52 -10.576   6.273 -11.401
  428    H    TYR  53           H        TYR  53 -10.389   0.959 -12.143
  429    HA   TYR  53           HA       TYR  53  -9.859  -0.256  -9.631
  430    HB2  TYR  53           2HB      TYR  53  -7.556  -0.561 -10.539
  431    HB3  TYR  53           1HB      TYR  53  -8.808  -1.086 -11.663
  432    HD1  TYR  53           HD1      TYR  53  -9.231   0.155 -13.728
  433    HD2  TYR  53           HD2      TYR  53  -6.184   1.402 -11.024
  434    HE1  TYR  53           HE1      TYR  53  -8.299   1.625 -15.461
  435    HE2  TYR  53           HE2      TYR  53  -5.246   2.873 -12.755
  436    HH   TYR  53           HH       TYR  53  -5.242   3.044 -15.224
  437    H    SER  54           H        SER  54  -7.826   0.288  -8.333
  438    HA   SER  54           HA       SER  54  -7.039   3.087  -8.309
  439    HB2  SER  54           2HB      SER  54  -8.487   1.845  -5.954
  440    HB3  SER  54           1HB      SER  54  -7.574   3.349  -5.865
  441    HG   SER  54           HG       SER  54  -9.403   3.298  -7.916
  442    H    ARG  55           H        ARG  55  -5.106   3.488  -7.159
  443    HA   ARG  55           HA       ARG  55  -3.708   1.091  -6.128
  444    HB2  ARG  55           2HB      ARG  55  -2.442   3.365  -7.686
  445    HB3  ARG  55           1HB      ARG  55  -1.613   1.948  -7.059
  446    HG2  ARG  55           2HG      ARG  55  -3.037   0.541  -8.565
  447    HG3  ARG  55           1HG      ARG  55  -3.656   2.035  -9.274
  448    HD2  ARG  55           2HD      ARG  55  -0.785   1.091  -9.257
  449    HD3  ARG  55           1HD      ARG  55  -1.862   1.159 -10.650
  450    HE   ARG  55           HE       ARG  55  -1.726   3.734  -9.664
  451   HH11  ARG  55          1HH1      ARG  55   0.474   1.419 -10.965
  452   HH12  ARG  55          2HH1      ARG  55   1.547   2.622 -11.587
  453   HH21  ARG  55          1HH2      ARG  55  -0.332   5.269 -10.439
  454   HH22  ARG  55          2HH2      ARG  55   1.103   4.785 -11.275
  455    H    ALA  56           H        ALA  56  -1.824   1.672  -4.674
  456    HA   ALA  56           HA       ALA  56  -2.389   4.135  -3.135
  457    HB1  ALA  56           3HB      ALA  56  -1.322   1.510  -2.091
  458    HB2  ALA  56           1HB      ALA  56  -2.956   2.135  -1.864
  459    HB3  ALA  56           2HB      ALA  56  -1.581   2.972  -1.139
  460    H    TYR  57           H        TYR  57  -0.760   5.530  -2.792
  461    HA   TYR  57           HA       TYR  57   1.866   4.855  -3.962
  462    HB2  TYR  57           2HB      TYR  57   0.555   7.559  -3.570
  463    HB3  TYR  57           1HB      TYR  57   2.143   7.287  -4.285
  464    HD1  TYR  57           HD1      TYR  57  -1.482   6.624  -4.736
  465    HD2  TYR  57           HD2      TYR  57   2.347   6.720  -6.593
  466    HE1  TYR  57           HE1      TYR  57  -2.546   6.326  -6.930
  467    HE2  TYR  57           HE2      TYR  57   1.291   6.420  -8.795
  468    HH   TYR  57           HH       TYR  57  -2.039   6.779  -9.307
  469    H    ILE  58           H        ILE  58   3.154   4.176  -2.314
  470    HA   ILE  58           HA       ILE  58   2.704   5.147   0.358
  471    HB   ILE  58           HB       ILE  58   4.806   3.199  -0.604
  472   HG12  ILE  58          2HG1      ILE  58   2.054   2.678   0.568
  473   HG13  ILE  58          1HG1      ILE  58   2.510   2.438  -1.115
  474   HG21  ILE  58          1HG2      ILE  58   4.907   2.484   1.740
  475   HG22  ILE  58          2HG2      ILE  58   3.742   3.734   2.175
  476   HG23  ILE  58          3HG2      ILE  58   5.336   4.187   1.573
  477   HD11  ILE  58          3HD1      ILE  58   4.085   0.701  -0.445
  478   HD12  ILE  58          1HD1      ILE  58   2.446   0.338   0.097
  479   HD13  ILE  58          2HD1      ILE  58   3.639   0.949   1.245
  480    H    ASN  59           H        ASN  59   3.735   6.703   1.383
  481    HA   ASN  59           HA       ASN  59   6.016   8.053   0.218
  482    HB2  ASN  59           2HB      ASN  59   4.317   9.442   1.188
  483    HB3  ASN  59           1HB      ASN  59   4.355   8.542   2.700
  484   HD21  ASN  59          1HD2      ASN  59   6.038   8.898   4.141
  485   HD22  ASN  59          2HD2      ASN  59   7.078  10.274   4.022
  486    H    PHE  60           H        PHE  60   8.105   7.836   0.821
  487    HA   PHE  60           HA       PHE  60   8.735   6.181   3.194
  488    HB2  PHE  60           2HB      PHE  60   9.915   6.274   0.449
  489    HB3  PHE  60           1HB      PHE  60  11.005   5.951   1.792
  490    HD1  PHE  60           HD2      PHE  60   7.942   4.732   0.078
  491    HD2  PHE  60           HD1      PHE  60  11.075   3.867   2.826
  492    HE1  PHE  60           HE2      PHE  60   7.275   2.361   0.098
  493    HE2  PHE  60           HE1      PHE  60  10.421   1.511   2.855
  494    HZ   PHE  60           HZ       PHE  60   8.513   0.744   1.488
  495    H    ARG  61           H        ARG  61  10.403   6.823   4.567
  496    HA   ARG  61           HA       ARG  61  11.253   9.638   4.323
  497    HB2  ARG  61           2HB      ARG  61  10.955   7.786   6.678
  498    HB3  ARG  61           1HB      ARG  61  11.954   9.224   6.793
  499    HG2  ARG  61           2HG      ARG  61  10.018  10.631   6.296
  500    HG3  ARG  61           1HG      ARG  61   9.003   9.188   6.150
  501    HD2  ARG  61           2HD      ARG  61   9.276   8.654   8.445
  502    HD3  ARG  61           1HD      ARG  61  10.582   9.811   8.643
  503    HE   ARG  61           HE       ARG  61   8.089  11.019   7.921
  504   HH11  ARG  61          1HH1      ARG  61  10.015   9.858  10.525
  505   HH12  ARG  61          2HH1      ARG  61   9.154  10.757  11.720
  506   HH21  ARG  61          1HH2      ARG  61   6.965  12.149   9.452
  507   HH22  ARG  61          2HH2      ARG  61   7.446  12.067  11.111
  508    H    ASN  62           H        ASN  62  12.545   6.387   5.008
  509    HA   ASN  62           HA       ASN  62  15.286   7.498   4.919
  510    HB2  ASN  62           2HB      ASN  62  14.451   6.682   7.152
  511    HB3  ASN  62           1HB      ASN  62  14.334   5.069   6.460
  512   HD21  ASN  62          1HD2      ASN  62  15.844   4.100   7.699
  513   HD22  ASN  62          2HD2      ASN  62  17.527   4.505   7.662
  514    HA   PRO  63           HA       PRO  63  16.141   4.735   1.438
  515    HB2  PRO  63           2HB      PRO  63  18.871   4.477   1.982
  516    HB3  PRO  63           1HB      PRO  63  18.131   5.746   1.001
  517    HG2  PRO  63           2HG      PRO  63  18.954   5.814   3.881
  518    HG3  PRO  63           1HG      PRO  63  19.117   7.068   2.636
  519    HD2  PRO  63           2HD      PRO  63  17.196   7.217   4.480
  520    HD3  PRO  63           1HD      PRO  63  16.876   7.697   2.801
  521    H    ASP  64           H        ASP  64  17.520   4.026   4.671
  522    HA   ASP  64           HA       ASP  64  17.849   1.249   4.331
  523    HB2  ASP  64           2HB      ASP  64  17.158   2.763   6.867
  524    HB3  ASP  64           1HB      ASP  64  17.803   1.125   6.790
  525    H    ASP  65           H        ASP  65  15.107   3.108   5.599
  526    HA   ASP  65           HA       ASP  65  13.321   1.068   6.187
  527    HB2  ASP  65           2HB      ASP  65  12.993   3.433   6.785
  528    HB3  ASP  65           1HB      ASP  65  12.766   3.843   5.091
  529    H    ILE  66           H        ILE  66  14.055   2.598   3.081
  530    HA   ILE  66           HA       ILE  66  12.094   1.337   1.501
  531    HB   ILE  66           HB       ILE  66  14.868   2.234   0.672
  532   HG12  ILE  66          2HG1      ILE  66  12.206   3.692   0.555
  533   HG13  ILE  66          1HG1      ILE  66  13.530   4.056   1.656
  534   HG21  ILE  66          1HG2      ILE  66  13.952   2.328  -1.607
  535   HG22  ILE  66          2HG2      ILE  66  12.429   1.660  -1.020
  536   HG23  ILE  66          3HG2      ILE  66  13.901   0.691  -0.951
  537   HD11  ILE  66          3HD1      ILE  66  13.606   4.313  -1.344
  538   HD12  ILE  66          1HD1      ILE  66  14.937   4.673  -0.243
  539   HD13  ILE  66          2HD1      ILE  66  13.459   5.631  -0.182
  540    H    LEU  67           H        LEU  67  15.581   0.480   1.635
  541    HA   LEU  67           HA       LEU  67  15.254  -1.937   0.225
  542    HB2  LEU  67           2HB      LEU  67  17.574  -2.455   1.013
  543    HB3  LEU  67           1HB      LEU  67  17.382  -0.920   0.197
  544    HG   LEU  67           HG       LEU  67  17.243   0.102   2.575
  545   HD11  LEU  67          1HD1      LEU  67  16.992  -1.943   3.843
  546   HD12  LEU  67          2HD1      LEU  67  18.488  -1.127   4.293
  547   HD13  LEU  67          3HD1      LEU  67  18.538  -2.539   3.236
  548   HD21  LEU  67          3HD2      LEU  67  19.100   0.468   1.031
  549   HD22  LEU  67          1HD2      LEU  67  19.850  -1.035   1.565
  550   HD23  LEU  67          2HD2      LEU  67  19.671   0.310   2.690
  551    H    LEU  68           H        LEU  68  14.719  -1.238   3.545
  552    HA   LEU  68           HA       LEU  68  15.090  -3.826   4.640
  553    HB2  LEU  68           2HB      LEU  68  15.019  -1.842   6.035
  554    HB3  LEU  68           1HB      LEU  68  13.369  -1.515   5.542
  555    HG   LEU  68           HG       LEU  68  12.602  -3.546   6.707
  556   HD11  LEU  68          1HD1      LEU  68  15.476  -3.818   7.602
  557   HD12  LEU  68          2HD1      LEU  68  14.637  -4.892   6.479
  558   HD13  LEU  68          3HD1      LEU  68  14.116  -4.792   8.161
  559   HD21  LEU  68          3HD2      LEU  68  14.276  -1.719   8.442
  560   HD22  LEU  68          1HD2      LEU  68  12.954  -2.749   8.994
  561   HD23  LEU  68          2HD2      LEU  68  12.626  -1.407   7.899
  562    H    PHE  69           H        PHE  69  11.956  -2.161   4.042
  563    HA   PHE  69           HA       PHE  69  10.607  -4.720   4.205
  564    HB2  PHE  69           2HB      PHE  69   9.701  -1.874   4.078
  565    HB3  PHE  69           1HB      PHE  69   8.549  -3.161   3.727
  566    HD1  PHE  69           HD1      PHE  69  10.826  -1.808   6.322
  567    HD2  PHE  69           HD2      PHE  69   7.613  -4.463   5.454
  568    HE1  PHE  69           HE1      PHE  69  10.454  -2.145   8.726
  569    HE2  PHE  69           HE2      PHE  69   7.240  -4.801   7.861
  570    HZ   PHE  69           HZ       PHE  69   8.664  -3.641   9.501
  571    H    ARG  70           H        ARG  70  11.560  -2.553   1.612
  572    HA   ARG  70           HA       ARG  70   9.818  -3.471  -0.393
  573    HB2  ARG  70           2HB      ARG  70  11.289  -1.501  -0.642
  574    HB3  ARG  70           1HB      ARG  70  12.693  -2.553  -0.693
  575    HG2  ARG  70           2HG      ARG  70  10.500  -2.862  -2.717
  576    HG3  ARG  70           1HG      ARG  70  11.711  -1.595  -2.897
  577    HD2  ARG  70           2HD      ARG  70  13.488  -3.272  -2.893
  578    HD3  ARG  70           1HD      ARG  70  12.303  -4.551  -2.640
  579    HE   ARG  70           HE       ARG  70  11.803  -2.992  -4.991
  580   HH11  ARG  70          1HH1      ARG  70  13.628  -5.643  -3.748
  581   HH12  ARG  70          2HH1      ARG  70  13.741  -6.419  -5.288
  582   HH21  ARG  70          1HH2      ARG  70  11.977  -3.989  -6.949
  583   HH22  ARG  70          2HH2      ARG  70  12.827  -5.491  -7.077
  584    H    ASP  71           H        ASP  71  12.971  -4.724   0.634
  585    HA   ASP  71           HA       ASP  71  13.312  -6.660  -1.353
  586    HB2  ASP  71           2HB      ASP  71  15.104  -5.905   0.144
  587    HB3  ASP  71           1HB      ASP  71  14.307  -6.684   1.508
  588    H    ARG  72           H        ARG  72  11.630  -6.896   1.761
  589    HA   ARG  72           HA       ARG  72  11.111  -9.728   1.417
  590    HB2  ARG  72           2HB      ARG  72   9.902  -9.519   3.587
  591    HB3  ARG  72           1HB      ARG  72  11.568  -8.968   3.650
  592    HG2  ARG  72           2HG      ARG  72  10.800  -6.641   3.480
  593    HG3  ARG  72           1HG      ARG  72   9.130  -7.204   3.456
  594    HD2  ARG  72           2HD      ARG  72  11.092  -7.654   5.713
  595    HD3  ARG  72           1HD      ARG  72   9.844  -6.411   5.685
  596    HE   ARG  72           HE       ARG  72   8.853  -9.094   5.323
  597   HH11  ARG  72          1HH1      ARG  72   9.690  -6.690   7.656
  598   HH12  ARG  72          2HH1      ARG  72   8.613  -7.325   8.852
  599   HH21  ARG  72          1HH2      ARG  72   7.514  -9.909   6.870
  600   HH22  ARG  72          2HH2      ARG  72   7.423  -9.151   8.422
  601    H    PHE  73           H        PHE  73   9.348  -6.737   0.890
  602    HA   PHE  73           HA       PHE  73   6.806  -8.186   0.604
  603    HB2  PHE  73           2HB      PHE  73   7.540  -5.331   1.077
  604    HB3  PHE  73           1HB      PHE  73   6.019  -5.672   0.268
  605    HD1  PHE  73           HD1      PHE  73   4.215  -6.814   1.433
  606    HD2  PHE  73           HD2      PHE  73   7.866  -5.874   3.417
  607    HE1  PHE  73           HE1      PHE  73   3.132  -7.201   3.604
  608    HE2  PHE  73           HE2      PHE  73   6.788  -6.273   5.593
  609    HZ   PHE  73           HZ       PHE  73   4.417  -6.939   5.691
  610    H    ASP  74           H        ASP  74   9.252  -7.464  -1.468
  611    HA   ASP  74           HA       ASP  74   7.961  -6.244  -3.648
  612    HB2  ASP  74           2HB      ASP  74  10.395  -6.393  -3.493
  613    HB3  ASP  74           1HB      ASP  74  10.317  -8.142  -3.678
  614    H    GLY  75           H        GLY  75   5.887  -7.272  -3.777
  615    HA2  GLY  75           2HA      GLY  75   4.473  -8.431  -5.184
  616    HA3  GLY  75           1HA      GLY  75   5.874  -9.180  -5.926
  617    H    TYR  76           H        TYR  76   4.112  -9.292  -2.797
  618    HA   TYR  76           HA       TYR  76   4.411 -12.233  -2.879
  619    HB2  TYR  76           2HB      TYR  76   4.518 -12.314  -0.566
  620    HB3  TYR  76           1HB      TYR  76   5.325 -10.784  -0.884
  621    HD1  TYR  76           HD1      TYR  76   3.858  -8.641  -0.726
  622    HD2  TYR  76           HD2      TYR  76   2.726 -12.400   0.926
  623    HE1  TYR  76           HE1      TYR  76   2.288  -7.505   0.787
  624    HE2  TYR  76           HE2      TYR  76   1.153 -11.270   2.438
  625    HH   TYR  76           HH       TYR  76   0.872  -9.009   3.447
  626    H    ILE  77           H        ILE  77   2.559 -13.523  -2.098
  627    HA   ILE  77           HA       ILE  77   0.042 -12.330  -3.040
  628    HB   ILE  77           HB       ILE  77   0.780 -15.235  -2.615
  629   HG12  ILE  77          2HG1      ILE  77   1.906 -14.177  -4.542
  630   HG13  ILE  77          1HG1      ILE  77   0.736 -15.386  -5.062
  631   HG21  ILE  77          1HG2      ILE  77  -1.597 -14.907  -2.209
  632   HG22  ILE  77          2HG2      ILE  77  -1.353 -15.752  -3.737
  633   HG23  ILE  77          3HG2      ILE  77  -1.761 -14.036  -3.734
  634   HD11  ILE  77          3HD1      ILE  77   0.346 -12.401  -5.084
  635   HD12  ILE  77          1HD1      ILE  77  -0.863 -13.594  -5.562
  636   HD13  ILE  77          2HD1      ILE  77   0.634 -13.439  -6.480
  637    H    PHE  78           H        PHE  78  -1.137 -11.437  -1.469
  638    HA   PHE  78           HA       PHE  78  -1.404 -12.798   1.130
  639    HB2  PHE  78           2HB      PHE  78  -0.839 -10.378   1.137
  640    HB3  PHE  78           1HB      PHE  78  -2.340 -10.037   0.286
  641    HD1  PHE  78           HD1      PHE  78  -1.020 -11.513   3.444
  642    HD2  PHE  78           HD2      PHE  78  -4.299  -9.610   1.491
  643    HE1  PHE  78           HE1      PHE  78  -2.182 -11.300   5.603
  644    HE2  PHE  78           HE2      PHE  78  -5.461  -9.397   3.648
  645    HZ   PHE  78           HZ       PHE  78  -4.404 -10.241   5.708
  646    H    LEU  79           H        LEU  79  -3.266 -13.802   1.721
  647    HA   LEU  79           HA       LEU  79  -5.596 -13.585  -0.086
  648    HB2  LEU  79           2HB      LEU  79  -4.774 -15.874   1.712
  649    HB3  LEU  79           1HB      LEU  79  -6.205 -15.844   0.696
  650    HG   LEU  79           HG       LEU  79  -3.354 -15.759  -0.322
  651   HD11  LEU  79          1HD1      LEU  79  -3.767 -18.041  -1.085
  652   HD12  LEU  79          2HD1      LEU  79  -5.354 -18.020  -0.311
  653   HD13  LEU  79          3HD1      LEU  79  -3.889 -17.916   0.670
  654   HD21  LEU  79          3HD2      LEU  79  -4.382 -16.145  -2.521
  655   HD22  LEU  79          1HD2      LEU  79  -4.887 -14.611  -1.812
  656   HD23  LEU  79          2HD2      LEU  79  -5.981 -15.994  -1.791
  657    H    ASP  80           H        ASP  80  -7.641 -13.268   0.760
  658    HA   ASP  80           HA       ASP  80  -7.805 -12.424   3.566
  659    HB2  ASP  80           2HB      ASP  80  -9.853 -11.325   2.947
  660    HB3  ASP  80           1HB      ASP  80  -8.679 -10.983   1.681
  661    H    SER  81           H        SER  81 -10.688 -12.900   3.755
  662    HA   SER  81           HA       SER  81 -10.714 -15.561   4.766
  663    HB2  SER  81           2HB      SER  81 -13.007 -13.653   4.221
  664    HB3  SER  81           1HB      SER  81 -13.147 -15.163   5.121
  665    HG   SER  81           HG       SER  81 -12.703 -13.901   6.756
  666    H    LYS  82           H        LYS  82 -12.089 -14.087   1.830
  667    HA   LYS  82           HA       LYS  82 -13.186 -16.547   0.840
  668    HB2  LYS  82           2HB      LYS  82 -12.698 -13.855  -0.439
  669    HB3  LYS  82           1HB      LYS  82 -13.391 -15.207  -1.322
  670    HG2  LYS  82           2HG      LYS  82 -14.575 -13.958   1.159
  671    HG3  LYS  82           1HG      LYS  82 -15.099 -13.651  -0.500
  672    HD2  LYS  82           2HD      LYS  82 -15.592 -16.089  -0.729
  673    HD3  LYS  82           1HD      LYS  82 -15.218 -16.285   0.986
  674    HE2  LYS  82           2HE      LYS  82 -17.397 -14.542  -0.176
  675    HE3  LYS  82           1HE      LYS  82 -17.631 -16.106   0.601
  676    HZ1  LYS  82           3HZ      LYS  82 -18.113 -14.334   2.125
  677    HZ2  LYS  82           1HZ      LYS  82 -16.594 -13.639   1.886
  678    HZ3  LYS  82           2HZ      LYS  82 -16.727 -15.142   2.648
  679    H    GLY  83           H        GLY  83 -10.158 -14.805   0.371
  680    HA2  GLY  83           2HA      GLY  83  -8.127 -16.008   0.019
  681    HA3  GLY  83           1HA      GLY  83  -9.035 -17.268  -0.797
  682    H    LEU  84           H        LEU  84  -9.362 -13.819  -1.479
  683    HA   LEU  84           HA       LEU  84  -8.659 -14.219  -4.242
  684    HB2  LEU  84           2HB      LEU  84  -9.161 -11.666  -2.700
  685    HB3  LEU  84           1HB      LEU  84  -8.994 -11.777  -4.442
  686    HG   LEU  84           HG       LEU  84 -11.219 -12.964  -2.774
  687   HD11  LEU  84          1HD1      LEU  84 -11.399 -10.559  -3.068
  688   HD12  LEU  84          2HD1      LEU  84 -12.638 -11.394  -4.003
  689   HD13  LEU  84          3HD1      LEU  84 -11.212 -10.737  -4.811
  690   HD21  LEU  84          3HD2      LEU  84 -10.759 -13.118  -5.756
  691   HD22  LEU  84          1HD2      LEU  84 -12.220 -13.642  -4.915
  692   HD23  LEU  84          2HD2      LEU  84 -10.689 -14.463  -4.617
  693    H    GLU  85           H        GLU  85  -6.663 -14.180  -5.061
  694    HA   GLU  85           HA       GLU  85  -4.359 -13.722  -3.506
  695    HB2  GLU  85           2HB      GLU  85  -4.579 -13.758  -6.525
  696    HB3  GLU  85           1HB      GLU  85  -3.103 -13.961  -5.589
  697    HG2  GLU  85           2HG      GLU  85  -3.973 -16.041  -4.651
  698    HG3  GLU  85           1HG      GLU  85  -5.466 -15.833  -5.565
  699    H    TYR  86           H        TYR  86  -4.093 -11.706  -2.642
  700    HA   TYR  86           HA       TYR  86  -4.127  -9.365  -4.388
  701    HB2  TYR  86           2HB      TYR  86  -3.332  -9.511  -1.467
  702    HB3  TYR  86           1HB      TYR  86  -3.725  -8.063  -2.387
  703    HD1  TYR  86           HD1      TYR  86  -6.203  -8.340  -3.591
  704    HD2  TYR  86           HD2      TYR  86  -4.939 -10.149   0.049
  705    HE1  TYR  86           HE1      TYR  86  -8.548  -8.518  -2.867
  706    HE2  TYR  86           HE2      TYR  86  -7.273 -10.336   0.777
  707    HH   TYR  86           HH       TYR  86  -9.848 -10.104  -1.189
  708    HA   PRO  87           HA       PRO  87   0.313 -10.316  -4.905
  709    HB2  PRO  87           2HB      PRO  87   0.299  -9.031  -7.451
  710    HB3  PRO  87           1HB      PRO  87   0.280 -10.764  -7.124
  711    HG2  PRO  87           2HG      PRO  87  -1.805  -9.299  -8.263
  712    HG3  PRO  87           1HG      PRO  87  -1.943 -10.921  -7.564
  713    HD2  PRO  87           2HD      PRO  87  -2.656  -8.272  -6.381
  714    HD3  PRO  87           1HD      PRO  87  -3.440  -9.851  -6.176
  715    H    ALA  88           H        ALA  88   0.830  -8.772  -3.257
  716    HA   ALA  88           HA       ALA  88   0.734  -5.961  -3.790
  717    HB1  ALA  88           3HB      ALA  88   0.483  -6.887  -1.527
  718    HB2  ALA  88           1HB      ALA  88   1.785  -5.699  -1.617
  719    HB3  ALA  88           2HB      ALA  88   2.163  -7.420  -1.568
  720    H    VAL  89           H        VAL  89   1.962  -5.719  -5.714
  721    HA   VAL  89           HA       VAL  89   4.854  -6.182  -5.532
  722    HB   VAL  89           HB       VAL  89   3.273  -5.111  -7.886
  723   HG11  VAL  89          1HG1      VAL  89   6.081  -6.221  -7.717
  724   HG12  VAL  89          2HG1      VAL  89   5.643  -4.529  -7.959
  725   HG13  VAL  89          3HG1      VAL  89   5.258  -5.725  -9.195
  726   HG21  VAL  89          3HG2      VAL  89   2.507  -7.357  -7.334
  727   HG22  VAL  89          1HG2      VAL  89   4.171  -7.942  -7.311
  728   HG23  VAL  89          2HG2      VAL  89   3.454  -7.385  -8.822
  729    H    VAL  90           H        VAL  90   5.907  -4.626  -4.446
  730    HA   VAL  90           HA       VAL  90   5.009  -1.840  -4.695
  731    HB   VAL  90           HB       VAL  90   5.049  -2.740  -2.426
  732   HG11  VAL  90          1HG1      VAL  90   7.124  -3.327  -1.286
  733   HG12  VAL  90          2HG1      VAL  90   8.022  -3.101  -2.786
  734   HG13  VAL  90          3HG1      VAL  90   6.827  -4.393  -2.662
  735   HG21  VAL  90          3HG2      VAL  90   7.160  -0.633  -2.874
  736   HG22  VAL  90          1HG2      VAL  90   6.363  -0.973  -1.338
  737   HG23  VAL  90          2HG2      VAL  90   5.426  -0.363  -2.703
  738    H    GLU  91           H        GLU  91   6.056  -0.750  -6.270
  739    HA   GLU  91           HA       GLU  91   8.954  -1.222  -6.632
  740    HB2  GLU  91           2HB      GLU  91   8.669  -0.607  -8.993
  741    HB3  GLU  91           1HB      GLU  91   7.692  -2.003  -8.559
  742    HG2  GLU  91           2HG      GLU  91   5.696  -0.652  -8.493
  743    HG3  GLU  91           1HG      GLU  91   6.639   0.816  -8.753
  744    H    PHE  92           H        PHE  92  10.245   0.590  -7.353
  745    HA   PHE  92           HA       PHE  92   9.576   2.958  -5.857
  746    HB2  PHE  92           2HB      PHE  92  11.848   3.706  -6.381
  747    HB3  PHE  92           1HB      PHE  92  11.853   2.053  -5.777
  748    HD1  PHE  92           HD1      PHE  92  12.082   0.162  -7.433
  749    HD2  PHE  92           HD2      PHE  92  12.763   4.228  -8.499
  750    HE1  PHE  92           HE1      PHE  92  13.345  -0.575  -9.416
  751    HE2  PHE  92           HE2      PHE  92  14.023   3.500 -10.484
  752    HZ   PHE  92           HZ       PHE  92  14.316   1.096 -10.945
  753    H    ALA  93           H        ALA  93   9.455   5.072  -6.619
  754    HA   ALA  93           HA       ALA  93   8.844   5.422  -9.468
  755    HB1  ALA  93           3HB      ALA  93   8.480   7.361  -7.173
  756    HB2  ALA  93           1HB      ALA  93   7.227   6.309  -7.833
  757    HB3  ALA  93           2HB      ALA  93   7.920   7.588  -8.830
  758    HA   PRO  94           HA       PRO  94  12.838   7.054 -10.396
  759    HB2  PRO  94           2HB      PRO  94  12.195   8.886 -12.350
  760    HB3  PRO  94           1HB      PRO  94  12.286   7.140 -12.612
  761    HG2  PRO  94           2HG      PRO  94   9.880   8.854 -12.084
  762    HG3  PRO  94           1HG      PRO  94  10.084   7.544 -13.266
  763    HD2  PRO  94           2HD      PRO  94   8.786   7.138 -10.955
  764    HD3  PRO  94           1HD      PRO  94   9.832   5.881 -11.652
  765    H    PHE  95           H        PHE  95  14.053   9.153 -10.680
  766    HA   PHE  95           HA       PHE  95  13.436  10.875  -8.441
  767    HB2  PHE  95           2HB      PHE  95  15.661  11.892  -8.943
  768    HB3  PHE  95           1HB      PHE  95  15.728  10.153  -8.691
  769    HD1  PHE  95           HD1      PHE  95  15.998  12.848 -11.175
  770    HD2  PHE  95           HD2      PHE  95  16.323   8.656 -10.478
  771    HE1  PHE  95           HE1      PHE  95  17.142  12.578 -13.336
  772    HE2  PHE  95           HE2      PHE  95  17.468   8.383 -12.638
  773    HZ   PHE  95           HZ       PHE  95  17.875  10.343 -14.070
  774    H    GLN  96           H        GLN  96  14.077  13.307  -8.834
  775    HA   GLN  96           HA       GLN  96  12.858  14.322 -11.318
  776    HB2  GLN  96           2HB      GLN  96  12.202  15.106  -8.478
  777    HB3  GLN  96           1HB      GLN  96  11.878  16.183  -9.830
  778    HG2  GLN  96           2HG      GLN  96  10.804  13.378  -9.614
  779    HG3  GLN  96           1HG      GLN  96   9.931  14.818  -9.091
  780   HE21  GLN  96          1HE2      GLN  96  11.249  13.128 -11.855
  781   HE22  GLN  96          2HE2      GLN  96  10.295  13.943 -13.044
  782    H    LYS  97           H        LYS  97  13.244  16.792 -11.444
  783    HA   LYS  97           HA       LYS  97  16.040  17.262 -11.386
  784    HB2  LYS  97           2HB      LYS  97  14.572  18.252 -13.084
  785    HB3  LYS  97           1HB      LYS  97  13.757  19.196 -11.847
  786    HG2  LYS  97           2HG      LYS  97  15.324  20.573 -13.090
  787    HG3  LYS  97           1HG      LYS  97  15.827  20.426 -11.406
  788    HD2  LYS  97           2HD      LYS  97  17.733  20.223 -12.942
  789    HD3  LYS  97           1HD      LYS  97  17.481  18.740 -12.019
  790    HE2  LYS  97           2HE      LYS  97  16.359  17.722 -13.938
  791    HE3  LYS  97           1HE      LYS  97  16.554  19.214 -14.860
  792    HZ1  LYS  97           3HZ      LYS  97  18.786  17.562 -13.808
  793    HZ2  LYS  97           1HZ      LYS  97  18.933  18.940 -14.776
  794    HZ3  LYS  97           2HZ      LYS  97  18.233  17.536 -15.403
  Start of MODEL   11
    1    H1   MET   1           1H       MET   1  23.638  22.693 -13.287
    2    H2   MET   1           2H       MET   1  24.044  21.132 -13.803
    3    H3   MET   1           3H       MET   1  24.958  21.892 -12.601
    4    HA   MET   1           HA       MET   1  23.095  21.882 -11.096
    5    HB2  MET   1           2HB      MET   1  21.697  20.335 -13.296
    6    HB3  MET   1           1HB      MET   1  21.054  20.636 -11.687
    7    HG2  MET   1           2HG      MET   1  21.647  22.713 -13.788
    8    HG3  MET   1           1HG      MET   1  20.054  22.142 -13.297
    9    HE1  MET   1           3HE      MET   1  20.257  21.931 -10.157
   10    HE2  MET   1           1HE      MET   1  18.910  22.707 -10.991
   11    HE3  MET   1           2HE      MET   1  19.727  23.542  -9.670
   12    H    GLY   2           H        GLY   2  23.129  18.967 -13.165
   13    HA2  GLY   2           2HA      GLY   2  23.935  16.857 -12.829
   14    HA3  GLY   2           1HA      GLY   2  25.221  17.627 -11.926
   15    H    HIS   3           H        HIS   3  25.035  17.786  -9.648
   16    HA   HIS   3           HA       HIS   3  23.962  15.345  -8.589
   17    HB2  HIS   3           2HB      HIS   3  25.204  15.879  -6.585
   18    HB3  HIS   3           1HB      HIS   3  26.200  16.237  -7.990
   19    HD1  HIS   3           HD1      HIS   3  24.888  17.708  -4.931
   20    HD2  HIS   3           HD2      HIS   3  26.367  19.114  -8.549
   21    HE1  HIS   3           HE1      HIS   3  25.424  20.120  -4.543
   22    HE2  HIS   3           HE2      HIS   3  26.101  20.997  -6.795
   23    H    HIS   4           H        HIS   4  21.878  17.346  -9.297
   24    HA   HIS   4           HA       HIS   4  20.771  18.482  -6.962
   25    HB2  HIS   4           2HB      HIS   4  18.699  18.703  -8.204
   26    HB3  HIS   4           1HB      HIS   4  20.051  19.096  -9.257
   27    HD1  HIS   4           HD1      HIS   4  17.091  16.989  -9.025
   28    HD2  HIS   4           HD2      HIS   4  20.656  16.951 -11.163
   29    HE1  HIS   4           HE1      HIS   4  16.721  15.396 -10.926
   30    HE2  HIS   4           HE2      HIS   4  18.845  15.473 -12.265
   31    H    HIS   5           H        HIS   5  20.717  15.236  -8.206
   32    HA   HIS   5           HA       HIS   5  19.063  14.374  -5.919
   33    HB2  HIS   5           2HB      HIS   5  18.102  13.653  -8.016
   34    HB3  HIS   5           1HB      HIS   5  19.649  13.040  -8.577
   35    HD1  HIS   5           HD1      HIS   5  20.503  10.814  -7.432
   36    HD2  HIS   5           HD2      HIS   5  16.568  11.848  -6.601
   37    HE1  HIS   5           HE1      HIS   5  19.430   8.721  -6.566
   38    HE2  HIS   5           HE2      HIS   5  16.997   9.308  -6.362
   39    H    HIS   6           H        HIS   6  20.971  14.714  -4.568
   40    HA   HIS   6           HA       HIS   6  23.247  12.916  -5.007
   41    HB2  HIS   6           2HB      HIS   6  23.605  15.333  -4.500
   42    HB3  HIS   6           1HB      HIS   6  22.851  15.089  -2.931
   43    HD1  HIS   6           HD1      HIS   6  24.544  14.985  -1.162
   44    HD2  HIS   6           HD2      HIS   6  25.943  13.311  -4.700
   45    HE1  HIS   6           HE1      HIS   6  26.884  14.230  -0.669
   46    HE2  HIS   6           HE2      HIS   6  27.758  13.364  -2.858
   47    H    HIS   7           H        HIS   7  20.405  12.333  -3.836
   48    HA   HIS   7           HA       HIS   7  21.299  10.385  -1.877
   49    HB2  HIS   7           2HB      HIS   7  20.854  12.462  -0.560
   50    HB3  HIS   7           1HB      HIS   7  19.202  12.465  -1.164
   51    HD1  HIS   7           HD1      HIS   7  17.541  11.295   0.257
   52    HD2  HIS   7           HD2      HIS   7  21.426  10.063   1.078
   53    HE1  HIS   7           HE1      HIS   7  17.359   9.764   2.238
   54    HE2  HIS   7           HE2      HIS   7  19.728   9.133   2.795
   55    H    HIS   8           H        HIS   8  19.850   8.627  -1.689
   56    HA   HIS   8           HA       HIS   8  18.172   8.139  -3.913
   57    HB2  HIS   8           2HB      HIS   8  19.349   6.358  -2.621
   58    HB3  HIS   8           1HB      HIS   8  18.251   6.637  -1.277
   59    HD1  HIS   8           HD1      HIS   8  17.973   3.914  -1.899
   60    HD2  HIS   8           HD2      HIS   8  16.141   6.696  -4.389
   61    HE1  HIS   8           HE1      HIS   8  16.215   2.642  -3.151
   62    HE2  HIS   8           HE2      HIS   8  15.289   4.291  -4.805
   63    H    SER   9           H        SER   9  16.393   9.343  -4.213
   64    HA   SER   9           HA       SER   9  14.792  10.610  -2.355
   65    HB2  SER   9           2HB      SER   9  13.910   9.475  -5.025
   66    HB3  SER   9           1HB      SER   9  13.071  10.729  -4.111
   67    HG   SER   9           HG       SER   9  14.482  12.162  -4.768
   68    H    HIS  10           H        HIS  10  12.737  10.161  -1.441
   69    HA   HIS  10           HA       HIS  10  12.489   7.350  -0.669
   70    HB2  HIS  10           2HB      HIS  10  11.185   8.134   1.195
   71    HB3  HIS  10           1HB      HIS  10  12.610   9.153   1.049
   72    HD1  HIS  10           HD1      HIS  10   8.883   9.218   0.727
   73    HD2  HIS  10           HD2      HIS  10  12.092  11.838   0.415
   74    HE1  HIS  10           HE1      HIS  10   7.876  11.514   0.682
   75    HE2  HIS  10           HE2      HIS  10   9.845  13.071   0.755
   76    H    MET  11           H        MET  11  11.403   8.591  -3.276
   77    HA   MET  11           HA       MET  11   8.530   8.308  -2.988
   78    HB2  MET  11           2HB      MET  11  10.122   8.713  -5.531
   79    HB3  MET  11           1HB      MET  11   8.397   8.973  -5.309
   80    HG2  MET  11           2HG      MET  11  10.649  10.570  -4.109
   81    HG3  MET  11           1HG      MET  11   9.502  11.094  -5.340
   82    HE1  MET  11           3HE      MET  11  10.158  12.774  -2.710
   83    HE2  MET  11           1HE      MET  11   8.543  13.288  -2.222
   84    HE3  MET  11           2HE      MET  11   8.997  13.307  -3.926
   85    H    VAL  12           H        VAL  12   8.053   6.180  -2.560
   86    HA   VAL  12           HA       VAL  12   8.691   4.222  -4.675
   87    HB   VAL  12           HB       VAL  12   8.625   3.609  -1.706
   88   HG11  VAL  12          1HG1      VAL  12   9.326   1.859  -4.068
   89   HG12  VAL  12          2HG1      VAL  12   7.871   1.738  -3.077
   90   HG13  VAL  12          3HG1      VAL  12   9.451   1.394  -2.369
   91   HG21  VAL  12          3HG2      VAL  12  11.037   3.242  -1.887
   92   HG22  VAL  12          1HG2      VAL  12  10.619   4.906  -2.295
   93   HG23  VAL  12          2HG2      VAL  12  10.999   3.752  -3.575
   94    H    VAL  13           H        VAL  13   6.922   3.253  -5.507
   95    HA   VAL  13           HA       VAL  13   4.355   3.643  -4.096
   96    HB   VAL  13           HB       VAL  13   3.268   3.521  -6.310
   97   HG11  VAL  13          1HG1      VAL  13   3.835   5.694  -5.367
   98   HG12  VAL  13          2HG1      VAL  13   4.005   5.720  -7.122
   99   HG13  VAL  13          3HG1      VAL  13   5.438   5.613  -6.099
  100   HG21  VAL  13          3HG2      VAL  13   6.096   3.458  -7.392
  101   HG22  VAL  13          1HG2      VAL  13   4.631   3.659  -8.357
  102   HG23  VAL  13          2HG2      VAL  13   4.914   2.151  -7.489
  103    H    ILE  14           H        ILE  14   2.734   2.042  -4.226
  104    HA   ILE  14           HA       ILE  14   3.728  -0.702  -4.605
  105    HB   ILE  14           HB       ILE  14   2.692  -0.000  -2.392
  106   HG12  ILE  14          2HG1      ILE  14   1.226  -2.093  -2.243
  107   HG13  ILE  14          1HG1      ILE  14   1.572  -2.335  -3.953
  108   HG21  ILE  14          1HG2      ILE  14   0.257   0.095  -2.223
  109   HG22  ILE  14          2HG2      ILE  14   0.125  -0.029  -3.977
  110   HG23  ILE  14          3HG2      ILE  14   0.884   1.386  -3.249
  111   HD11  ILE  14          3HD1      ILE  14   3.588  -2.241  -1.719
  112   HD12  ILE  14          1HD1      ILE  14   3.971  -2.437  -3.429
  113   HD13  ILE  14          2HD1      ILE  14   3.043  -3.674  -2.584
  114    H    ARG  15           H        ARG  15   2.770  -2.070  -6.138
  115    HA   ARG  15           HA       ARG  15   0.674  -0.870  -7.834
  116    HB2  ARG  15           2HB      ARG  15   3.390  -1.860  -8.674
  117    HB3  ARG  15           1HB      ARG  15   2.052  -1.784  -9.815
  118    HG2  ARG  15           2HG      ARG  15   1.910   0.564  -9.660
  119    HG3  ARG  15           1HG      ARG  15   2.914   0.611  -8.209
  120    HD2  ARG  15           2HD      ARG  15   4.005   1.322 -10.402
  121    HD3  ARG  15           1HD      ARG  15   4.874   0.148  -9.415
  122    HE   ARG  15           HE       ARG  15   4.234  -1.554 -10.957
  123   HH11  ARG  15          1HH1      ARG  15   3.420   1.622 -12.007
  124   HH12  ARG  15          2HH1      ARG  15   3.394   1.176 -13.676
  125   HH21  ARG  15          1HH2      ARG  15   4.212  -2.115 -13.089
  126   HH22  ARG  15          2HH2      ARG  15   3.846  -0.921 -14.288
  127    H    ARG  16           H        ARG  16  -0.268  -2.343  -9.417
  128    HA   ARG  16           HA       ARG  16  -1.354  -4.200 -10.069
  129    HB2  ARG  16           2HB      ARG  16   0.974  -5.579  -8.730
  130    HB3  ARG  16           1HB      ARG  16  -0.288  -6.447  -9.597
  131    HG2  ARG  16           2HG      ARG  16   0.282  -4.936 -11.587
  132    HG3  ARG  16           1HG      ARG  16   1.739  -4.514 -10.688
  133    HD2  ARG  16           2HD      ARG  16   2.062  -6.357 -12.340
  134    HD3  ARG  16           1HD      ARG  16   2.480  -6.795 -10.686
  135    HE   ARG  16           HE       ARG  16   0.909  -8.427 -10.799
  136   HH11  ARG  16          1HH1      ARG  16   0.035  -6.022 -13.130
  137   HH12  ARG  16          2HH1      ARG  16  -1.335  -6.923 -13.687
  138   HH21  ARG  16          1HH2      ARG  16  -0.861  -9.551 -11.538
  139   HH22  ARG  16          2HH2      ARG  16  -1.821  -8.879 -12.811
  140    H    LEU  17           H        LEU  17  -2.037  -2.943  -7.525
  141    HA   LEU  17           HA       LEU  17  -3.049  -5.062  -5.850
  142    HB2  LEU  17           2HB      LEU  17  -3.341  -2.074  -5.865
  143    HB3  LEU  17           1HB      LEU  17  -4.410  -3.048  -4.877
  144    HG   LEU  17           HG       LEU  17  -2.561  -2.184  -3.554
  145   HD11  LEU  17          1HD1      LEU  17  -1.794  -4.265  -2.555
  146   HD12  LEU  17          2HD1      LEU  17  -2.303  -5.163  -3.983
  147   HD13  LEU  17          3HD1      LEU  17  -3.505  -4.370  -2.964
  148   HD21  LEU  17          3HD2      LEU  17  -0.757  -3.707  -5.437
  149   HD22  LEU  17          1HD2      LEU  17  -0.258  -2.897  -3.951
  150   HD23  LEU  17          2HD2      LEU  17  -0.884  -1.954  -5.302
  151    HA   PRO  18           HA       PRO  18  -6.825  -5.403  -8.314
  152    HB2  PRO  18           2HB      PRO  18  -7.696  -7.726  -7.272
  153    HB3  PRO  18           1HB      PRO  18  -6.341  -7.664  -8.406
  154    HG2  PRO  18           2HG      PRO  18  -6.315  -7.990  -5.437
  155    HG3  PRO  18           1HG      PRO  18  -5.271  -8.736  -6.659
  156    HD2  PRO  18           2HD      PRO  18  -4.608  -6.522  -5.093
  157    HD3  PRO  18           1HD      PRO  18  -3.793  -7.002  -6.595
  158    HA   PRO  19           HA       PRO  19  -9.568  -3.397  -5.398
  159    HB2  PRO  19           2HB      PRO  19 -11.905  -3.680  -6.825
  160    HB3  PRO  19           1HB      PRO  19 -10.690  -2.438  -7.144
  161    HG2  PRO  19           2HG      PRO  19 -11.120  -5.063  -8.523
  162    HG3  PRO  19           1HG      PRO  19 -10.745  -3.478  -9.227
  163    HD2  PRO  19           2HD      PRO  19  -8.853  -5.367  -8.916
  164    HD3  PRO  19           1HD      PRO  19  -8.485  -3.641  -8.707
  165    H    GLY  20           H        GLY  20  -9.922  -4.547  -3.555
  166    HA2  GLY  20           2HA      GLY  20 -12.132  -6.439  -3.528
  167    HA3  GLY  20           1HA      GLY  20 -10.570  -7.117  -3.111
  168    H    LEU  21           H        LEU  21  -9.686  -6.691  -1.096
  169    HA   LEU  21           HA       LEU  21 -11.461  -6.236   1.004
  170    HB2  LEU  21           2HB      LEU  21  -9.609  -6.376   2.485
  171    HB3  LEU  21           1HB      LEU  21  -9.331  -7.504   1.174
  172    HG   LEU  21           HG       LEU  21  -8.009  -4.793   1.449
  173   HD11  LEU  21          1HD1      LEU  21  -7.280  -6.363   3.177
  174   HD12  LEU  21          2HD1      LEU  21  -5.994  -6.035   2.016
  175   HD13  LEU  21          3HD1      LEU  21  -6.888  -7.554   1.934
  176   HD21  LEU  21          3HD2      LEU  21  -7.492  -7.037  -0.510
  177   HD22  LEU  21          1HD2      LEU  21  -6.530  -5.567  -0.350
  178   HD23  LEU  21          2HD2      LEU  21  -8.206  -5.469  -0.886
  179    H    THR  22           H        THR  22 -11.234  -4.617   2.751
  180    HA   THR  22           HA       THR  22 -11.371  -1.938   1.600
  181    HB   THR  22           HB       THR  22 -12.082  -2.825   4.416
  182    HG1  THR  22           HG1      THR  22 -13.648  -2.670   2.034
  183   HG21  THR  22          3HG2      THR  22 -13.438  -0.774   4.457
  184   HG22  THR  22          1HG2      THR  22 -12.871  -0.361   2.838
  185   HG23  THR  22          2HG2      THR  22 -11.736  -0.401   4.188
  186    H    LYS  23           H        LYS  23 -10.218  -0.142   2.447
  187    HA   LYS  23           HA       LYS  23  -7.552  -0.363   2.816
  188    HB2  LYS  23           2HB      LYS  23  -7.547   1.899   3.771
  189    HB3  LYS  23           1HB      LYS  23  -8.610   1.769   2.377
  190    HG2  LYS  23           2HG      LYS  23 -10.552   1.659   3.849
  191    HG3  LYS  23           1HG      LYS  23  -9.497   1.742   5.261
  192    HD2  LYS  23           2HD      LYS  23  -9.780   3.880   3.138
  193    HD3  LYS  23           1HD      LYS  23 -10.483   3.932   4.756
  194    HE2  LYS  23           2HE      LYS  23  -8.214   3.856   5.723
  195    HE3  LYS  23           1HE      LYS  23  -7.533   3.850   4.098
  196    HZ1  LYS  23           3HZ      LYS  23  -8.516   6.015   3.715
  197    HZ2  LYS  23           1HZ      LYS  23  -7.510   6.057   5.072
  198    HZ3  LYS  23           2HZ      LYS  23  -9.189   6.019   5.263
  199    H    GLU  24           H        GLU  24  -9.932  -0.515   5.437
  200    HA   GLU  24           HA       GLU  24  -8.385  -0.359   7.693
  201    HB2  GLU  24           2HB      GLU  24 -10.648  -2.301   7.170
  202    HB3  GLU  24           1HB      GLU  24 -10.040  -1.862   8.761
  203    HG2  GLU  24           2HG      GLU  24 -10.762   0.420   8.463
  204    HG3  GLU  24           1HG      GLU  24 -11.242   0.088   6.800
  205    H    GLN  25           H        GLN  25  -8.952  -3.341   5.793
  206    HA   GLN  25           HA       GLN  25  -6.881  -4.747   7.350
  207    HB2  GLN  25           2HB      GLN  25  -8.693  -5.868   5.197
  208    HB3  GLN  25           1HB      GLN  25  -7.720  -6.779   6.342
  209    HG2  GLN  25           2HG      GLN  25  -9.119  -5.930   8.180
  210    HG3  GLN  25           1HG      GLN  25 -10.112  -5.067   7.004
  211   HE21  GLN  25          1HE2      GLN  25 -11.390  -6.283   5.559
  212   HE22  GLN  25          2HE2      GLN  25 -11.822  -7.919   5.895
  213    H    LEU  26           H        LEU  26  -6.943  -2.825   4.727
  214    HA   LEU  26           HA       LEU  26  -5.165  -4.412   3.027
  215    HB2  LEU  26           2HB      LEU  26  -6.896  -3.458   1.794
  216    HB3  LEU  26           1HB      LEU  26  -6.814  -1.942   2.653
  217    HG   LEU  26           HG       LEU  26  -4.572  -1.557   1.501
  218   HD11  LEU  26          1HD1      LEU  26  -5.545  -3.868  -0.179
  219   HD12  LEU  26          2HD1      LEU  26  -4.097  -3.834   0.829
  220   HD13  LEU  26          3HD1      LEU  26  -4.205  -2.795  -0.591
  221   HD21  LEU  26          3HD2      LEU  26  -7.068  -1.737  -0.192
  222   HD22  LEU  26          1HD2      LEU  26  -5.633  -0.778  -0.567
  223   HD23  LEU  26          2HD2      LEU  26  -6.607  -0.390   0.851
  224    H    GLU  27           H        GLU  27  -5.169  -1.335   4.818
  225    HA   GLU  27           HA       GLU  27  -2.566  -0.593   3.846
  226    HB2  GLU  27           2HB      GLU  27  -2.762   1.337   5.297
  227    HB3  GLU  27           1HB      GLU  27  -4.255   1.094   4.401
  228    HG2  GLU  27           2HG      GLU  27  -5.211  -0.005   6.420
  229    HG3  GLU  27           1HG      GLU  27  -3.743   0.429   7.293
  230    H    GLU  28           H        GLU  28  -3.726  -2.415   6.565
  231    HA   GLU  28           HA       GLU  28  -1.672  -1.907   8.400
  232    HB2  GLU  28           2HB      GLU  28  -2.315  -4.040   9.475
  233    HB3  GLU  28           1HB      GLU  28  -3.695  -3.021   9.104
  234    HG2  GLU  28           2HG      GLU  28  -4.279  -4.392   7.225
  235    HG3  GLU  28           1HG      GLU  28  -2.806  -5.342   7.409
  236    H    GLN  29           H        GLN  29  -1.693  -4.021   5.596
  237    HA   GLN  29           HA       GLN  29   0.984  -5.010   6.269
  238    HB2  GLN  29           2HB      GLN  29   0.786  -6.437   4.262
  239    HB3  GLN  29           1HB      GLN  29  -0.518  -6.701   5.408
  240    HG2  GLN  29           2HG      GLN  29  -0.939  -4.828   3.113
  241    HG3  GLN  29           1HG      GLN  29  -0.997  -6.566   2.837
  242   HE21  GLN  29          1HE2      GLN  29  -3.183  -6.555   2.340
  243   HE22  GLN  29          2HE2      GLN  29  -4.403  -6.291   3.533
  244    H    LEU  30           H        LEU  30  -0.565  -2.687   4.173
  245    HA   LEU  30           HA       LEU  30   1.712  -2.287   2.469
  246    HB2  LEU  30           2HB      LEU  30  -0.730  -0.572   2.936
  247    HB3  LEU  30           1HB      LEU  30   0.489  -0.244   1.719
  248    HG   LEU  30           HG       LEU  30  -1.352  -2.641   1.812
  249   HD11  LEU  30          1HD1      LEU  30  -2.456  -0.597   1.097
  250   HD12  LEU  30          2HD1      LEU  30  -2.267  -1.709  -0.257
  251   HD13  LEU  30          3HD1      LEU  30  -1.197  -0.315  -0.106
  252   HD21  LEU  30          3HD2      LEU  30   0.811  -1.962  -0.187
  253   HD22  LEU  30          1HD2      LEU  30  -0.358  -3.274  -0.341
  254   HD23  LEU  30          2HD2      LEU  30   0.833  -3.304   0.956
  255    H    ARG  31           H        ARG  31   0.792  -1.082   5.599
  256    HA   ARG  31           HA       ARG  31   3.245   0.541   5.573
  257    HB2  ARG  31           2HB      ARG  31   2.196   2.224   7.055
  258    HB3  ARG  31           1HB      ARG  31   1.476   2.162   5.456
  259    HG2  ARG  31           2HG      ARG  31  -0.498   1.146   6.265
  260    HG3  ARG  31           1HG      ARG  31   0.249   0.747   7.814
  261    HD2  ARG  31           2HD      ARG  31   0.425   3.142   8.336
  262    HD3  ARG  31           1HD      ARG  31  -0.341   3.533   6.797
  263    HE   ARG  31           HE       ARG  31  -2.373   2.521   7.645
  264   HH11  ARG  31          1HH1      ARG  31   0.088   3.098  10.003
  265   HH12  ARG  31          2HH1      ARG  31  -1.047   3.213  11.303
  266   HH21  ARG  31          1HH2      ARG  31  -3.803   2.705   9.317
  267   HH22  ARG  31          2HH2      ARG  31  -3.210   2.991  10.923
  268    HA   PRO  32           HA       PRO  32   3.521  -2.040   9.380
  269    HB2  PRO  32           2HB      PRO  32   5.247  -3.915   8.629
  270    HB3  PRO  32           1HB      PRO  32   3.546  -4.037   8.161
  271    HG2  PRO  32           2HG      PRO  32   5.901  -3.168   6.533
  272    HG3  PRO  32           1HG      PRO  32   4.506  -4.151   6.053
  273    HD2  PRO  32           2HD      PRO  32   4.816  -1.397   5.604
  274    HD3  PRO  32           1HD      PRO  32   3.301  -2.307   5.475
  275    H    LEU  33           H        LEU  33   5.154   0.200   7.812
  276    HA   LEU  33           HA       LEU  33   7.864  -0.071   8.499
  277    HB2  LEU  33           2HB      LEU  33   6.173   2.376   7.970
  278    HB3  LEU  33           1HB      LEU  33   7.897   2.463   8.267
  279    HG   LEU  33           HG       LEU  33   8.272   1.015   6.256
  280   HD11  LEU  33          1HD1      LEU  33   6.461   0.762   4.626
  281   HD12  LEU  33          2HD1      LEU  33   5.320   1.441   5.790
  282   HD13  LEU  33          3HD1      LEU  33   6.118  -0.096   6.130
  283   HD21  LEU  33          3HD2      LEU  33   8.474   3.457   6.138
  284   HD22  LEU  33          1HD2      LEU  33   6.764   3.578   5.722
  285   HD23  LEU  33          2HD2      LEU  33   7.887   2.773   4.623
  286    HA   PRO  34           HA       PRO  34   8.085   0.324  12.873
  287    HB2  PRO  34           2HB      PRO  34  10.326   2.015  13.034
  288    HB3  PRO  34           1HB      PRO  34  10.355   0.252  12.950
  289    HG2  PRO  34           2HG      PRO  34  10.702   2.261  10.756
  290    HG3  PRO  34           1HG      PRO  34  11.538   0.715  11.008
  291    HD2  PRO  34           2HD      PRO  34   9.615   0.938   9.173
  292    HD3  PRO  34           1HD      PRO  34   9.745  -0.527  10.169
  293    H    ALA  35           H        ALA  35   8.958   3.482  11.417
  294    HA   ALA  35           HA       ALA  35   6.644   4.750  12.584
  295    HB1  ALA  35           3HB      ALA  35   9.389   5.549  13.565
  296    HB2  ALA  35           1HB      ALA  35   8.146   4.737  14.515
  297    HB3  ALA  35           2HB      ALA  35   7.880   6.384  13.937
  298    H    HIS  36           H        HIS  36   6.644   4.807  10.096
  299    HA   HIS  36           HA       HIS  36   7.839   7.362   9.230
  300    HB2  HIS  36           2HB      HIS  36   7.778   4.819   7.575
  301    HB3  HIS  36           1HB      HIS  36   8.320   6.395   7.005
  302    HD1  HIS  36           HD1      HIS  36   9.988   3.550   7.468
  303    HD2  HIS  36           HD2      HIS  36  10.293   7.149   9.536
  304    HE1  HIS  36           HE1      HIS  36  12.232   3.503   8.589
  305    HE2  HIS  36           HE2      HIS  36  12.457   5.748   9.689
  306    H    ASP  37           H        ASP  37   6.783   8.065   7.050
  307    HA   ASP  37           HA       ASP  37   4.025   8.441   7.693
  308    HB2  ASP  37           2HB      ASP  37   5.536  10.201   6.735
  309    HB3  ASP  37           1HB      ASP  37   5.500   9.335   5.203
  310    H    TYR  38           H        TYR  38   2.329   8.334   5.915
  311    HA   TYR  38           HA       TYR  38   2.638   6.078   4.080
  312    HB2  TYR  38           2HB      TYR  38   0.477   5.091   4.826
  313    HB3  TYR  38           1HB      TYR  38   1.717   5.032   6.073
  314    HD1  TYR  38           HD2      TYR  38   1.596   6.573   8.021
  315    HD2  TYR  38           HD1      TYR  38  -1.542   6.361   5.146
  316    HE1  TYR  38           HE2      TYR  38   0.091   7.715   9.589
  317    HE2  TYR  38           HE1      TYR  38  -3.056   7.508   6.711
  318    HH   TYR  38           HH       TYR  38  -1.962   9.101   9.480
  319    H    PHE  39           H        PHE  39   1.195   6.112   2.313
  320    HA   PHE  39           HA       PHE  39   0.034   8.748   1.772
  321    HB2  PHE  39           2HB      PHE  39   1.631   7.131   0.248
  322    HB3  PHE  39           1HB      PHE  39   0.042   6.688  -0.364
  323    HD1  PHE  39           HD2      PHE  39   2.414   9.479   0.090
  324    HD2  PHE  39           HD1      PHE  39  -1.192   8.178  -1.763
  325    HE1  PHE  39           HE2      PHE  39   2.428  11.480  -1.339
  326    HE2  PHE  39           HE1      PHE  39  -1.182  10.179  -3.192
  327    HZ   PHE  39           HZ       PHE  39   0.627  11.835  -2.982
  328    H    GLU  40           H        GLU  40  -1.912   8.110  -0.120
  329    HA   GLU  40           HA       GLU  40  -4.078   7.333   1.593
  330    HB2  GLU  40           2HB      GLU  40  -5.511   7.802  -0.368
  331    HB3  GLU  40           1HB      GLU  40  -4.414   9.124   0.004
  332    HG2  GLU  40           2HG      GLU  40  -2.945   8.452  -1.815
  333    HG3  GLU  40           1HG      GLU  40  -3.988   7.077  -2.169
  334    H    PHE  41           H        PHE  41  -5.453   5.585   1.441
  335    HA   PHE  41           HA       PHE  41  -4.632   3.358  -0.324
  336    HB2  PHE  41           2HB      PHE  41  -5.801   3.092   2.461
  337    HB3  PHE  41           1HB      PHE  41  -5.232   1.783   1.431
  338    HD1  PHE  41           HD1      PHE  41  -2.759   1.678   0.866
  339    HD2  PHE  41           HD2      PHE  41  -4.331   4.220   3.904
  340    HE1  PHE  41           HE1      PHE  41  -0.514   1.882   1.856
  341    HE2  PHE  41           HE2      PHE  41  -2.089   4.424   4.897
  342    HZ   PHE  41           HZ       PHE  41  -0.179   3.256   3.873
  343    H    PHE  42           H        PHE  42  -6.272   2.235  -1.387
  344    HA   PHE  42           HA       PHE  42  -8.711   3.700  -1.718
  345    HB2  PHE  42           2HB      PHE  42  -9.274   2.110  -3.449
  346    HB3  PHE  42           1HB      PHE  42  -7.591   2.578  -3.614
  347    HD1  PHE  42           HD2      PHE  42  -5.801   0.967  -3.189
  348    HD2  PHE  42           HD1      PHE  42  -9.899  -0.161  -2.856
  349    HE1  PHE  42           HE2      PHE  42  -5.154  -1.406  -3.263
  350    HE2  PHE  42           HE1      PHE  42  -9.253  -2.533  -2.929
  351    HZ   PHE  42           HZ       PHE  42  -6.880  -3.156  -3.136
  352    H    ALA  43           H        ALA  43 -10.782   3.200  -1.153
  353    HA   ALA  43           HA       ALA  43 -11.130   1.007   0.794
  354    HB1  ALA  43           3HB      ALA  43 -11.551   3.251   1.689
  355    HB2  ALA  43           1HB      ALA  43 -13.016   2.269   1.685
  356    HB3  ALA  43           2HB      ALA  43 -12.785   3.511   0.454
  357    H    ALA  44           H        ALA  44 -11.640  -0.684  -0.577
  358    HA   ALA  44           HA       ALA  44 -14.138  -0.412  -2.135
  359    HB1  ALA  44           3HB      ALA  44 -12.195  -0.699  -3.598
  360    HB2  ALA  44           1HB      ALA  44 -13.269  -2.095  -3.683
  361    HB3  ALA  44           2HB      ALA  44 -11.774  -2.188  -2.754
  362    H    ASP  45           H        ASP  45 -14.953  -2.816  -2.626
  363    HA   ASP  45           HA       ASP  45 -14.824  -4.415  -0.160
  364    HB2  ASP  45           2HB      ASP  45 -16.891  -3.072  -0.103
  365    HB3  ASP  45           1HB      ASP  45 -17.355  -3.714  -1.676
  366    H    LEU  46           H        LEU  46 -14.445  -6.522  -0.536
  367    HA   LEU  46           HA       LEU  46 -14.046  -7.460  -3.187
  368    HB2  LEU  46           2HB      LEU  46 -13.878  -9.759  -1.844
  369    HB3  LEU  46           1HB      LEU  46 -12.590  -8.573  -1.877
  370    HG   LEU  46           HG       LEU  46 -13.460  -7.687   0.323
  371   HD11  LEU  46          1HD1      LEU  46 -15.728  -8.559   0.240
  372   HD12  LEU  46          2HD1      LEU  46 -14.883  -9.161   1.667
  373   HD13  LEU  46          3HD1      LEU  46 -15.114 -10.212   0.268
  374   HD21  LEU  46          3HD2      LEU  46 -12.553 -10.568   0.273
  375   HD22  LEU  46          1HD2      LEU  46 -12.442  -9.467   1.649
  376   HD23  LEU  46          2HD2      LEU  46 -11.507  -9.150   0.187
  377    H    SER  47           H        SER  47 -16.035  -7.126  -4.175
  378    HA   SER  47           HA       SER  47 -18.290  -8.825  -3.395
  379    HB2  SER  47           2HB      SER  47 -18.729  -6.451  -3.930
  380    HB3  SER  47           1HB      SER  47 -18.093  -6.702  -5.555
  381    HG   SER  47           HG       SER  47 -20.548  -7.319  -4.513
  382    H    LEU  48           H        LEU  48 -19.555  -9.539  -5.572
  383    HA   LEU  48           HA       LEU  48 -17.874 -11.569  -6.730
  384    HB2  LEU  48           2HB      LEU  48 -20.773 -10.846  -7.192
  385    HB3  LEU  48           1HB      LEU  48 -19.972 -12.191  -7.982
  386    HG   LEU  48           HG       LEU  48 -21.247 -13.065  -6.159
  387   HD11  LEU  48          1HD1      LEU  48 -19.099 -14.131  -6.511
  388   HD12  LEU  48          2HD1      LEU  48 -19.527 -14.149  -4.801
  389   HD13  LEU  48          3HD1      LEU  48 -18.329 -13.001  -5.398
  390   HD21  LEU  48          3HD2      LEU  48 -20.946 -12.366  -3.835
  391   HD22  LEU  48          1HD2      LEU  48 -21.499 -11.027  -4.840
  392   HD23  LEU  48          2HD2      LEU  48 -19.808 -11.118  -4.350
  393    H    TYR  49           H        TYR  49 -18.445  -8.374  -7.531
  394    HA   TYR  49           HA       TYR  49 -17.408  -8.836 -10.249
  395    HB2  TYR  49           2HB      TYR  49 -18.682  -6.740 -10.946
  396    HB3  TYR  49           1HB      TYR  49 -19.641  -8.186 -10.668
  397    HD1  TYR  49           HD2      TYR  49 -20.992  -8.379  -8.559
  398    HD2  TYR  49           HD1      TYR  49 -19.055  -4.749  -9.662
  399    HE1  TYR  49           HE2      TYR  49 -22.430  -7.142  -7.000
  400    HE2  TYR  49           HE1      TYR  49 -20.495  -3.505  -8.103
  401    HH   TYR  49           HH       TYR  49 -22.600  -3.712  -6.964
  402    HA   PRO  50           HA       PRO  50 -14.391  -6.140  -8.107
  403    HB2  PRO  50           2HB      PRO  50 -12.185  -7.144  -9.267
  404    HB3  PRO  50           1HB      PRO  50 -13.039  -8.020  -7.988
  405    HG2  PRO  50           2HG      PRO  50 -13.181  -8.403 -10.964
  406    HG3  PRO  50           1HG      PRO  50 -13.025  -9.628  -9.690
  407    HD2  PRO  50           2HD      PRO  50 -15.401  -8.993 -10.882
  408    HD3  PRO  50           1HD      PRO  50 -15.278  -9.596  -9.219
  409    H    HIS  51           H        HIS  51 -15.921  -5.033 -10.181
  410    HA   HIS  51           HA       HIS  51 -14.128  -4.141 -12.293
  411    HB2  HIS  51           2HB      HIS  51 -16.484  -4.716 -12.790
  412    HB3  HIS  51           1HB      HIS  51 -17.017  -3.396 -11.754
  413    HD1  HIS  51           HD1      HIS  51 -17.192  -1.119 -12.819
  414    HD2  HIS  51           HD2      HIS  51 -15.107  -3.827 -15.187
  415    HE1  HIS  51           HE1      HIS  51 -16.807   0.052 -15.005
  416    HE2  HIS  51           HE2      HIS  51 -15.554  -1.598 -16.427
  417    H    LEU  52           H        LEU  52 -14.915  -3.078  -9.170
  418    HA   LEU  52           HA       LEU  52 -14.797  -0.243  -9.620
  419    HB2  LEU  52           2HB      LEU  52 -14.440  -1.792  -7.047
  420    HB3  LEU  52           1HB      LEU  52 -14.710  -0.063  -7.172
  421    HG   LEU  52           HG       LEU  52 -16.677  -2.230  -7.946
  422   HD11  LEU  52          1HD1      LEU  52 -16.429  -2.030  -5.541
  423   HD12  LEU  52          2HD1      LEU  52 -17.990  -1.384  -6.052
  424   HD13  LEU  52          3HD1      LEU  52 -16.674  -0.283  -5.638
  425   HD21  LEU  52          3HD2      LEU  52 -18.271  -0.397  -8.291
  426   HD22  LEU  52          1HD2      LEU  52 -16.908  -0.288  -9.405
  427   HD23  LEU  52          2HD2      LEU  52 -16.987   0.776  -8.000
  428    H    TYR  53           H        TYR  53 -12.782  -0.304 -10.927
  429    HA   TYR  53           HA       TYR  53 -10.301  -1.155  -9.932
  430    HB2  TYR  53           2HB      TYR  53 -10.838   1.011 -11.979
  431    HB3  TYR  53           1HB      TYR  53  -9.310   0.166 -11.749
  432    HD1  TYR  53           HD1      TYR  53  -9.619  -2.525 -11.775
  433    HD2  TYR  53           HD2      TYR  53 -12.149   0.274 -13.754
  434    HE1  TYR  53           HE1      TYR  53 -10.349  -4.289 -13.322
  435    HE2  TYR  53           HE2      TYR  53 -12.884  -1.485 -15.309
  436    HH   TYR  53           HH       TYR  53 -12.015  -3.664 -16.181
  437    H    SER  54           H        SER  54  -9.093  -0.399  -8.332
  438    HA   SER  54           HA       SER  54  -8.881   2.467  -7.811
  439    HB2  SER  54           2HB      SER  54  -9.747   0.497  -5.670
  440    HB3  SER  54           1HB      SER  54  -9.345   2.191  -5.396
  441    HG   SER  54           HG       SER  54 -11.437   1.265  -7.085
  442    H    ARG  55           H        ARG  55  -7.069   2.998  -6.393
  443    HA   ARG  55           HA       ARG  55  -5.068   0.863  -6.072
  444    HB2  ARG  55           2HB      ARG  55  -3.361   2.558  -7.036
  445    HB3  ARG  55           1HB      ARG  55  -4.383   1.663  -8.154
  446    HG2  ARG  55           2HG      ARG  55  -5.870   3.579  -8.367
  447    HG3  ARG  55           1HG      ARG  55  -4.891   4.485  -7.212
  448    HD2  ARG  55           2HD      ARG  55  -3.072   4.629  -8.713
  449    HD3  ARG  55           1HD      ARG  55  -3.734   3.371  -9.760
  450    HE   ARG  55           HE       ARG  55  -5.145   4.922 -10.723
  451   HH11  ARG  55          1HH1      ARG  55  -3.458   6.371  -8.083
  452   HH12  ARG  55          2HH1      ARG  55  -4.022   7.962  -8.464
  453   HH21  ARG  55          1HH2      ARG  55  -5.845   6.978 -11.193
  454   HH22  ARG  55          2HH2      ARG  55  -5.349   8.296 -10.187
  455    H    ALA  56           H        ALA  56  -3.115   1.621  -4.865
  456    HA   ALA  56           HA       ALA  56  -3.651   3.803  -2.968
  457    HB1  ALA  56           3HB      ALA  56  -2.798   1.020  -2.143
  458    HB2  ALA  56           1HB      ALA  56  -4.404   1.712  -1.908
  459    HB3  ALA  56           2HB      ALA  56  -3.015   2.406  -1.075
  460    H    TYR  57           H        TYR  57  -1.583   4.199  -1.573
  461    HA   TYR  57           HA       TYR  57   0.875   3.535  -3.055
  462    HB2  TYR  57           2HB      TYR  57   0.128   6.357  -2.246
  463    HB3  TYR  57           1HB      TYR  57   1.659   5.869  -2.958
  464    HD1  TYR  57           HD2      TYR  57   1.718   5.083  -5.334
  465    HD2  TYR  57           HD1      TYR  57  -1.788   6.769  -3.596
  466    HE1  TYR  57           HE2      TYR  57   0.804   5.493  -7.580
  467    HE2  TYR  57           HE1      TYR  57  -2.706   7.182  -5.836
  468    HH   TYR  57           HH       TYR  57  -1.825   7.517  -8.143
  469    H    ILE  58           H        ILE  58   2.855   4.027  -1.876
  470    HA   ILE  58           HA       ILE  58   2.536   4.124   1.066
  471    HB   ILE  58           HB       ILE  58   4.711   2.668  -0.479
  472   HG12  ILE  58          2HG1      ILE  58   2.358   1.509   1.050
  473   HG13  ILE  58          1HG1      ILE  58   2.490   1.574  -0.705
  474   HG21  ILE  58          1HG2      ILE  58   5.492   3.457   1.684
  475   HG22  ILE  58          2HG2      ILE  58   5.297   1.704   1.720
  476   HG23  ILE  58          3HG2      ILE  58   4.089   2.740   2.481
  477   HD11  ILE  58          3HD1      ILE  58   4.447   0.111  -0.601
  478   HD12  ILE  58          1HD1      ILE  58   3.026  -0.633   0.129
  479   HD13  ILE  58          2HD1      ILE  58   4.292   0.038   1.154
  480    H    ASN  59           H        ASN  59   4.372   5.194   2.205
  481    HA   ASN  59           HA       ASN  59   6.027   6.902   0.481
  482    HB2  ASN  59           2HB      ASN  59   4.074   8.239   1.204
  483    HB3  ASN  59           1HB      ASN  59   4.500   7.931   2.885
  484   HD21  ASN  59          1HD2      ASN  59   4.786  10.105   3.318
  485   HD22  ASN  59          2HD2      ASN  59   6.127  11.007   2.720
  486    H    PHE  60           H        PHE  60   7.870   5.733   0.949
  487    HA   PHE  60           HA       PHE  60   8.804   5.265   3.616
  488    HB2  PHE  60           2HB      PHE  60  10.113   5.154   0.899
  489    HB3  PHE  60           1HB      PHE  60  11.041   4.912   2.375
  490    HD1  PHE  60           HD2      PHE  60   8.349   3.522   0.257
  491    HD2  PHE  60           HD1      PHE  60  10.884   2.918   3.627
  492    HE1  PHE  60           HE2      PHE  60   7.718   1.144   0.307
  493    HE2  PHE  60           HE1      PHE  60  10.261   0.551   3.684
  494    HZ   PHE  60           HZ       PHE  60   8.674  -0.348   2.020
  495    H    ARG  61           H        ARG  61  10.897   6.224   4.444
  496    HA   ARG  61           HA       ARG  61  11.450   8.922   3.413
  497    HB2  ARG  61           2HB      ARG  61  11.073   8.330   6.360
  498    HB3  ARG  61           1HB      ARG  61  11.538   9.877   5.667
  499    HG2  ARG  61           2HG      ARG  61   9.301   9.742   4.388
  500    HG3  ARG  61           1HG      ARG  61   8.883   8.485   5.555
  501    HD2  ARG  61           2HD      ARG  61   9.639  11.345   6.167
  502    HD3  ARG  61           1HD      ARG  61   8.034  10.630   6.298
  503    HE   ARG  61           HE       ARG  61  10.014   9.329   7.928
  504   HH11  ARG  61          1HH1      ARG  61   7.817  11.968   7.753
  505   HH12  ARG  61          2HH1      ARG  61   7.651  12.091   9.471
  506   HH21  ARG  61          1HH2      ARG  61   9.832   9.520  10.144
  507   HH22  ARG  61          2HH2      ARG  61   8.788  10.733  10.804
  508    H    ASN  62           H        ASN  62  12.803   6.090   3.704
  509    HA   ASN  62           HA       ASN  62  15.458   7.185   4.086
  510    HB2  ASN  62           2HB      ASN  62  14.638   6.541   6.396
  511    HB3  ASN  62           1HB      ASN  62  14.604   4.874   5.840
  512   HD21  ASN  62          1HD2      ASN  62  16.453   3.726   5.856
  513   HD22  ASN  62          2HD2      ASN  62  18.011   4.375   6.229
  514    HA   PRO  63           HA       PRO  63  16.171   4.321   0.711
  515    HB2  PRO  63           2HB      PRO  63  18.987   4.506   1.692
  516    HB3  PRO  63           1HB      PRO  63  18.343   4.748   0.063
  517    HG2  PRO  63           2HG      PRO  63  19.079   6.829   1.550
  518    HG3  PRO  63           1HG      PRO  63  17.637   6.912   0.520
  519    HD2  PRO  63           2HD      PRO  63  17.832   6.568   3.484
  520    HD3  PRO  63           1HD      PRO  63  16.648   7.484   2.529
  521    H    ASP  64           H        ASP  64  17.924   3.787   3.775
  522    HA   ASP  64           HA       ASP  64  18.329   1.003   3.404
  523    HB2  ASP  64           2HB      ASP  64  18.172   2.418   6.071
  524    HB3  ASP  64           1HB      ASP  64  19.104   0.979   5.662
  525    H    ASP  65           H        ASP  65  15.614   2.835   4.470
  526    HA   ASP  65           HA       ASP  65  14.223   0.638   5.741
  527    HB2  ASP  65           2HB      ASP  65  13.938   3.047   6.404
  528    HB3  ASP  65           1HB      ASP  65  13.176   3.345   4.848
  529    H    ILE  66           H        ILE  66  14.192   2.359   2.655
  530    HA   ILE  66           HA       ILE  66  12.079   1.091   1.359
  531    HB   ILE  66           HB       ILE  66  14.701   2.009   0.142
  532   HG12  ILE  66          2HG1      ILE  66  12.057   3.471   0.434
  533   HG13  ILE  66          1HG1      ILE  66  13.501   3.783   1.391
  534   HG21  ILE  66          1HG2      ILE  66  13.437   2.176  -1.963
  535   HG22  ILE  66          2HG2      ILE  66  12.028   1.475  -1.167
  536   HG23  ILE  66          3HG2      ILE  66  13.498   0.519  -1.362
  537   HD11  ILE  66          3HD1      ILE  66  14.686   4.475  -0.634
  538   HD12  ILE  66          1HD1      ILE  66  13.234   5.438  -0.356
  539   HD13  ILE  66          2HD1      ILE  66  13.230   4.172  -1.584
  540    H    LEU  67           H        LEU  67  15.555   0.191   1.162
  541    HA   LEU  67           HA       LEU  67  15.080  -2.186  -0.286
  542    HB2  LEU  67           2HB      LEU  67  17.419  -2.786   0.298
  543    HB3  LEU  67           1HB      LEU  67  17.240  -1.191  -0.399
  544    HG   LEU  67           HG       LEU  67  17.299  -0.343   2.057
  545   HD11  LEU  67          1HD1      LEU  67  17.096  -2.495   3.176
  546   HD12  LEU  67          2HD1      LEU  67  18.628  -1.725   3.581
  547   HD13  LEU  67          3HD1      LEU  67  18.588  -3.052   2.419
  548   HD21  LEU  67          3HD2      LEU  67  19.037   0.132   0.438
  549   HD22  LEU  67          1HD2      LEU  67  19.760  -1.457   0.703
  550   HD23  LEU  67          2HD2      LEU  67  19.759  -0.257   1.999
  551    H    LEU  68           H        LEU  68  15.052  -1.523   3.138
  552    HA   LEU  68           HA       LEU  68  15.186  -4.135   4.157
  553    HB2  LEU  68           2HB      LEU  68  15.367  -2.333   5.684
  554    HB3  LEU  68           1HB      LEU  68  13.868  -1.610   5.136
  555    HG   LEU  68           HG       LEU  68  12.591  -3.440   6.178
  556   HD11  LEU  68          1HD1      LEU  68  15.281  -4.399   7.167
  557   HD12  LEU  68          2HD1      LEU  68  14.228  -5.233   6.023
  558   HD13  LEU  68          3HD1      LEU  68  13.713  -5.016   7.694
  559   HD21  LEU  68          3HD2      LEU  68  14.524  -2.093   8.074
  560   HD22  LEU  68          1HD2      LEU  68  12.969  -2.804   8.506
  561   HD23  LEU  68          2HD2      LEU  68  13.029  -1.395   7.447
  562    H    PHE  69           H        PHE  69  12.251  -2.178   3.554
  563    HA   PHE  69           HA       PHE  69  10.556  -4.460   3.930
  564    HB2  PHE  69           2HB      PHE  69  10.088  -1.581   3.244
  565    HB3  PHE  69           1HB      PHE  69   8.770  -2.747   3.113
  566    HD1  PHE  69           HD2      PHE  69   8.128  -4.076   5.125
  567    HD2  PHE  69           HD1      PHE  69  10.758  -0.734   5.354
  568    HE1  PHE  69           HE2      PHE  69   7.739  -3.943   7.543
  569    HE2  PHE  69           HE1      PHE  69  10.375  -0.599   7.781
  570    HZ   PHE  69           HZ       PHE  69   8.863  -2.205   8.879
  571    H    ARG  70           H        ARG  70  11.814  -2.776   1.090
  572    HA   ARG  70           HA       ARG  70  10.181  -3.955  -0.863
  573    HB2  ARG  70           2HB      ARG  70  12.176  -2.163  -0.988
  574    HB3  ARG  70           1HB      ARG  70  13.089  -3.582  -1.468
  575    HG2  ARG  70           2HG      ARG  70  10.565  -2.656  -2.834
  576    HG3  ARG  70           1HG      ARG  70  12.189  -2.222  -3.355
  577    HD2  ARG  70           2HD      ARG  70  12.708  -4.526  -3.839
  578    HD3  ARG  70           1HD      ARG  70  11.179  -5.062  -3.141
  579    HE   ARG  70           HE       ARG  70  10.459  -3.329  -5.122
  580   HH11  ARG  70          1HH1      ARG  70  12.378  -6.197  -5.029
  581   HH12  ARG  70          2HH1      ARG  70  11.937  -6.660  -6.635
  582   HH21  ARG  70          1HH2      ARG  70   9.910  -3.941  -7.155
  583   HH22  ARG  70          2HH2      ARG  70  10.558  -5.399  -7.828
  584    H    ASP  71           H        ASP  71  12.932  -5.202   0.916
  585    HA   ASP  71           HA       ASP  71  13.404  -7.563  -0.559
  586    HB2  ASP  71           2HB      ASP  71  15.043  -6.759   1.012
  587    HB3  ASP  71           1HB      ASP  71  13.894  -6.848   2.343
  588    H    ARG  72           H        ARG  72  11.385  -7.021   2.347
  589    HA   ARG  72           HA       ARG  72  10.402  -9.757   2.258
  590    HB2  ARG  72           2HB      ARG  72   9.032  -9.004   4.265
  591    HB3  ARG  72           1HB      ARG  72  10.778  -8.982   4.451
  592    HG2  ARG  72           2HG      ARG  72  10.805  -6.572   4.089
  593    HG3  ARG  72           1HG      ARG  72   9.059  -6.578   3.851
  594    HD2  ARG  72           2HD      ARG  72  10.412  -7.495   6.392
  595    HD3  ARG  72           1HD      ARG  72   9.814  -5.856   6.135
  596    HE   ARG  72           HE       ARG  72   7.776  -7.769   5.641
  597   HH11  ARG  72          1HH1      ARG  72   9.493  -6.277   8.233
  598   HH12  ARG  72          2HH1      ARG  72   8.164  -6.405   9.325
  599   HH21  ARG  72          1HH2      ARG  72   6.073  -7.906   7.055
  600   HH22  ARG  72          2HH2      ARG  72   6.250  -7.311   8.671
  601    H    PHE  73           H        PHE  73   9.506  -6.917   0.717
  602    HA   PHE  73           HA       PHE  73   6.755  -7.929   0.298
  603    HB2  PHE  73           2HB      PHE  73   7.700  -5.094   0.671
  604    HB3  PHE  73           1HB      PHE  73   6.186  -5.482  -0.126
  605    HD1  PHE  73           HD1      PHE  73   4.369  -6.603   1.137
  606    HD2  PHE  73           HD2      PHE  73   7.910  -5.218   3.060
  607    HE1  PHE  73           HE1      PHE  73   3.240  -6.746   3.314
  608    HE2  PHE  73           HE2      PHE  73   6.779  -5.364   5.237
  609    HZ   PHE  73           HZ       PHE  73   4.444  -6.128   5.365
  610    H    ASP  74           H        ASP  74   9.059  -8.497  -1.269
  611    HA   ASP  74           HA       ASP  74   9.159  -6.877  -3.626
  612    HB2  ASP  74           2HB      ASP  74  10.714  -8.561  -4.466
  613    HB3  ASP  74           1HB      ASP  74  11.096  -8.161  -2.794
  614    H    GLY  75           H        GLY  75   6.484  -8.064  -2.987
  615    HA2  GLY  75           2HA      GLY  75   4.862  -8.455  -4.763
  616    HA3  GLY  75           1HA      GLY  75   6.039  -9.501  -5.537
  617    H    TYR  76           H        TYR  76   4.392  -9.219  -2.384
  618    HA   TYR  76           HA       TYR  76   4.377 -12.123  -2.090
  619    HB2  TYR  76           2HB      TYR  76   3.703 -11.737   0.178
  620    HB3  TYR  76           1HB      TYR  76   4.944 -10.546  -0.193
  621    HD1  TYR  76           HD1      TYR  76   4.143  -8.200  -0.909
  622    HD2  TYR  76           HD2      TYR  76   1.634 -11.033   1.043
  623    HE1  TYR  76           HE1      TYR  76   2.621  -6.392  -0.246
  624    HE2  TYR  76           HE2      TYR  76   0.109  -9.225   1.714
  625    HH   TYR  76           HH       TYR  76   0.294  -6.091   0.393
  626    H    ILE  77           H        ILE  77   2.316 -13.178  -1.297
  627    HA   ILE  77           HA       ILE  77  -0.059 -12.066  -2.665
  628    HB   ILE  77           HB       ILE  77   0.551 -14.944  -1.944
  629   HG12  ILE  77          2HG1      ILE  77   1.878 -14.114  -3.856
  630   HG13  ILE  77          1HG1      ILE  77   0.702 -15.320  -4.367
  631   HG21  ILE  77          1HG2      ILE  77  -1.830 -14.525  -1.769
  632   HG22  ILE  77          2HG2      ILE  77  -1.503 -15.488  -3.210
  633   HG23  ILE  77          3HG2      ILE  77  -1.845 -13.764  -3.361
  634   HD11  ILE  77          3HD1      ILE  77   0.835 -13.492  -5.952
  635   HD12  ILE  77          1HD1      ILE  77   0.433 -12.338  -4.681
  636   HD13  ILE  77          2HD1      ILE  77  -0.756 -13.538  -5.191
  637    H    PHE  78           H        PHE  78  -1.484 -11.162  -1.308
  638    HA   PHE  78           HA       PHE  78  -1.691 -12.092   1.467
  639    HB2  PHE  78           2HB      PHE  78  -1.464  -9.640   0.959
  640    HB3  PHE  78           1HB      PHE  78  -3.036  -9.701   0.171
  641    HD1  PHE  78           HD1      PHE  78  -1.297 -10.139   3.413
  642    HD2  PHE  78           HD2      PHE  78  -5.034  -9.578   1.438
  643    HE1  PHE  78           HE1      PHE  78  -2.380  -9.720   5.584
  644    HE2  PHE  78           HE2      PHE  78  -6.117  -9.158   3.605
  645    HZ   PHE  78           HZ       PHE  78  -4.790  -9.227   5.680
  646    H    LEU  79           H        LEU  79  -3.532 -13.026   2.315
  647    HA   LEU  79           HA       LEU  79  -5.799 -13.489   0.477
  648    HB2  LEU  79           2HB      LEU  79  -4.459 -15.518   2.274
  649    HB3  LEU  79           1HB      LEU  79  -5.947 -15.801   1.389
  650    HG   LEU  79           HG       LEU  79  -3.351 -15.101   0.006
  651   HD11  LEU  79          1HD1      LEU  79  -3.033 -17.155   1.296
  652   HD12  LEU  79          2HD1      LEU  79  -3.062 -17.478  -0.438
  653   HD13  LEU  79          3HD1      LEU  79  -4.475 -17.849   0.552
  654   HD21  LEU  79          3HD2      LEU  79  -4.459 -16.071  -1.944
  655   HD22  LEU  79          1HD2      LEU  79  -5.390 -14.726  -1.287
  656   HD23  LEU  79          2HD2      LEU  79  -5.903 -16.386  -0.980
  657    H    ASP  80           H        ASP  80  -7.471 -12.407   1.379
  658    HA   ASP  80           HA       ASP  80  -7.879 -12.175   4.213
  659    HB2  ASP  80           2HB      ASP  80  -9.649 -11.526   1.845
  660    HB3  ASP  80           1HB      ASP  80 -10.117 -11.218   3.514
  661    H    SER  81           H        SER  81 -10.472 -12.624   4.744
  662    HA   SER  81           HA       SER  81 -10.694 -15.398   5.161
  663    HB2  SER  81           2HB      SER  81 -12.877 -13.297   5.230
  664    HB3  SER  81           1HB      SER  81 -13.017 -14.928   5.887
  665    HG   SER  81           HG       SER  81 -11.557 -12.730   6.825
  666    H    LYS  82           H        LYS  82 -11.500 -13.529   2.397
  667    HA   LYS  82           HA       LYS  82 -13.277 -15.557   1.285
  668    HB2  LYS  82           2HB      LYS  82 -12.230 -12.960   0.127
  669    HB3  LYS  82           1HB      LYS  82 -13.361 -14.028  -0.692
  670    HG2  LYS  82           2HG      LYS  82 -13.865 -12.634   1.938
  671    HG3  LYS  82           1HG      LYS  82 -14.484 -12.123   0.365
  672    HD2  LYS  82           2HD      LYS  82 -15.723 -14.237   0.160
  673    HD3  LYS  82           1HD      LYS  82 -15.095 -14.759   1.725
  674    HE2  LYS  82           2HE      LYS  82 -16.240 -12.892   2.816
  675    HE3  LYS  82           1HE      LYS  82 -16.845 -12.338   1.253
  676    HZ1  LYS  82           3HZ      LYS  82 -17.482 -14.966   2.496
  677    HZ2  LYS  82           1HZ      LYS  82 -18.108 -14.371   1.039
  678    HZ3  LYS  82           2HZ      LYS  82 -18.498 -13.615   2.500
  679    H    GLY  83           H        GLY  83  -9.980 -15.159   1.544
  680    HA2  GLY  83           2HA      GLY  83  -8.202 -16.296   0.656
  681    HA3  GLY  83           1HA      GLY  83  -9.374 -17.440   0.039
  682    H    LEU  84           H        LEU  84  -9.206 -14.038  -0.896
  683    HA   LEU  84           HA       LEU  84  -8.764 -14.834  -3.674
  684    HB2  LEU  84           2HB      LEU  84  -9.303 -12.095  -2.502
  685    HB3  LEU  84           1HB      LEU  84  -9.285 -12.499  -4.210
  686    HG   LEU  84           HG       LEU  84 -11.276 -13.531  -2.177
  687   HD11  LEU  84          1HD1      LEU  84 -11.601 -11.167  -2.678
  688   HD12  LEU  84          2HD1      LEU  84 -12.897 -12.142  -3.370
  689   HD13  LEU  84          3HD1      LEU  84 -11.611 -11.521  -4.407
  690   HD21  LEU  84          3HD2      LEU  84 -11.150 -13.950  -5.168
  691   HD22  LEU  84          1HD2      LEU  84 -12.457 -14.473  -4.103
  692   HD23  LEU  84          2HD2      LEU  84 -10.846 -15.173  -3.934
  693    H    GLU  85           H        GLU  85  -6.885 -14.452  -4.800
  694    HA   GLU  85           HA       GLU  85  -4.502 -13.894  -3.353
  695    HB2  GLU  85           2HB      GLU  85  -4.949 -14.011  -6.346
  696    HB3  GLU  85           1HB      GLU  85  -3.378 -14.000  -5.555
  697    HG2  GLU  85           2HG      GLU  85  -3.909 -16.134  -4.474
  698    HG3  GLU  85           1HG      GLU  85  -5.478 -16.147  -5.281
  699    H    TYR  86           H        TYR  86  -4.190 -11.881  -2.538
  700    HA   TYR  86           HA       TYR  86  -4.444  -9.587  -4.370
  701    HB2  TYR  86           2HB      TYR  86  -4.188  -9.667  -1.352
  702    HB3  TYR  86           1HB      TYR  86  -4.220  -8.186  -2.308
  703    HD1  TYR  86           HD1      TYR  86  -6.290  -7.696  -3.696
  704    HD2  TYR  86           HD2      TYR  86  -6.206 -10.726  -0.709
  705    HE1  TYR  86           HE1      TYR  86  -8.743  -7.686  -3.630
  706    HE2  TYR  86           HE2      TYR  86  -8.663 -10.722  -0.633
  707    HH   TYR  86           HH       TYR  86 -10.567  -9.242  -2.988
  708    HA   PRO  87           HA       PRO  87   0.126 -10.004  -4.345
  709    HB2  PRO  87           2HB      PRO  87   0.530  -9.236  -6.893
  710    HB3  PRO  87           1HB      PRO  87   0.001 -10.876  -6.491
  711    HG2  PRO  87           2HG      PRO  87  -1.616  -8.547  -7.463
  712    HG3  PRO  87           1HG      PRO  87  -1.699 -10.249  -7.956
  713    HD2  PRO  87           2HD      PRO  87  -3.427  -9.090  -6.163
  714    HD3  PRO  87           1HD      PRO  87  -3.039 -10.821  -6.180
  715    H    ALA  88           H        ALA  88   1.732  -8.389  -4.299
  716    HA   ALA  88           HA       ALA  88   0.946  -5.622  -4.852
  717    HB1  ALA  88           3HB      ALA  88   0.384  -6.023  -2.490
  718    HB2  ALA  88           1HB      ALA  88   1.665  -4.828  -2.675
  719    HB3  ALA  88           2HB      ALA  88   2.061  -6.471  -2.176
  720    H    VAL  89           H        VAL  89   2.427  -5.231  -6.404
  721    HA   VAL  89           HA       VAL  89   5.235  -5.964  -5.980
  722    HB   VAL  89           HB       VAL  89   3.919  -4.738  -8.420
  723   HG11  VAL  89          1HG1      VAL  89   6.678  -5.932  -8.085
  724   HG12  VAL  89          2HG1      VAL  89   6.308  -4.222  -8.287
  725   HG13  VAL  89          3HG1      VAL  89   5.982  -5.354  -9.598
  726   HG21  VAL  89          3HG2      VAL  89   4.090  -6.983  -9.405
  727   HG22  VAL  89          1HG2      VAL  89   3.067  -6.988  -7.968
  728   HG23  VAL  89          2HG2      VAL  89   4.717  -7.608  -7.879
  729    H    VAL  90           H        VAL  90   6.420  -4.528  -4.865
  730    HA   VAL  90           HA       VAL  90   5.761  -1.670  -4.996
  731    HB   VAL  90           HB       VAL  90   5.958  -2.684  -2.769
  732   HG11  VAL  90          1HG1      VAL  90   7.588  -4.425  -3.257
  733   HG12  VAL  90          2HG1      VAL  90   8.118  -3.435  -1.896
  734   HG13  VAL  90          3HG1      VAL  90   8.843  -3.206  -3.487
  735   HG21  VAL  90          3HG2      VAL  90   8.156  -0.694  -3.356
  736   HG22  VAL  90          1HG2      VAL  90   7.478  -1.042  -1.764
  737   HG23  VAL  90          2HG2      VAL  90   6.466  -0.316  -3.013
  738    H    GLU  91           H        GLU  91   7.079  -0.154  -5.903
  739    HA   GLU  91           HA       GLU  91   9.876  -0.709  -6.439
  740    HB2  GLU  91           2HB      GLU  91   9.736  -0.293  -8.862
  741    HB3  GLU  91           1HB      GLU  91   8.856  -1.742  -8.391
  742    HG2  GLU  91           2HG      GLU  91   6.747  -0.547  -8.548
  743    HG3  GLU  91           1HG      GLU  91   7.599   0.948  -8.931
  744    H    PHE  92           H        PHE  92  11.050   1.153  -7.303
  745    HA   PHE  92           HA       PHE  92  10.342   3.559  -5.992
  746    HB2  PHE  92           2HB      PHE  92  12.668   2.877  -6.361
  747    HB3  PHE  92           1HB      PHE  92  12.455   3.038  -8.098
  748    HD1  PHE  92           HD2      PHE  92  12.528   4.934  -4.913
  749    HD2  PHE  92           HD1      PHE  92  12.741   5.133  -9.168
  750    HE1  PHE  92           HE2      PHE  92  13.231   7.286  -4.770
  751    HE2  PHE  92           HE1      PHE  92  13.447   7.485  -9.022
  752    HZ   PHE  92           HZ       PHE  92  13.694   8.567  -6.823
  753    H    ALA  93           H        ALA  93   9.755   5.585  -6.816
  754    HA   ALA  93           HA       ALA  93   8.705   5.644  -9.578
  755    HB1  ALA  93           3HB      ALA  93   7.440   6.910  -7.142
  756    HB2  ALA  93           1HB      ALA  93   6.869   5.454  -7.959
  757    HB3  ALA  93           2HB      ALA  93   6.835   7.007  -8.797
  758    HA   PRO  94           HA       PRO  94  11.253   9.226 -10.189
  759    HB2  PRO  94           2HB      PRO  94   9.698  10.627 -11.982
  760    HB3  PRO  94           1HB      PRO  94  10.706   9.241 -12.411
  761    HG2  PRO  94           2HG      PRO  94   7.762   9.338 -11.840
  762    HG3  PRO  94           1HG      PRO  94   8.627   8.468 -13.123
  763    HD2  PRO  94           2HD      PRO  94   7.762   7.209 -10.915
  764    HD3  PRO  94           1HD      PRO  94   9.299   6.767 -11.686
  765    H    PHE  95           H        PHE  95  11.558  10.964  -8.915
  766    HA   PHE  95           HA       PHE  95   9.414  12.077  -7.371
  767    HB2  PHE  95           2HB      PHE  95  11.133  13.553  -6.396
  768    HB3  PHE  95           1HB      PHE  95  11.627  11.865  -6.382
  769    HD1  PHE  95           HD2      PHE  95  13.441  11.084  -7.832
  770    HD2  PHE  95           HD1      PHE  95  12.297  15.189  -7.736
  771    HE1  PHE  95           HE2      PHE  95  15.546  11.695  -8.948
  772    HE2  PHE  95           HE1      PHE  95  14.402  15.801  -8.849
  773    HZ   PHE  95           HZ       PHE  95  16.031  14.057  -9.456
  774    H    GLN  96           H        GLN  96   9.213  14.562  -7.190
  775    HA   GLN  96           HA       GLN  96   8.429  15.393  -9.877
  776    HB2  GLN  96           2HB      GLN  96   6.772  15.381  -8.024
  777    HB3  GLN  96           1HB      GLN  96   7.703  16.632  -7.216
  778    HG2  GLN  96           2HG      GLN  96   5.771  17.554  -8.386
  779    HG3  GLN  96           1HG      GLN  96   7.285  18.170  -9.046
  780   HE21  GLN  96          1HE2      GLN  96   7.901  17.573 -11.123
  781   HE22  GLN  96          2HE2      GLN  96   6.807  16.816 -12.226
  782    H    LYS  97           H        LYS  97   9.350  17.531  -7.175
  783    HA   LYS  97           HA       LYS  97  11.722  18.544  -8.317
  784    HB2  LYS  97           2HB      LYS  97  10.116  19.329 -10.067
  785    HB3  LYS  97           1HB      LYS  97   9.285  20.274  -8.841
  786    HG2  LYS  97           2HG      LYS  97  10.764  21.675 -10.173
  787    HG3  LYS  97           1HG      LYS  97  11.297  21.620  -8.493
  788    HD2  LYS  97           2HD      LYS  97  13.198  21.450 -10.020
  789    HD3  LYS  97           1HD      LYS  97  13.009  19.970  -9.081
  790    HE2  LYS  97           2HE      LYS  97  13.516  19.425 -11.384
  791    HE3  LYS  97           1HE      LYS  97  11.870  18.922 -11.003
  792    HZ1  LYS  97           3HZ      LYS  97  12.044  20.006 -13.167
  793    HZ2  LYS  97           1HZ      LYS  97  12.608  21.420 -12.435
  794    HZ3  LYS  97           2HZ      LYS  97  11.037  20.875 -12.129
  Start of MODEL   12
    1    H1   MET   1           1H       MET   1  13.340  17.554  22.351
    2    H2   MET   1           2H       MET   1  13.053  17.510  20.685
    3    H3   MET   1           3H       MET   1  12.039  18.409  21.695
    4    HA   MET   1           HA       MET   1  13.773  19.937  22.226
    5    HB2  MET   1           2HB      MET   1  15.635  18.316  22.125
    6    HB3  MET   1           1HB      MET   1  15.491  18.258  20.374
    7    HG2  MET   1           2HG      MET   1  17.350  19.676  21.112
    8    HG3  MET   1           1HG      MET   1  16.138  20.586  20.212
    9    HE1  MET   1           3HE      MET   1  17.607  19.788  23.786
   10    HE2  MET   1           1HE      MET   1  15.911  19.338  23.955
   11    HE3  MET   1           2HE      MET   1  16.541  20.741  24.819
   12    H    GLY   2           H        GLY   2  12.286  21.279  21.217
   13    HA2  GLY   2           2HA      GLY   2  11.560  22.749  19.610
   14    HA3  GLY   2           1HA      GLY   2  13.048  22.408  18.745
   15    H    HIS   3           H        HIS   3  12.384  22.148  16.687
   16    HA   HIS   3           HA       HIS   3   9.972  20.615  16.094
   17    HB2  HIS   3           2HB      HIS   3  11.852  22.193  14.326
   18    HB3  HIS   3           1HB      HIS   3  10.455  21.307  13.722
   19    HD1  HIS   3           HD1      HIS   3   8.228  22.454  13.841
   20    HD2  HIS   3           HD2      HIS   3  11.136  24.412  16.073
   21    HE1  HIS   3           HE1      HIS   3   7.183  24.618  14.558
   22    HE2  HIS   3           HE2      HIS   3   8.871  25.658  16.099
   23    H    HIS   4           H        HIS   4  10.153  19.154  14.055
   24    HA   HIS   4           HA       HIS   4  12.032  17.053  14.743
   25    HB2  HIS   4           2HB      HIS   4   9.690  17.213  12.850
   26    HB3  HIS   4           1HB      HIS   4  10.751  15.811  12.904
   27    HD1  HIS   4           HD1      HIS   4   9.830  14.009  14.302
   28    HD2  HIS   4           HD2      HIS   4   8.702  17.757  15.707
   29    HE1  HIS   4           HE1      HIS   4   8.381  13.571  16.301
   30    HE2  HIS   4           HE2      HIS   4   7.551  15.837  17.002
   31    H    HIS   5           H        HIS   5  12.806  15.733  12.680
   32    HA   HIS   5           HA       HIS   5  14.465  17.631  11.141
   33    HB2  HIS   5           2HB      HIS   5  14.943  14.699  11.744
   34    HB3  HIS   5           1HB      HIS   5  16.042  15.761  10.874
   35    HD1  HIS   5           HD1      HIS   5  17.563  17.248  12.240
   36    HD2  HIS   5           HD2      HIS   5  14.797  15.190  14.560
   37    HE1  HIS   5           HE1      HIS   5  18.311  17.563  14.618
   38    HE2  HIS   5           HE2      HIS   5  16.733  16.157  15.976
   39    H    HIS   6           H        HIS   6  13.592  17.986   9.152
   40    HA   HIS   6           HA       HIS   6  12.004  16.067   7.749
   41    HB2  HIS   6           2HB      HIS   6  13.355  18.574   6.720
   42    HB3  HIS   6           1HB      HIS   6  12.157  17.637   5.837
   43    HD1  HIS   6           HD1      HIS   6  12.503  20.381   8.180
   44    HD2  HIS   6           HD2      HIS   6   9.522  17.693   7.123
   45    HE1  HIS   6           HE1      HIS   6  10.368  21.386   9.020
   46    HE2  HIS   6           HE2      HIS   6   8.569  19.854   8.172
   47    H    HIS   7           H        HIS   7  13.188  14.165   7.490
   48    HA   HIS   7           HA       HIS   7  15.430  14.326   5.578
   49    HB2  HIS   7           2HB      HIS   7  16.064  12.038   6.377
   50    HB3  HIS   7           1HB      HIS   7  16.202  13.292   7.599
   51    HD1  HIS   7           HD1      HIS   7  14.275  13.306   9.458
   52    HD2  HIS   7           HD2      HIS   7  14.483   9.915   7.070
   53    HE1  HIS   7           HE1      HIS   7  12.959  11.550  10.675
   54    HE2  HIS   7           HE2      HIS   7  13.152   9.487   9.247
   55    H    HIS   8           H        HIS   8  15.381  13.081   3.704
   56    HA   HIS   8           HA       HIS   8  12.600  12.444   2.931
   57    HB2  HIS   8           2HB      HIS   8  13.335  13.126   0.618
   58    HB3  HIS   8           1HB      HIS   8  13.344  14.416   1.817
   59    HD1  HIS   8           HD1      HIS   8  15.691  12.242  -0.185
   60    HD2  HIS   8           HD2      HIS   8  15.828  15.552   2.330
   61    HE1  HIS   8           HE1      HIS   8  18.026  13.131  -0.368
   62    HE2  HIS   8           HE2      HIS   8  18.131  15.030   1.272
   63    H    SER   9           H        SER   9  12.294  10.996   1.092
   64    HA   SER   9           HA       SER   9  14.396   9.117   0.407
   65    HB2  SER   9           2HB      SER   9  11.875   8.179   1.819
   66    HB3  SER   9           1HB      SER   9  13.032   7.116   1.019
   67    HG   SER   9           HG       SER   9  14.375   8.684   2.692
   68    H    HIS  10           H        HIS  10  13.251   7.299  -1.064
   69    HA   HIS  10           HA       HIS  10  11.775   8.762  -3.102
   70    HB2  HIS  10           2HB      HIS  10  12.844   5.926  -3.062
   71    HB3  HIS  10           1HB      HIS  10  12.012   6.652  -4.431
   72    HD1  HIS  10           HD1      HIS  10  14.977   5.615  -4.517
   73    HD2  HIS  10           HD2      HIS  10  13.817   9.575  -4.009
   74    HE1  HIS  10           HE1      HIS  10  16.926   6.993  -5.290
   75    HE2  HIS  10           HE2      HIS  10  16.156   9.378  -5.094
   76    H    MET  11           H        MET  11   9.644   8.586  -3.513
   77    HA   MET  11           HA       MET  11   7.929   7.280  -1.648
   78    HB2  MET  11           2HB      MET  11   7.244   8.519  -4.329
   79    HB3  MET  11           1HB      MET  11   6.094   8.095  -3.066
   80    HG2  MET  11           2HG      MET  11   6.488  10.458  -3.018
   81    HG3  MET  11           1HG      MET  11   7.178   9.731  -1.567
   82    HE1  MET  11           3HE      MET  11   8.639  11.864  -1.048
   83    HE2  MET  11           1HE      MET  11   7.926  12.669  -2.446
   84    HE3  MET  11           2HE      MET  11   9.676  12.656  -2.234
   85    H    VAL  12           H        VAL  12   6.615   5.476  -1.897
   86    HA   VAL  12           HA       VAL  12   7.200   3.729  -4.212
   87    HB   VAL  12           HB       VAL  12   6.812   2.977  -1.298
   88   HG11  VAL  12          1HG1      VAL  12   7.038   1.141  -3.689
   89   HG12  VAL  12          2HG1      VAL  12   5.616   1.359  -2.667
   90   HG13  VAL  12          3HG1      VAL  12   7.078   0.633  -2.002
   91   HG21  VAL  12          3HG2      VAL  12   9.139   2.579  -3.190
   92   HG22  VAL  12          1HG2      VAL  12   9.060   2.010  -1.522
   93   HG23  VAL  12          2HG2      VAL  12   9.058   3.741  -1.865
   94    H    VAL  13           H        VAL  13   5.467   2.620  -5.140
   95    HA   VAL  13           HA       VAL  13   2.797   3.099  -3.982
   96    HB   VAL  13           HB       VAL  13   1.896   3.426  -6.300
   97   HG11  VAL  13          1HG1      VAL  13   2.306   5.318  -4.786
   98   HG12  VAL  13          2HG1      VAL  13   2.555   5.760  -6.475
   99   HG13  VAL  13          3HG1      VAL  13   3.943   5.468  -5.427
  100   HG21  VAL  13          3HG2      VAL  13   4.818   3.698  -7.036
  101   HG22  VAL  13          1HG2      VAL  13   3.454   4.113  -8.076
  102   HG23  VAL  13          2HG2      VAL  13   3.715   2.437  -7.590
  103    H    ILE  14           H        ILE  14   1.627   1.303  -3.747
  104    HA   ILE  14           HA       ILE  14   2.649  -1.231  -4.554
  105    HB   ILE  14           HB       ILE  14   1.175  -0.714  -2.506
  106   HG12  ILE  14          2HG1      ILE  14   0.087  -2.993  -2.614
  107   HG13  ILE  14          1HG1      ILE  14   0.638  -3.108  -4.284
  108   HG21  ILE  14          1HG2      ILE  14  -1.026  -1.055  -4.544
  109   HG22  ILE  14          2HG2      ILE  14  -0.631   0.432  -3.683
  110   HG23  ILE  14          3HG2      ILE  14  -1.235  -0.966  -2.794
  111   HD11  ILE  14          3HD1      ILE  14   2.368  -2.862  -1.830
  112   HD12  ILE  14          1HD1      ILE  14   2.965  -2.875  -3.493
  113   HD13  ILE  14          2HD1      ILE  14   2.147  -4.291  -2.838
  114    H    ARG  15           H        ARG  15   1.862  -2.697  -6.129
  115    HA   ARG  15           HA       ARG  15   0.084  -1.519  -8.169
  116    HB2  ARG  15           2HB      ARG  15   2.315  -1.244  -8.994
  117    HB3  ARG  15           1HB      ARG  15   2.743  -2.898  -8.585
  118    HG2  ARG  15           2HG      ARG  15   1.607  -3.784 -10.396
  119    HG3  ARG  15           1HG      ARG  15   0.554  -2.381 -10.559
  120    HD2  ARG  15           2HD      ARG  15   2.206  -2.532 -12.372
  121    HD3  ARG  15           1HD      ARG  15   2.377  -1.055 -11.428
  122    HE   ARG  15           HE       ARG  15   4.123  -3.058 -10.453
  123   HH11  ARG  15          1HH1      ARG  15   3.681  -0.907 -13.087
  124   HH12  ARG  15          2HH1      ARG  15   5.369  -0.751 -13.409
  125   HH21  ARG  15          1HH2      ARG  15   6.323  -2.848 -10.855
  126   HH22  ARG  15          2HH2      ARG  15   6.846  -1.828 -12.150
  127    H    ARG  16           H        ARG  16  -1.136  -2.933  -9.438
  128    HA   ARG  16           HA       ARG  16  -2.409  -4.734  -9.938
  129    HB2  ARG  16           2HB      ARG  16  -0.009  -6.154  -8.825
  130    HB3  ARG  16           1HB      ARG  16  -1.440  -7.052  -9.308
  131    HG2  ARG  16           2HG      ARG  16  -1.248  -6.021 -11.568
  132    HG3  ARG  16           1HG      ARG  16   0.285  -5.311 -11.059
  133    HD2  ARG  16           2HD      ARG  16   0.562  -7.422 -12.326
  134    HD3  ARG  16           1HD      ARG  16   1.241  -7.492 -10.699
  135    HE   ARG  16           HE       ARG  16  -1.368  -8.474 -10.567
  136   HH11  ARG  16          1HH1      ARG  16   1.584  -9.315 -12.127
  137   HH12  ARG  16          2HH1      ARG  16   1.287 -11.016 -12.018
  138   HH21  ARG  16          1HH2      ARG  16  -1.731 -10.667 -10.405
  139   HH22  ARG  16          2HH2      ARG  16  -0.555 -11.771 -11.032
  140    H    LEU  17           H        LEU  17  -2.582  -3.393  -7.258
  141    HA   LEU  17           HA       LEU  17  -3.588  -5.424  -5.460
  142    HB2  LEU  17           2HB      LEU  17  -2.528  -3.036  -4.974
  143    HB3  LEU  17           1HB      LEU  17  -4.188  -2.501  -5.128
  144    HG   LEU  17           HG       LEU  17  -3.682  -2.804  -2.799
  145   HD11  LEU  17          1HD1      LEU  17  -5.385  -5.127  -3.701
  146   HD12  LEU  17          2HD1      LEU  17  -5.940  -3.467  -3.490
  147   HD13  LEU  17          3HD1      LEU  17  -5.375  -4.389  -2.097
  148   HD21  LEU  17          3HD2      LEU  17  -2.864  -5.625  -3.500
  149   HD22  LEU  17          1HD2      LEU  17  -2.976  -4.962  -1.870
  150   HD23  LEU  17          2HD2      LEU  17  -1.790  -4.315  -3.005
  151    HA   PRO  18           HA       PRO  18  -7.560  -5.107  -7.658
  152    HB2  PRO  18           2HB      PRO  18  -8.490  -7.551  -7.094
  153    HB3  PRO  18           1HB      PRO  18  -7.153  -7.320  -8.227
  154    HG2  PRO  18           2HG      PRO  18  -7.085  -8.210  -5.370
  155    HG3  PRO  18           1HG      PRO  18  -6.126  -8.783  -6.747
  156    HD2  PRO  18           2HD      PRO  18  -5.271  -6.934  -4.840
  157    HD3  PRO  18           1HD      PRO  18  -4.540  -7.177  -6.437
  158    HA   PRO  19           HA       PRO  19 -10.484  -3.899  -4.470
  159    HB2  PRO  19           2HB      PRO  19 -12.545  -5.241  -6.160
  160    HB3  PRO  19           1HB      PRO  19 -12.493  -3.582  -5.554
  161    HG2  PRO  19           2HG      PRO  19 -11.992  -4.098  -8.118
  162    HG3  PRO  19           1HG      PRO  19 -11.052  -2.873  -7.242
  163    HD2  PRO  19           2HD      PRO  19 -10.293  -5.683  -7.972
  164    HD3  PRO  19           1HD      PRO  19  -9.309  -4.203  -8.016
  165    H    GLY  20           H        GLY  20 -11.509  -4.817  -2.667
  166    HA2  GLY  20           2HA      GLY  20 -12.638  -7.259  -2.321
  167    HA3  GLY  20           1HA      GLY  20 -10.925  -7.621  -2.243
  168    H    LEU  21           H        LEU  21 -10.422  -4.952  -0.953
  169    HA   LEU  21           HA       LEU  21 -11.659  -5.367   1.664
  170    HB2  LEU  21           2HB      LEU  21  -9.609  -5.448   2.876
  171    HB3  LEU  21           1HB      LEU  21  -9.569  -6.702   1.653
  172    HG   LEU  21           HG       LEU  21  -8.123  -4.046   1.474
  173   HD11  LEU  21          1HD1      LEU  21  -7.218  -5.480   3.230
  174   HD12  LEU  21          2HD1      LEU  21  -6.094  -5.320   1.881
  175   HD13  LEU  21          3HD1      LEU  21  -7.039  -6.799   2.073
  176   HD21  LEU  21          3HD2      LEU  21  -6.937  -5.089  -0.425
  177   HD22  LEU  21          1HD2      LEU  21  -8.660  -4.882  -0.730
  178   HD23  LEU  21          2HD2      LEU  21  -8.025  -6.476  -0.319
  179    H    THR  22           H        THR  22 -11.012  -3.637   3.241
  180    HA   THR  22           HA       THR  22 -11.243  -1.049   1.905
  181    HB   THR  22           HB       THR  22 -11.584  -1.767   4.833
  182    HG1  THR  22           HG1      THR  22 -13.839  -1.417   4.288
  183   HG21  THR  22          3HG2      THR  22 -12.287   0.793   3.380
  184   HG22  THR  22          1HG2      THR  22 -10.949   0.595   4.511
  185   HG23  THR  22          2HG2      THR  22 -12.611   0.437   5.078
  186    H    LYS  23           H        LYS  23  -9.934   0.737   2.429
  187    HA   LYS  23           HA       LYS  23  -7.246   0.452   2.488
  188    HB2  LYS  23           2HB      LYS  23  -7.119   2.821   3.239
  189    HB3  LYS  23           1HB      LYS  23  -8.244   2.547   1.921
  190    HG2  LYS  23           2HG      LYS  23  -9.470   3.962   3.236
  191    HG3  LYS  23           1HG      LYS  23 -10.019   2.403   3.847
  192    HD2  LYS  23           2HD      LYS  23  -9.576   3.914   5.695
  193    HD3  LYS  23           1HD      LYS  23  -8.409   2.592   5.714
  194    HE2  LYS  23           2HE      LYS  23  -6.743   4.057   4.657
  195    HE3  LYS  23           1HE      LYS  23  -7.917   5.373   4.630
  196    HZ1  LYS  23           3HZ      LYS  23  -6.377   5.547   6.496
  197    HZ2  LYS  23           1HZ      LYS  23  -6.890   4.047   7.081
  198    HZ3  LYS  23           2HZ      LYS  23  -7.966   5.350   7.036
  199    H    GLU  24           H        GLU  24  -9.292   0.211   5.306
  200    HA   GLU  24           HA       GLU  24  -7.278   0.703   7.255
  201    HB2  GLU  24           2HB      GLU  24  -9.908  -0.777   7.471
  202    HB3  GLU  24           1HB      GLU  24  -8.905  -0.309   8.841
  203    HG2  GLU  24           2HG      GLU  24  -9.181   2.036   8.287
  204    HG3  GLU  24           1HG      GLU  24 -10.097   1.610   6.844
  205    H    GLN  25           H        GLN  25  -8.602  -2.370   5.942
  206    HA   GLN  25           HA       GLN  25  -6.585  -3.964   7.296
  207    HB2  GLN  25           2HB      GLN  25  -8.520  -4.721   5.085
  208    HB3  GLN  25           1HB      GLN  25  -7.512  -5.851   5.980
  209    HG2  GLN  25           2HG      GLN  25  -8.695  -5.220   8.051
  210    HG3  GLN  25           1HG      GLN  25  -9.730  -4.153   7.102
  211   HE21  GLN  25          1HE2      GLN  25 -11.271  -5.064   5.719
  212   HE22  GLN  25          2HE2      GLN  25 -11.750  -6.713   5.844
  213    H    LEU  26           H        LEU  26  -6.847  -2.211   4.400
  214    HA   LEU  26           HA       LEU  26  -4.881  -3.704   2.911
  215    HB2  LEU  26           2HB      LEU  26  -6.599  -2.778   1.628
  216    HB3  LEU  26           1HB      LEU  26  -6.507  -1.228   2.431
  217    HG   LEU  26           HG       LEU  26  -4.328  -0.811   1.293
  218   HD11  LEU  26          1HD1      LEU  26  -4.955  -3.406  -0.133
  219   HD12  LEU  26          2HD1      LEU  26  -3.591  -3.095   0.942
  220   HD13  LEU  26          3HD1      LEU  26  -3.695  -2.262  -0.608
  221   HD21  LEU  26          3HD2      LEU  26  -6.646  -1.441  -0.540
  222   HD22  LEU  26          1HD2      LEU  26  -5.269  -0.413  -0.940
  223   HD23  LEU  26          2HD2      LEU  26  -6.385   0.067   0.339
  224    H    GLU  27           H        GLU  27  -4.931  -0.693   4.783
  225    HA   GLU  27           HA       GLU  27  -2.372   0.199   3.865
  226    HB2  GLU  27           2HB      GLU  27  -2.560   1.972   5.474
  227    HB3  GLU  27           1HB      GLU  27  -4.126   1.746   4.710
  228    HG2  GLU  27           2HG      GLU  27  -4.877   0.470   6.700
  229    HG3  GLU  27           1HG      GLU  27  -3.320   0.799   7.460
  230    H    GLU  28           H        GLU  28  -3.472  -1.618   6.695
  231    HA   GLU  28           HA       GLU  28  -1.325  -1.363   8.399
  232    HB2  GLU  28           2HB      GLU  28  -1.954  -3.546   9.342
  233    HB3  GLU  28           1HB      GLU  28  -3.357  -2.535   9.040
  234    HG2  GLU  28           2HG      GLU  28  -3.921  -3.803   7.078
  235    HG3  GLU  28           1HG      GLU  28  -2.431  -4.736   7.197
  236    H    GLN  29           H        GLN  29  -1.600  -3.572   5.659
  237    HA   GLN  29           HA       GLN  29   0.996  -4.768   6.173
  238    HB2  GLN  29           2HB      GLN  29   0.466  -6.074   4.071
  239    HB3  GLN  29           1HB      GLN  29  -0.671  -6.275   5.398
  240    HG2  GLN  29           2HG      GLN  29  -2.112  -4.530   4.267
  241    HG3  GLN  29           1HG      GLN  29  -1.036  -4.670   2.879
  242   HE21  GLN  29          1HE2      GLN  29  -3.903  -5.313   3.240
  243   HE22  GLN  29          2HE2      GLN  29  -4.065  -6.954   2.741
  244    H    LEU  30           H        LEU  30  -0.088  -2.015   4.600
  245    HA   LEU  30           HA       LEU  30   2.219  -1.916   2.776
  246    HB2  LEU  30           2HB      LEU  30  -0.221  -0.136   2.940
  247    HB3  LEU  30           1HB      LEU  30   1.085   0.050   1.784
  248    HG   LEU  30           HG       LEU  30  -0.848  -2.272   1.957
  249   HD11  LEU  30          1HD1      LEU  30  -0.490  -0.124  -0.134
  250   HD12  LEU  30          2HD1      LEU  30  -1.826  -0.258   1.008
  251   HD13  LEU  30          3HD1      LEU  30  -1.603  -1.489  -0.234
  252   HD21  LEU  30          3HD2      LEU  30   0.256  -3.112  -0.071
  253   HD22  LEU  30          1HD2      LEU  30   1.355  -3.078   1.306
  254   HD23  LEU  30          2HD2      LEU  30   1.465  -1.834   0.059
  255    H    ARG  31           H        ARG  31   1.243  -0.792   5.855
  256    HA   ARG  31           HA       ARG  31   3.438   1.179   5.799
  257    HB2  ARG  31           2HB      ARG  31   2.163   2.631   7.349
  258    HB3  ARG  31           1HB      ARG  31   1.400   2.453   5.780
  259    HG2  ARG  31           2HG      ARG  31  -0.433   2.241   7.114
  260    HG3  ARG  31           1HG      ARG  31   0.051   0.552   7.029
  261    HD2  ARG  31           2HD      ARG  31   1.255   0.835   9.185
  262    HD3  ARG  31           1HD      ARG  31   0.640   2.485   9.276
  263    HE   ARG  31           HE       ARG  31  -0.837   0.027   9.716
  264   HH11  ARG  31          1HH1      ARG  31  -0.984   3.436   9.241
  265   HH12  ARG  31          2HH1      ARG  31  -2.572   3.571   9.898
  266   HH21  ARG  31          1HH2      ARG  31  -2.881   0.228  10.588
  267   HH22  ARG  31          2HH2      ARG  31  -3.622   1.793  10.668
  268    HA   PRO  32           HA       PRO  32   3.660  -1.574   9.735
  269    HB2  PRO  32           2HB      PRO  32   5.085  -3.734   9.030
  270    HB3  PRO  32           1HB      PRO  32   3.333  -3.676   8.790
  271    HG2  PRO  32           2HG      PRO  32   5.529  -3.181   6.800
  272    HG3  PRO  32           1HG      PRO  32   4.062  -4.165   6.620
  273    HD2  PRO  32           2HD      PRO  32   4.271  -1.613   5.673
  274    HD3  PRO  32           1HD      PRO  32   2.734  -2.331   6.194
  275    H    LEU  33           H        LEU  33   5.458   0.235   7.841
  276    HA   LEU  33           HA       LEU  33   8.158  -0.330   8.368
  277    HB2  LEU  33           2HB      LEU  33   6.748   2.258   7.710
  278    HB3  LEU  33           1HB      LEU  33   8.489   2.104   7.790
  279    HG   LEU  33           HG       LEU  33   8.464   0.546   5.892
  280   HD11  LEU  33          1HD1      LEU  33   6.430   0.162   4.596
  281   HD12  LEU  33          2HD1      LEU  33   5.485   1.015   5.818
  282   HD13  LEU  33          3HD1      LEU  33   6.292  -0.499   6.224
  283   HD21  LEU  33          3HD2      LEU  33   6.954   3.110   5.392
  284   HD22  LEU  33          1HD2      LEU  33   7.773   2.151   4.159
  285   HD23  LEU  33          2HD2      LEU  33   8.707   2.916   5.444
  286    HA   PRO  34           HA       PRO  34   8.763   0.823  12.581
  287    HB2  PRO  34           2HB      PRO  34  11.283   1.892  12.527
  288    HB3  PRO  34           1HB      PRO  34  10.948   0.161  12.406
  289    HG2  PRO  34           2HG      PRO  34  11.513   2.142  10.225
  290    HG3  PRO  34           1HG      PRO  34  12.144   0.496  10.431
  291    HD2  PRO  34           2HD      PRO  34  10.133   1.045   8.721
  292    HD3  PRO  34           1HD      PRO  34  10.200  -0.484   9.625
  293    H    ALA  35           H        ALA  35  10.015   3.477  10.497
  294    HA   ALA  35           HA       ALA  35   8.490   5.426  12.059
  295    HB1  ALA  35           3HB      ALA  35  10.433   6.826  12.525
  296    HB2  ALA  35           1HB      ALA  35  11.492   5.631  11.772
  297    HB3  ALA  35           2HB      ALA  35  10.626   5.232  13.256
  298    H    HIS  36           H        HIS  36   7.420   6.553  10.544
  299    HA   HIS  36           HA       HIS  36   8.678   7.878   8.360
  300    HB2  HIS  36           2HB      HIS  36   7.860   6.573   6.496
  301    HB3  HIS  36           1HB      HIS  36   8.755   5.487   7.561
  302    HD1  HIS  36           HD1      HIS  36   5.803   5.501   5.661
  303    HD2  HIS  36           HD2      HIS  36   6.694   4.289   9.540
  304    HE1  HIS  36           HE1      HIS  36   3.961   3.921   6.316
  305    HE2  HIS  36           HE2      HIS  36   4.435   3.338   8.722
  306    H    ASP  37           H        ASP  37   6.830   8.332   6.601
  307    HA   ASP  37           HA       ASP  37   4.322   9.064   7.982
  308    HB2  ASP  37           2HB      ASP  37   5.594  10.990   7.183
  309    HB3  ASP  37           1HB      ASP  37   5.737  10.273   5.583
  310    H    TYR  38           H        TYR  38   2.310   8.636   6.781
  311    HA   TYR  38           HA       TYR  38   2.671   6.779   4.512
  312    HB2  TYR  38           2HB      TYR  38   0.471   5.717   5.252
  313    HB3  TYR  38           1HB      TYR  38   1.898   5.376   6.218
  314    HD1  TYR  38           HD1      TYR  38  -1.278   7.278   6.132
  315    HD2  TYR  38           HD2      TYR  38   2.028   6.022   8.513
  316    HE1  TYR  38           HE1      TYR  38  -2.475   7.975   8.160
  317    HE2  TYR  38           HE2      TYR  38   0.835   6.724  10.545
  318    HH   TYR  38           HH       TYR  38  -0.933   8.071  11.277
  319    H    PHE  39           H        PHE  39   1.060   6.745   2.878
  320    HA   PHE  39           HA       PHE  39   0.092   9.477   2.387
  321    HB2  PHE  39           2HB      PHE  39   1.785   7.914   0.926
  322    HB3  PHE  39           1HB      PHE  39   0.257   7.532   0.150
  323    HD1  PHE  39           HD1      PHE  39  -1.182  10.049   0.081
  324    HD2  PHE  39           HD2      PHE  39   2.984   9.313  -0.448
  325    HE1  PHE  39           HE1      PHE  39  -0.995  12.082  -1.284
  326    HE2  PHE  39           HE2      PHE  39   3.170  11.352  -1.809
  327    HZ   PHE  39           HZ       PHE  39   1.180  12.740  -2.229
  328    H    GLU  40           H        GLU  40  -1.428   8.298   0.006
  329    HA   GLU  40           HA       GLU  40  -3.949   7.994   1.433
  330    HB2  GLU  40           2HB      GLU  40  -4.961   8.396  -0.803
  331    HB3  GLU  40           1HB      GLU  40  -3.864   9.678  -0.301
  332    HG2  GLU  40           2HG      GLU  40  -2.098   8.679  -1.713
  333    HG3  GLU  40           1HG      GLU  40  -3.256   7.469  -2.261
  334    H    PHE  41           H        PHE  41  -5.406   6.308   1.110
  335    HA   PHE  41           HA       PHE  41  -4.468   3.945  -0.395
  336    HB2  PHE  41           2HB      PHE  41  -5.738   3.860   2.362
  337    HB3  PHE  41           1HB      PHE  41  -5.230   2.471   1.410
  338    HD1  PHE  41           HD1      PHE  41  -2.845   1.961   1.129
  339    HD2  PHE  41           HD2      PHE  41  -4.143   5.191   3.588
  340    HE1  PHE  41           HE1      PHE  41  -0.621   2.058   2.171
  341    HE2  PHE  41           HE2      PHE  41  -1.917   5.292   4.631
  342    HZ   PHE  41           HZ       PHE  41  -0.152   3.726   3.925
  343    H    PHE  42           H        PHE  42  -6.195   2.538  -1.161
  344    HA   PHE  42           HA       PHE  42  -8.756   3.977  -1.425
  345    HB2  PHE  42           2HB      PHE  42  -9.075   2.961  -3.536
  346    HB3  PHE  42           1HB      PHE  42  -7.380   3.428  -3.501
  347    HD1  PHE  42           HD2      PHE  42  -5.628   1.627  -3.069
  348    HD2  PHE  42           HD1      PHE  42  -9.722   0.723  -3.877
  349    HE1  PHE  42           HE2      PHE  42  -5.005  -0.674  -3.662
  350    HE2  PHE  42           HE1      PHE  42  -9.093  -1.579  -4.468
  351    HZ   PHE  42           HZ       PHE  42  -6.736  -2.280  -4.360
  352    H    ALA  43           H        ALA  43 -10.694   2.447  -1.855
  353    HA   ALA  43           HA       ALA  43 -10.579  -0.061  -0.355
  354    HB1  ALA  43           3HB      ALA  43 -11.052   1.659   1.343
  355    HB2  ALA  43           1HB      ALA  43 -12.398   0.538   1.141
  356    HB3  ALA  43           2HB      ALA  43 -12.479   2.152   0.433
  357    H    ALA  44           H        ALA  44 -11.993  -1.582  -1.120
  358    HA   ALA  44           HA       ALA  44 -14.403  -0.889  -2.530
  359    HB1  ALA  44           3HB      ALA  44 -12.762  -0.449  -4.294
  360    HB2  ALA  44           1HB      ALA  44 -13.794  -1.821  -4.705
  361    HB3  ALA  44           2HB      ALA  44 -12.146  -2.095  -4.136
  362    H    ASP  45           H        ASP  45 -15.817  -2.607  -2.753
  363    HA   ASP  45           HA       ASP  45 -15.488  -4.814  -1.022
  364    HB2  ASP  45           2HB      ASP  45 -17.530  -4.231  -3.171
  365    HB3  ASP  45           1HB      ASP  45 -17.623  -5.639  -2.118
  366    H    LEU  46           H        LEU  46 -16.054  -7.117  -1.816
  367    HA   LEU  46           HA       LEU  46 -14.395  -7.792  -4.163
  368    HB2  LEU  46           2HB      LEU  46 -13.782  -9.874  -3.105
  369    HB3  LEU  46           1HB      LEU  46 -13.361  -8.530  -2.063
  370    HG   LEU  46           HG       LEU  46 -15.830 -10.241  -1.661
  371   HD11  LEU  46          1HD1      LEU  46 -13.135 -10.450  -0.308
  372   HD12  LEU  46          2HD1      LEU  46 -13.823 -11.617  -1.438
  373   HD13  LEU  46          3HD1      LEU  46 -14.586 -11.353   0.129
  374   HD21  LEU  46          3HD2      LEU  46 -15.803  -9.270   0.601
  375   HD22  LEU  46          1HD2      LEU  46 -15.987  -8.031  -0.640
  376   HD23  LEU  46          2HD2      LEU  46 -14.427  -8.263   0.149
  377    H    SER  47           H        SER  47 -14.961 -10.307  -4.688
  378    HA   SER  47           HA       SER  47 -16.422 -11.832  -5.537
  379    HB2  SER  47           2HB      SER  47 -18.660 -10.331  -4.151
  380    HB3  SER  47           1HB      SER  47 -18.713 -11.980  -4.768
  381    HG   SER  47           HG       SER  47 -18.132 -11.305  -2.361
  382    H    LEU  48           H        LEU  48 -17.823  -8.546  -5.655
  383    HA   LEU  48           HA       LEU  48 -19.162  -8.898  -8.135
  384    HB2  LEU  48           2HB      LEU  48 -19.478  -7.115  -6.262
  385    HB3  LEU  48           1HB      LEU  48 -18.196  -6.244  -7.074
  386    HG   LEU  48           HG       LEU  48 -20.783  -7.042  -8.436
  387   HD11  LEU  48          1HD1      LEU  48 -20.072  -4.394  -7.159
  388   HD12  LEU  48          2HD1      LEU  48 -21.256  -5.551  -6.548
  389   HD13  LEU  48          3HD1      LEU  48 -21.529  -4.744  -8.092
  390   HD21  LEU  48          3HD2      LEU  48 -18.948  -6.582  -9.982
  391   HD22  LEU  48          1HD2      LEU  48 -18.646  -5.035  -9.189
  392   HD23  LEU  48          2HD2      LEU  48 -20.158  -5.303 -10.058
  393    H    TYR  49           H        TYR  49 -18.469  -8.541 -10.230
  394    HA   TYR  49           HA       TYR  49 -15.826  -8.922 -10.908
  395    HB2  TYR  49           2HB      TYR  49 -16.464  -8.174 -13.208
  396    HB3  TYR  49           1HB      TYR  49 -17.547  -9.374 -12.515
  397    HD1  TYR  49           HD1      TYR  49 -17.211  -5.839 -13.522
  398    HD2  TYR  49           HD2      TYR  49 -19.850  -8.832 -12.022
  399    HE1  TYR  49           HE1      TYR  49 -19.131  -4.382 -14.006
  400    HE2  TYR  49           HE2      TYR  49 -21.772  -7.381 -12.505
  401    HH   TYR  49           HH       TYR  49 -21.634  -4.723 -14.482
  402    HA   PRO  50           HA       PRO  50 -13.683  -5.182 -10.209
  403    HB2  PRO  50           2HB      PRO  50 -11.713  -5.315 -12.099
  404    HB3  PRO  50           1HB      PRO  50 -11.740  -6.313 -10.641
  405    HG2  PRO  50           2HG      PRO  50 -12.613  -7.009 -13.425
  406    HG3  PRO  50           1HG      PRO  50 -11.658  -7.971 -12.280
  407    HD2  PRO  50           2HD      PRO  50 -14.289  -8.411 -12.660
  408    HD3  PRO  50           1HD      PRO  50 -13.527  -8.620 -11.069
  409    H    HIS  51           H        HIS  51 -15.616  -3.947 -10.978
  410    HA   HIS  51           HA       HIS  51 -15.442  -2.689 -13.579
  411    HB2  HIS  51           2HB      HIS  51 -17.357  -1.346 -12.818
  412    HB3  HIS  51           1HB      HIS  51 -17.630  -3.060 -12.518
  413    HD1  HIS  51           HD1      HIS  51 -17.315   0.210 -10.802
  414    HD2  HIS  51           HD2      HIS  51 -17.548  -3.807  -9.758
  415    HE1  HIS  51           HE1      HIS  51 -17.770   0.181  -8.339
  416    HE2  HIS  51           HE2      HIS  51 -17.823  -2.250  -7.710
  417    H    LEU  52           H        LEU  52 -13.493  -2.399 -11.071
  418    HA   LEU  52           HA       LEU  52 -12.752   0.354 -11.641
  419    HB2  LEU  52           2HB      LEU  52 -14.304   0.654  -9.808
  420    HB3  LEU  52           1HB      LEU  52 -13.526  -0.617  -8.883
  421    HG   LEU  52           HG       LEU  52 -11.458   0.828  -8.794
  422   HD11  LEU  52          1HD1      LEU  52 -13.328   2.924  -9.896
  423   HD12  LEU  52          2HD1      LEU  52 -11.904   2.261 -10.699
  424   HD13  LEU  52          3HD1      LEU  52 -11.720   3.225  -9.235
  425   HD21  LEU  52          3HD2      LEU  52 -12.982   0.656  -6.901
  426   HD22  LEU  52          1HD2      LEU  52 -13.972   1.959  -7.561
  427   HD23  LEU  52          2HD2      LEU  52 -12.323   2.286  -7.031
  428    H    TYR  53           H        TYR  53 -10.580   0.666 -11.496
  429    HA   TYR  53           HA       TYR  53  -8.950  -1.328 -10.042
  430    HB2  TYR  53           2HB      TYR  53  -8.261  -0.013 -12.687
  431    HB3  TYR  53           1HB      TYR  53  -7.189  -1.063 -11.768
  432    HD1  TYR  53           HD2      TYR  53 -10.154  -0.924 -13.926
  433    HD2  TYR  53           HD1      TYR  53  -7.554  -3.475 -11.718
  434    HE1  TYR  53           HE2      TYR  53 -11.063  -2.874 -15.121
  435    HE2  TYR  53           HE1      TYR  53  -8.452  -5.429 -12.909
  436    HH   TYR  53           HH       TYR  53 -10.412  -6.108 -14.142
  437    H    SER  54           H        SER  54  -7.610  -0.453  -8.558
  438    HA   SER  54           HA       SER  54  -6.588   2.260  -8.871
  439    HB2  SER  54           2HB      SER  54  -8.312   1.476  -6.501
  440    HB3  SER  54           1HB      SER  54  -7.385   2.972  -6.623
  441    HG   SER  54           HG       SER  54  -8.847   2.747  -8.824
  442    H    ARG  55           H        ARG  55  -5.116   2.830  -6.951
  443    HA   ARG  55           HA       ARG  55  -3.886   0.488  -5.715
  444    HB2  ARG  55           2HB      ARG  55  -1.630   1.110  -6.547
  445    HB3  ARG  55           1HB      ARG  55  -2.723   0.589  -7.821
  446    HG2  ARG  55           2HG      ARG  55  -3.137   2.989  -8.365
  447    HG3  ARG  55           1HG      ARG  55  -1.897   3.419  -7.183
  448    HD2  ARG  55           2HD      ARG  55  -1.538   1.800  -9.709
  449    HD3  ARG  55           1HD      ARG  55  -0.893   3.407  -9.369
  450    HE   ARG  55           HE       ARG  55   0.035   1.592  -7.432
  451   HH11  ARG  55          1HH1      ARG  55   0.486   2.325 -10.779
  452   HH12  ARG  55          2HH1      ARG  55   2.100   1.695 -10.790
  453   HH21  ARG  55          1HH2      ARG  55   2.075   0.766  -7.499
  454   HH22  ARG  55          2HH2      ARG  55   2.973   0.825  -8.976
  455    H    ALA  56           H        ALA  56  -2.477   0.970  -3.962
  456    HA   ALA  56           HA       ALA  56  -3.106   3.533  -2.685
  457    HB1  ALA  56           3HB      ALA  56  -3.669   1.475  -1.486
  458    HB2  ALA  56           1HB      ALA  56  -2.488   2.441  -0.603
  459    HB3  ALA  56           2HB      ALA  56  -1.968   1.008  -1.491
  460    H    TYR  57           H        TYR  57  -1.466   4.685  -1.464
  461    HA   TYR  57           HA       TYR  57   1.176   4.543  -2.781
  462    HB2  TYR  57           2HB      TYR  57  -0.292   6.917  -1.602
  463    HB3  TYR  57           1HB      TYR  57   1.349   6.975  -2.237
  464    HD1  TYR  57           HD1      TYR  57  -2.082   5.912  -3.308
  465    HD2  TYR  57           HD2      TYR  57   1.630   7.669  -4.428
  466    HE1  TYR  57           HE1      TYR  57  -2.977   6.358  -5.549
  467    HE2  TYR  57           HE2      TYR  57   0.744   8.112  -6.677
  468    HH   TYR  57           HH       TYR  57  -2.623   7.726  -7.423
  469    H    ILE  58           H        ILE  58   2.996   4.410  -1.602
  470    HA   ILE  58           HA       ILE  58   2.785   4.413   1.350
  471    HB   ILE  58           HB       ILE  58   4.703   2.774  -0.333
  472   HG12  ILE  58          2HG1      ILE  58   2.233   1.847   1.168
  473   HG13  ILE  58          1HG1      ILE  58   2.346   2.013  -0.582
  474   HG21  ILE  58          1HG2      ILE  58   5.592   3.337   1.865
  475   HG22  ILE  58          2HG2      ILE  58   5.209   1.619   1.778
  476   HG23  ILE  58          3HG2      ILE  58   4.130   2.721   2.635
  477   HD11  ILE  58          3HD1      ILE  58   2.595  -0.296   0.084
  478   HD12  ILE  58          1HD1      ILE  58   3.951   0.126   1.130
  479   HD13  ILE  58          2HD1      ILE  58   4.096   0.303  -0.619
  480    H    ASN  59           H        ASN  59   4.049   5.879   2.380
  481    HA   ASN  59           HA       ASN  59   6.253   7.113   0.866
  482    HB2  ASN  59           2HB      ASN  59   4.537   8.697   1.556
  483    HB3  ASN  59           1HB      ASN  59   4.700   8.186   3.233
  484   HD21  ASN  59          1HD2      ASN  59   5.169  10.343   3.801
  485   HD22  ASN  59          2HD2      ASN  59   6.725  11.032   3.506
  486    H    PHE  60           H        PHE  60   8.233   6.519   1.387
  487    HA   PHE  60           HA       PHE  60   8.811   5.357   4.007
  488    HB2  PHE  60           2HB      PHE  60  10.333   5.499   1.410
  489    HB3  PHE  60           1HB      PHE  60  11.145   5.059   2.911
  490    HD1  PHE  60           HD2      PHE  60   8.196   4.109   0.817
  491    HD2  PHE  60           HD1      PHE  60  11.181   2.850   3.581
  492    HE1  PHE  60           HE2      PHE  60   7.475   1.775   0.530
  493    HE2  PHE  60           HE1      PHE  60  10.461   0.518   3.303
  494    HZ   PHE  60           HZ       PHE  60   8.605  -0.027   1.772
  495    H    ARG  61           H        ARG  61  10.781   6.053   5.173
  496    HA   ARG  61           HA       ARG  61  11.503   8.867   4.709
  497    HB2  ARG  61           2HB      ARG  61   9.667   8.338   6.581
  498    HB3  ARG  61           1HB      ARG  61  11.096   7.984   7.539
  499    HG2  ARG  61           2HG      ARG  61  10.846  10.191   8.044
  500    HG3  ARG  61           1HG      ARG  61  11.870  10.346   6.619
  501    HD2  ARG  61           2HD      ARG  61   8.884  10.717   6.797
  502    HD3  ARG  61           1HD      ARG  61  10.099  11.933   6.414
  503    HE   ARG  61           HE       ARG  61   9.592   9.657   4.612
  504   HH11  ARG  61          1HH1      ARG  61   9.924  13.037   5.154
  505   HH12  ARG  61          2HH1      ARG  61   9.604  13.447   3.509
  506   HH21  ARG  61          1HH2      ARG  61   9.159  10.181   2.513
  507   HH22  ARG  61          2HH2      ARG  61   9.154  11.845   2.027
  508    H    ASN  62           H        ASN  62  12.856   6.298   4.253
  509    HA   ASN  62           HA       ASN  62  15.432   6.974   5.230
  510    HB2  ASN  62           2HB      ASN  62  14.485   5.937   7.290
  511    HB3  ASN  62           1HB      ASN  62  14.222   4.448   6.393
  512   HD21  ASN  62          1HD2      ASN  62  15.592   3.274   7.728
  513   HD22  ASN  62          2HD2      ASN  62  17.307   3.470   7.694
  514    HA   PRO  63           HA       PRO  63  16.035   4.929   1.262
  515    HB2  PRO  63           2HB      PRO  63  18.817   4.755   1.510
  516    HB3  PRO  63           1HB      PRO  63  17.925   6.120   0.831
  517    HG2  PRO  63           2HG      PRO  63  19.028   5.755   3.590
  518    HG3  PRO  63           1HG      PRO  63  18.988   7.212   2.581
  519    HD2  PRO  63           2HD      PRO  63  17.270   6.899   4.599
  520    HD3  PRO  63           1HD      PRO  63  16.752   7.645   3.070
  521    H    ASP  64           H        ASP  64  17.868   3.769   4.099
  522    HA   ASP  64           HA       ASP  64  18.301   1.135   3.202
  523    HB2  ASP  64           2HB      ASP  64  18.052   2.194   6.030
  524    HB3  ASP  64           1HB      ASP  64  18.728   0.628   5.588
  525    H    ASP  65           H        ASP  65  15.636   2.570   5.033
  526    HA   ASP  65           HA       ASP  65  14.218   0.242   5.682
  527    HB2  ASP  65           2HB      ASP  65  13.849   2.597   6.549
  528    HB3  ASP  65           1HB      ASP  65  13.021   2.950   5.037
  529    H    ILE  66           H        ILE  66  14.249   2.204   2.747
  530    HA   ILE  66           HA       ILE  66  12.077   1.091   1.381
  531    HB   ILE  66           HB       ILE  66  14.671   2.102   0.182
  532   HG12  ILE  66          2HG1      ILE  66  12.074   3.564   0.754
  533   HG13  ILE  66          1HG1      ILE  66  13.577   3.762   1.647
  534   HG21  ILE  66          1HG2      ILE  66  13.323   2.520  -1.843
  535   HG22  ILE  66          2HG2      ILE  66  11.940   1.744  -1.072
  536   HG23  ILE  66          3HG2      ILE  66  13.390   0.806  -1.432
  537   HD11  ILE  66          3HD1      ILE  66  13.229   5.585   0.091
  538   HD12  ILE  66          1HD1      ILE  66  13.141   4.448  -1.253
  539   HD13  ILE  66          2HD1      ILE  66  14.651   4.646  -0.360
  540    H    LEU  67           H        LEU  67  15.542   0.186   1.042
  541    HA   LEU  67           HA       LEU  67  15.009  -2.054  -0.610
  542    HB2  LEU  67           2HB      LEU  67  17.362  -2.708  -0.162
  543    HB3  LEU  67           1HB      LEU  67  17.168  -1.058  -0.714
  544    HG   LEU  67           HG       LEU  67  17.280  -0.480   1.847
  545   HD11  LEU  67          1HD1      LEU  67  18.750  -1.969   3.112
  546   HD12  LEU  67          2HD1      LEU  67  18.704  -3.139   1.793
  547   HD13  LEU  67          3HD1      LEU  67  17.233  -2.760   2.688
  548   HD21  LEU  67          3HD2      LEU  67  18.892   0.261   0.186
  549   HD22  LEU  67          1HD2      LEU  67  19.718  -1.296   0.269
  550   HD23  LEU  67          2HD2      LEU  67  19.703  -0.226   1.672
  551    H    LEU  68           H        LEU  68  15.249  -1.702   2.875
  552    HA   LEU  68           HA       LEU  68  15.325  -4.362   3.690
  553    HB2  LEU  68           2HB      LEU  68  15.551  -2.676   5.332
  554    HB3  LEU  68           1HB      LEU  68  14.046  -1.907   4.871
  555    HG   LEU  68           HG       LEU  68  12.787  -3.824   5.799
  556   HD11  LEU  68          1HD1      LEU  68  15.506  -4.794   6.705
  557   HD12  LEU  68          2HD1      LEU  68  14.450  -5.581   5.531
  558   HD13  LEU  68          3HD1      LEU  68  13.956  -5.464   7.219
  559   HD21  LEU  68          3HD2      LEU  68  13.189  -3.315   8.157
  560   HD22  LEU  68          1HD2      LEU  68  13.199  -1.851   7.175
  561   HD23  LEU  68          2HD2      LEU  68  14.720  -2.545   7.740
  562    H    PHE  69           H        PHE  69  12.375  -2.364   3.335
  563    HA   PHE  69           HA       PHE  69  10.643  -4.605   3.614
  564    HB2  PHE  69           2HB      PHE  69  10.282  -1.713   3.006
  565    HB3  PHE  69           1HB      PHE  69   8.942  -2.807   2.658
  566    HD1  PHE  69           HD2      PHE  69   7.884  -4.081   4.461
  567    HD2  PHE  69           HD1      PHE  69  10.907  -1.190   5.273
  568    HE1  PHE  69           HE2      PHE  69   7.243  -4.087   6.824
  569    HE2  PHE  69           HE1      PHE  69  10.268  -1.195   7.650
  570    HZ   PHE  69           HZ       PHE  69   8.431  -2.642   8.429
  571    H    ARG  70           H        ARG  70  11.899  -2.902   0.767
  572    HA   ARG  70           HA       ARG  70  10.357  -4.189  -1.184
  573    HB2  ARG  70           2HB      ARG  70  11.864  -2.331  -1.723
  574    HB3  ARG  70           1HB      ARG  70  13.261  -3.323  -1.338
  575    HG2  ARG  70           2HG      ARG  70  11.371  -4.223  -3.480
  576    HG3  ARG  70           1HG      ARG  70  12.533  -2.945  -3.828
  577    HD2  ARG  70           2HD      ARG  70  14.379  -4.376  -3.415
  578    HD3  ARG  70           1HD      ARG  70  13.363  -5.595  -2.648
  579    HE   ARG  70           HE       ARG  70  12.661  -5.121  -5.382
  580   HH11  ARG  70          1HH1      ARG  70  14.880  -6.821  -3.351
  581   HH12  ARG  70          2HH1      ARG  70  15.073  -8.117  -4.481
  582   HH21  ARG  70          1HH2      ARG  70  12.926  -6.773  -6.807
  583   HH22  ARG  70          2HH2      ARG  70  13.985  -8.087  -6.418
  584    H    ASP  71           H        ASP  71  13.336  -5.227   0.419
  585    HA   ASP  71           HA       ASP  71  13.746  -7.563  -1.126
  586    HB2  ASP  71           2HB      ASP  71  15.456  -6.322   0.273
  587    HB3  ASP  71           1HB      ASP  71  14.728  -7.068   1.693
  588    H    ARG  72           H        ARG  72  12.333  -7.118   2.138
  589    HA   ARG  72           HA       ARG  72  11.853  -9.923   2.485
  590    HB2  ARG  72           2HB      ARG  72  10.720  -9.305   4.558
  591    HB3  ARG  72           1HB      ARG  72  12.264  -8.481   4.410
  592    HG2  ARG  72           2HG      ARG  72  11.173  -6.424   3.809
  593    HG3  ARG  72           1HG      ARG  72   9.604  -7.226   3.758
  594    HD2  ARG  72           2HD      ARG  72  11.342  -6.869   6.207
  595    HD3  ARG  72           1HD      ARG  72   9.871  -5.966   5.837
  596    HE   ARG  72           HE       ARG  72   9.718  -8.884   6.092
  597   HH11  ARG  72          1HH1      ARG  72   8.987  -5.779   7.418
  598   HH12  ARG  72          2HH1      ARG  72   7.769  -6.410   8.468
  599   HH21  ARG  72          1HH2      ARG  72   8.180  -9.659   7.471
  600   HH22  ARG  72          2HH2      ARG  72   7.327  -8.569   8.509
  601    H    PHE  73           H        PHE  73  10.113  -7.538   0.790
  602    HA   PHE  73           HA       PHE  73   7.635  -9.131   0.932
  603    HB2  PHE  73           2HB      PHE  73   8.166  -6.251   0.298
  604    HB3  PHE  73           1HB      PHE  73   6.760  -7.023  -0.424
  605    HD1  PHE  73           HD2      PHE  73   8.373  -6.284   2.860
  606    HD2  PHE  73           HD1      PHE  73   4.792  -7.284   0.780
  607    HE1  PHE  73           HE2      PHE  73   7.077  -5.905   4.913
  608    HE2  PHE  73           HE1      PHE  73   3.494  -6.903   2.832
  609    HZ   PHE  73           HZ       PHE  73   4.633  -6.214   4.902
  610    H    ASP  74           H        ASP  74   8.629  -7.053  -1.735
  611    HA   ASP  74           HA       ASP  74   8.360  -7.355  -3.979
  612    HB2  ASP  74           2HB      ASP  74  10.720  -7.896  -3.505
  613    HB3  ASP  74           1HB      ASP  74  10.295  -9.604  -3.408
  614    H    GLY  75           H        GLY  75   6.393  -7.962  -4.706
  615    HA2  GLY  75           2HA      GLY  75   4.744  -9.300  -5.592
  616    HA3  GLY  75           1HA      GLY  75   5.957 -10.562  -5.727
  617    H    TYR  76           H        TYR  76   4.289  -8.921  -3.032
  618    HA   TYR  76           HA       TYR  76   4.175 -11.430  -1.567
  619    HB2  TYR  76           2HB      TYR  76   4.818  -9.790  -0.107
  620    HB3  TYR  76           1HB      TYR  76   3.914  -8.538  -0.940
  621    HD1  TYR  76           HD2      TYR  76   3.257 -11.602   1.148
  622    HD2  TYR  76           HD1      TYR  76   2.128  -7.627   0.131
  623    HE1  TYR  76           HE2      TYR  76   1.544 -11.636   2.914
  624    HE2  TYR  76           HE1      TYR  76   0.428  -7.645   1.879
  625    HH   TYR  76           HH       TYR  76  -0.846  -9.151   3.200
  626    H    ILE  77           H        ILE  77   2.560 -12.783  -2.001
  627    HA   ILE  77           HA       ILE  77  -0.007 -11.865  -2.996
  628    HB   ILE  77           HB       ILE  77   0.946 -14.662  -2.327
  629   HG12  ILE  77          2HG1      ILE  77   2.182 -13.556  -4.186
  630   HG13  ILE  77          1HG1      ILE  77   1.263 -14.960  -4.717
  631   HG21  ILE  77          1HG2      ILE  77  -1.487 -14.511  -2.213
  632   HG22  ILE  77          2HG2      ILE  77  -0.991 -15.442  -3.625
  633   HG23  ILE  77          3HG2      ILE  77  -1.532 -13.774  -3.815
  634   HD11  ILE  77          3HD1      ILE  77   1.083 -13.174  -6.323
  635   HD12  ILE  77          1HD1      ILE  77   0.491 -12.075  -5.079
  636   HD13  ILE  77          2HD1      ILE  77  -0.485 -13.459  -5.568
  637    H    PHE  78           H        PHE  78  -1.405 -11.029  -1.547
  638    HA   PHE  78           HA       PHE  78  -1.630 -12.199   1.133
  639    HB2  PHE  78           2HB      PHE  78  -1.479  -9.783   1.051
  640    HB3  PHE  78           1HB      PHE  78  -2.822  -9.695  -0.083
  641    HD1  PHE  78           HD1      PHE  78  -2.074 -11.027   3.332
  642    HD2  PHE  78           HD2      PHE  78  -4.900  -9.135   0.761
  643    HE1  PHE  78           HE1      PHE  78  -3.633 -10.797   5.220
  644    HE2  PHE  78           HE2      PHE  78  -6.462  -8.903   2.646
  645    HZ   PHE  78           HZ       PHE  78  -5.830  -9.733   4.878
  646    H    LEU  79           H        LEU  79  -3.364 -13.352   1.835
  647    HA   LEU  79           HA       LEU  79  -5.685 -13.658   0.030
  648    HB2  LEU  79           2HB      LEU  79  -4.484 -15.628   1.981
  649    HB3  LEU  79           1HB      LEU  79  -6.002 -15.883   1.141
  650    HG   LEU  79           HG       LEU  79  -3.354 -15.505  -0.270
  651   HD11  LEU  79          1HD1      LEU  79  -3.368 -17.916  -0.644
  652   HD12  LEU  79          2HD1      LEU  79  -4.814 -18.071   0.354
  653   HD13  LEU  79          3HD1      LEU  79  -3.296 -17.540   1.078
  654   HD21  LEU  79          3HD2      LEU  79  -4.554 -16.408  -2.206
  655   HD22  LEU  79          1HD2      LEU  79  -5.286 -14.912  -1.623
  656   HD23  LEU  79          2HD2      LEU  79  -6.039 -16.466  -1.257
  657    H    ASP  80           H        ASP  80  -7.494 -12.761   0.771
  658    HA   ASP  80           HA       ASP  80  -7.568 -11.332   3.180
  659    HB2  ASP  80           2HB      ASP  80  -9.972 -10.925   2.577
  660    HB3  ASP  80           1HB      ASP  80  -8.827 -10.580   1.286
  661    H    SER  81           H        SER  81 -10.020 -13.795   2.420
  662    HA   SER  81           HA       SER  81  -9.794 -15.218   4.887
  663    HB2  SER  81           2HB      SER  81 -12.189 -13.374   4.518
  664    HB3  SER  81           1HB      SER  81 -12.043 -14.604   5.774
  665    HG   SER  81           HG       SER  81  -9.898 -13.238   6.075
  666    H    LYS  82           H        LYS  82 -11.886 -14.252   2.190
  667    HA   LYS  82           HA       LYS  82 -13.054 -16.793   1.707
  668    HB2  LYS  82           2HB      LYS  82 -12.500 -14.391  -0.041
  669    HB3  LYS  82           1HB      LYS  82 -13.233 -15.848  -0.691
  670    HG2  LYS  82           2HG      LYS  82 -14.400 -14.343   1.638
  671    HG3  LYS  82           1HG      LYS  82 -14.813 -13.991  -0.043
  672    HD2  LYS  82           2HD      LYS  82 -15.511 -16.370  -0.309
  673    HD3  LYS  82           1HD      LYS  82 -15.219 -16.611   1.414
  674    HE2  LYS  82           2HE      LYS  82 -16.939 -15.025   1.983
  675    HE3  LYS  82           1HE      LYS  82 -17.143 -14.572   0.291
  676    HZ1  LYS  82           3HZ      LYS  82 -17.915 -16.825  -0.170
  677    HZ2  LYS  82           1HZ      LYS  82 -18.879 -16.074   0.996
  678    HZ3  LYS  82           2HZ      LYS  82 -17.744 -17.234   1.462
  679    H    GLY  83           H        GLY  83 -10.318 -15.143   0.108
  680    HA2  GLY  83           2HA      GLY  83  -8.229 -16.604   0.107
  681    HA3  GLY  83           1HA      GLY  83  -9.255 -17.793  -0.673
  682    H    LEU  84           H        LEU  84  -9.277 -14.310  -1.306
  683    HA   LEU  84           HA       LEU  84  -8.665 -14.823  -4.114
  684    HB2  LEU  84           2HB      LEU  84  -9.396 -12.239  -2.716
  685    HB3  LEU  84           1HB      LEU  84  -9.285 -12.475  -4.452
  686    HG   LEU  84           HG       LEU  84 -11.306 -13.789  -2.619
  687   HD11  LEU  84          1HD1      LEU  84 -11.767 -11.429  -2.908
  688   HD12  LEU  84          2HD1      LEU  84 -12.940 -12.385  -3.812
  689   HD13  LEU  84          3HD1      LEU  84 -11.616 -11.583  -4.658
  690   HD21  LEU  84          3HD2      LEU  84 -10.710 -15.246  -4.487
  691   HD22  LEU  84          1HD2      LEU  84 -11.016 -13.933  -5.625
  692   HD23  LEU  84          2HD2      LEU  84 -12.343 -14.612  -4.681
  693    H    GLU  85           H        GLU  85  -6.761 -14.286  -5.089
  694    HA   GLU  85           HA       GLU  85  -4.509 -13.661  -3.451
  695    HB2  GLU  85           2HB      GLU  85  -4.716 -13.780  -6.469
  696    HB3  GLU  85           1HB      GLU  85  -3.217 -13.682  -5.554
  697    HG2  GLU  85           2HG      GLU  85  -3.839 -15.853  -4.468
  698    HG3  GLU  85           1HG      GLU  85  -5.188 -15.960  -5.599
  699    H    TYR  86           H        TYR  86  -3.943 -11.709  -2.775
  700    HA   TYR  86           HA       TYR  86  -4.365  -9.388  -4.549
  701    HB2  TYR  86           2HB      TYR  86  -3.793  -9.450  -1.570
  702    HB3  TYR  86           1HB      TYR  86  -4.019  -7.993  -2.532
  703    HD1  TYR  86           HD2      TYR  86  -5.698 -10.932  -1.079
  704    HD2  TYR  86           HD1      TYR  86  -6.235  -7.296  -3.229
  705    HE1  TYR  86           HE2      TYR  86  -8.121 -11.076  -0.709
  706    HE2  TYR  86           HE1      TYR  86  -8.662  -7.437  -2.865
  707    HH   TYR  86           HH       TYR  86 -10.070  -9.745  -0.707
  708    HA   PRO  87           HA       PRO  87   0.105 -10.322  -4.948
  709    HB2  PRO  87           2HB      PRO  87   0.397  -9.394  -7.479
  710    HB3  PRO  87           1HB      PRO  87  -0.268 -10.993  -7.117
  711    HG2  PRO  87           2HG      PRO  87  -1.706  -8.452  -7.802
  712    HG3  PRO  87           1HG      PRO  87  -2.016 -10.103  -8.372
  713    HD2  PRO  87           2HD      PRO  87  -3.463  -8.913  -6.390
  714    HD3  PRO  87           1HD      PRO  87  -3.203 -10.667  -6.484
  715    H    ALA  88           H        ALA  88   0.590  -8.733  -3.361
  716    HA   ALA  88           HA       ALA  88   0.682  -5.954  -3.921
  717    HB1  ALA  88           3HB      ALA  88   2.201  -7.527  -1.839
  718    HB2  ALA  88           1HB      ALA  88   0.592  -6.836  -1.641
  719    HB3  ALA  88           2HB      ALA  88   1.985  -5.778  -1.862
  720    H    VAL  89           H        VAL  89   1.711  -5.866  -5.991
  721    HA   VAL  89           HA       VAL  89   4.543  -6.513  -6.173
  722    HB   VAL  89           HB       VAL  89   2.756  -5.084  -8.163
  723   HG11  VAL  89          1HG1      VAL  89   5.506  -6.299  -8.500
  724   HG12  VAL  89          2HG1      VAL  89   5.110  -4.582  -8.538
  725   HG13  VAL  89          3HG1      VAL  89   4.510  -5.650  -9.804
  726   HG21  VAL  89          3HG2      VAL  89   1.966  -7.353  -7.730
  727   HG22  VAL  89          1HG2      VAL  89   3.581  -7.991  -8.031
  728   HG23  VAL  89          2HG2      VAL  89   2.669  -7.242  -9.344
  729    H    VAL  90           H        VAL  90   6.136  -5.134  -5.600
  730    HA   VAL  90           HA       VAL  90   5.346  -2.415  -4.832
  731    HB   VAL  90           HB       VAL  90   6.328  -3.687  -3.053
  732   HG11  VAL  90          1HG1      VAL  90   8.616  -4.559  -3.121
  733   HG12  VAL  90          2HG1      VAL  90   8.754  -4.070  -4.811
  734   HG13  VAL  90          3HG1      VAL  90   7.594  -5.315  -4.346
  735   HG21  VAL  90          3HG2      VAL  90   8.308  -1.631  -4.043
  736   HG22  VAL  90          1HG2      VAL  90   8.179  -2.232  -2.390
  737   HG23  VAL  90          2HG2      VAL  90   6.856  -1.303  -3.096
  738    H    GLU  91           H        GLU  91   5.824  -0.741  -6.089
  739    HA   GLU  91           HA       GLU  91   8.458  -0.666  -7.407
  740    HB2  GLU  91           2HB      GLU  91   7.587   0.320  -9.402
  741    HB3  GLU  91           1HB      GLU  91   6.623  -1.118  -9.091
  742    HG2  GLU  91           2HG      GLU  91   4.800   0.204  -8.263
  743    HG3  GLU  91           1HG      GLU  91   5.771   1.673  -8.326
  744    H    PHE  92           H        PHE  92   8.995   1.695  -8.037
  745    HA   PHE  92           HA       PHE  92   8.088   3.460  -5.847
  746    HB2  PHE  92           2HB      PHE  92  10.323   4.484  -5.860
  747    HB3  PHE  92           1HB      PHE  92  10.408   2.760  -5.521
  748    HD1  PHE  92           HD1      PHE  92  11.142   1.189  -7.346
  749    HD2  PHE  92           HD2      PHE  92  11.466   5.424  -7.713
  750    HE1  PHE  92           HE1      PHE  92  12.775   0.906  -9.166
  751    HE2  PHE  92           HE2      PHE  92  13.093   5.141  -9.534
  752    HZ   PHE  92           HZ       PHE  92  13.751   2.883 -10.262
  753    H    ALA  93           H        ALA  93   8.149   5.769  -6.278
  754    HA   ALA  93           HA       ALA  93   7.045   6.448  -8.831
  755    HB1  ALA  93           3HB      ALA  93   6.270   7.522  -6.770
  756    HB2  ALA  93           1HB      ALA  93   6.869   8.714  -7.924
  757    HB3  ALA  93           2HB      ALA  93   7.863   8.245  -6.544
  758    HA   PRO  94           HA       PRO  94  11.041   7.030 -10.821
  759    HB2  PRO  94           2HB      PRO  94  10.011   8.361 -13.040
  760    HB3  PRO  94           1HB      PRO  94  10.146   6.607 -12.876
  761    HG2  PRO  94           2HG      PRO  94   7.776   8.379 -12.414
  762    HG3  PRO  94           1HG      PRO  94   7.849   6.777 -13.175
  763    HD2  PRO  94           2HD      PRO  94   6.974   7.077 -10.660
  764    HD3  PRO  94           1HD      PRO  94   7.957   5.671 -11.125
  765    H    PHE  95           H        PHE  95  12.287   8.520  -9.848
  766    HA   PHE  95           HA       PHE  95  11.483  11.203  -9.318
  767    HB2  PHE  95           2HB      PHE  95  13.938  11.485  -8.682
  768    HB3  PHE  95           1HB      PHE  95  13.032  10.263  -7.800
  769    HD1  PHE  95           HD1      PHE  95  15.469  10.732 -10.569
  770    HD2  PHE  95           HD2      PHE  95  13.735   8.021  -7.774
  771    HE1  PHE  95           HE1      PHE  95  17.156   9.043 -11.161
  772    HE2  PHE  95           HE2      PHE  95  15.422   6.330  -8.364
  773    HZ   PHE  95           HZ       PHE  95  17.133   6.841 -10.059
  774    H    GLN  96           H        GLN  96  12.239   9.897 -12.220
  775    HA   GLN  96           HA       GLN  96  13.941  11.876 -13.358
  776    HB2  GLN  96           2HB      GLN  96  12.079   9.840 -14.588
  777    HB3  GLN  96           1HB      GLN  96  13.096  10.910 -15.545
  778    HG2  GLN  96           2HG      GLN  96  14.079   8.918 -13.509
  779    HG3  GLN  96           1HG      GLN  96  14.099   8.699 -15.258
  780   HE21  GLN  96          1HE2      GLN  96  14.842  11.453 -15.824
  781   HE22  GLN  96          2HE2      GLN  96  16.501  11.602 -15.373
  782    H    LYS  97           H        LYS  97  13.473  13.709 -14.505
  783    HA   LYS  97           HA       LYS  97  10.873  14.904 -14.023
  784    HB2  LYS  97           2HB      LYS  97  12.954  16.186 -13.661
  785    HB3  LYS  97           1HB      LYS  97  13.335  16.043 -15.370
  786    HG2  LYS  97           2HG      LYS  97  12.425  18.238 -14.843
  787    HG3  LYS  97           1HG      LYS  97  11.361  17.356 -15.941
  788    HD2  LYS  97           2HD      LYS  97   9.933  16.734 -14.031
  789    HD3  LYS  97           1HD      LYS  97  10.988  17.652 -12.955
  790    HE2  LYS  97           2HE      LYS  97  10.439  19.709 -14.119
  791    HE3  LYS  97           1HE      LYS  97   9.467  18.817 -15.292
  792    HZ1  LYS  97           3HZ      LYS  97   8.053  19.806 -13.649
  793    HZ2  LYS  97           1HZ      LYS  97   8.919  19.084 -12.388
  794    HZ3  LYS  97           2HZ      LYS  97   8.020  18.127 -13.455
  Start of MODEL   13
    1    H1   MET   1           1H       MET   1  26.669  14.446  19.729
    2    H2   MET   1           2H       MET   1  28.032  14.012  18.831
    3    H3   MET   1           3H       MET   1  27.424  12.959  20.005
    4    HA   MET   1           HA       MET   1  26.845  12.198  17.814
    5    HB2  MET   1           2HB      MET   1  24.405  12.004  18.153
    6    HB3  MET   1           1HB      MET   1  25.311  11.698  19.626
    7    HG2  MET   1           2HG      MET   1  23.376  12.987  20.165
    8    HG3  MET   1           1HG      MET   1  24.800  14.008  20.365
    9    HE1  MET   1           3HE      MET   1  23.203  16.149  20.435
   10    HE2  MET   1           1HE      MET   1  21.790  15.121  20.209
   11    HE3  MET   1           2HE      MET   1  22.028  16.530  19.175
   12    H    GLY   2           H        GLY   2  24.794  12.617  16.243
   13    HA2  GLY   2           2HA      GLY   2  24.611  15.436  15.468
   14    HA3  GLY   2           1HA      GLY   2  25.290  14.322  14.288
   15    H    HIS   3           H        HIS   3  23.561  14.766  12.847
   16    HA   HIS   3           HA       HIS   3  21.079  13.330  13.534
   17    HB2  HIS   3           2HB      HIS   3  21.205  15.969  12.049
   18    HB3  HIS   3           1HB      HIS   3  19.746  15.040  12.383
   19    HD1  HIS   3           HD1      HIS   3  22.075  17.487  13.871
   20    HD2  HIS   3           HD2      HIS   3  18.945  15.067  15.143
   21    HE1  HIS   3           HE1      HIS   3  21.440  18.346  16.142
   22    HE2  HIS   3           HE2      HIS   3  19.609  16.813  16.932
   23    H    HIS   4           H        HIS   4  19.911  12.474  11.713
   24    HA   HIS   4           HA       HIS   4  21.558  11.653   9.497
   25    HB2  HIS   4           2HB      HIS   4  19.821  10.181  10.513
   26    HB3  HIS   4           1HB      HIS   4  18.576  11.281   9.931
   27    HD1  HIS   4           HD1      HIS   4  17.642  10.757   7.697
   28    HD2  HIS   4           HD2      HIS   4  21.337   8.960   8.285
   29    HE1  HIS   4           HE1      HIS   4  17.994   9.280   5.701
   30    HE2  HIS   4           HE2      HIS   4  20.122   8.043   6.200
   31    H    HIS   5           H        HIS   5  22.072  13.826   8.788
   32    HA   HIS   5           HA       HIS   5  20.192  15.816   8.250
   33    HB2  HIS   5           2HB      HIS   5  22.643  16.146   8.626
   34    HB3  HIS   5           1HB      HIS   5  22.927  15.562   6.991
   35    HD1  HIS   5           HD1      HIS   5  21.337  18.422   8.848
   36    HD2  HIS   5           HD2      HIS   5  22.591  17.461   5.010
   37    HE1  HIS   5           HE1      HIS   5  21.189  20.557   7.545
   38    HE2  HIS   5           HE2      HIS   5  22.143  19.993   5.290
   39    H    HIS   6           H        HIS   6  21.601  13.412   6.021
   40    HA   HIS   6           HA       HIS   6  20.198  14.383   3.730
   41    HB2  HIS   6           2HB      HIS   6  21.398  11.669   4.343
   42    HB3  HIS   6           1HB      HIS   6  20.646  12.066   2.801
   43    HD1  HIS   6           HD1      HIS   6  23.863  11.837   4.201
   44    HD2  HIS   6           HD2      HIS   6  21.998  14.635   1.760
   45    HE1  HIS   6           HE1      HIS   6  25.720  13.087   3.072
   46    HE2  HIS   6           HE2      HIS   6  24.565  14.631   1.462
   47    H    HIS   7           H        HIS   7  18.082  14.775   4.452
   48    HA   HIS   7           HA       HIS   7  16.516  12.530   5.516
   49    HB2  HIS   7           2HB      HIS   7  16.603  14.780   6.670
   50    HB3  HIS   7           1HB      HIS   7  15.730  15.450   5.297
   51    HD1  HIS   7           HD1      HIS   7  13.218  15.133   5.258
   52    HD2  HIS   7           HD2      HIS   7  15.068  12.961   8.274
   53    HE1  HIS   7           HE1      HIS   7  11.357  14.269   6.700
   54    HE2  HIS   7           HE2      HIS   7  12.509  13.111   8.608
   55    H    HIS   8           H        HIS   8  17.232  12.761   2.646
   56    HA   HIS   8           HA       HIS   8  14.687  13.349   1.324
   57    HB2  HIS   8           2HB      HIS   8  17.381  12.577   0.178
   58    HB3  HIS   8           1HB      HIS   8  15.956  12.969  -0.778
   59    HD1  HIS   8           HD1      HIS   8  15.221  15.462  -0.843
   60    HD2  HIS   8           HD2      HIS   8  18.723  14.751   1.278
   61    HE1  HIS   8           HE1      HIS   8  16.274  17.717  -0.505
   62    HE2  HIS   8           HE2      HIS   8  18.463  17.244   0.646
   63    H    SER   9           H        SER   9  13.439  11.846   0.260
   64    HA   SER   9           HA       SER   9  14.207   9.007   0.524
   65    HB2  SER   9           2HB      SER   9  11.924   8.437   1.239
   66    HB3  SER   9           1HB      SER   9  12.676   9.560   2.372
   67    HG   SER   9           HG       SER   9  10.765  10.175   0.352
   68    H    HIS  10           H        HIS  10  13.565   7.654  -1.104
   69    HA   HIS  10           HA       HIS  10  12.624   8.828  -3.567
   70    HB2  HIS  10           2HB      HIS  10  13.249   5.964  -2.800
   71    HB3  HIS  10           1HB      HIS  10  12.780   6.467  -4.418
   72    HD1  HIS  10           HD1      HIS  10  15.041   5.693  -5.398
   73    HD2  HIS  10           HD2      HIS  10  15.395   8.634  -2.479
   74    HE1  HIS  10           HE1      HIS  10  17.413   6.500  -5.533
   75    HE2  HIS  10           HE2      HIS  10  17.607   8.278  -3.769
   76    H    MET  11           H        MET  11  10.495   9.218  -3.913
   77    HA   MET  11           HA       MET  11   8.411   8.121  -2.356
   78    HB2  MET  11           2HB      MET  11   6.881   9.164  -4.000
   79    HB3  MET  11           1HB      MET  11   8.127  10.264  -3.433
   80    HG2  MET  11           2HG      MET  11   9.396   9.831  -5.517
   81    HG3  MET  11           1HG      MET  11   8.049   8.842  -6.085
   82    HE1  MET  11           3HE      MET  11   7.665  12.045  -8.302
   83    HE2  MET  11           1HE      MET  11   7.742  10.283  -8.296
   84    HE3  MET  11           2HE      MET  11   9.150  11.229  -7.816
   85    H    VAL  12           H        VAL  12   7.471   6.200  -2.419
   86    HA   VAL  12           HA       VAL  12   7.923   4.492  -4.785
   87    HB   VAL  12           HB       VAL  12   7.791   3.723  -1.861
   88   HG11  VAL  12          1HG1      VAL  12   8.197   1.956  -4.274
   89   HG12  VAL  12          2HG1      VAL  12   6.775   1.983  -3.232
   90   HG13  VAL  12          3HG1      VAL  12   8.328   1.446  -2.591
   91   HG21  VAL  12          3HG2      VAL  12  10.088   3.659  -3.829
   92   HG22  VAL  12          1HG2      VAL  12  10.141   3.068  -2.167
   93   HG23  VAL  12          2HG2      VAL  12   9.897   4.784  -2.483
   94    H    VAL  13           H        VAL  13   6.288   3.279  -5.597
   95    HA   VAL  13           HA       VAL  13   3.602   3.559  -4.392
   96    HB   VAL  13           HB       VAL  13   2.645   3.246  -6.573
   97   HG11  VAL  13          1HG1      VAL  13   3.379   5.520  -6.076
   98   HG12  VAL  13          2HG1      VAL  13   3.513   5.186  -7.801
   99   HG13  VAL  13          3HG1      VAL  13   4.957   5.183  -6.786
  100   HG21  VAL  13          3HG2      VAL  13   3.991   2.886  -8.601
  101   HG22  VAL  13          1HG2      VAL  13   4.189   1.563  -7.451
  102   HG23  VAL  13          2HG2      VAL  13   5.451   2.785  -7.613
  103    H    ILE  14           H        ILE  14   2.139   1.588  -4.934
  104    HA   ILE  14           HA       ILE  14   3.705  -0.898  -5.144
  105    HB   ILE  14           HB       ILE  14   3.105  -0.519  -2.756
  106   HG12  ILE  14          2HG1      ILE  14   1.681  -2.892  -3.990
  107   HG13  ILE  14          1HG1      ILE  14   3.417  -2.798  -3.718
  108   HG21  ILE  14          1HG2      ILE  14   0.249  -0.811  -3.690
  109   HG22  ILE  14          2HG2      ILE  14   0.990   0.658  -3.055
  110   HG23  ILE  14          3HG2      ILE  14   0.789  -0.750  -2.012
  111   HD11  ILE  14          3HD1      ILE  14   2.374  -4.088  -1.978
  112   HD12  ILE  14          1HD1      ILE  14   1.268  -2.765  -1.613
  113   HD13  ILE  14          2HD1      ILE  14   2.994  -2.582  -1.301
  114    H    ARG  15           H        ARG  15   3.057  -2.093  -6.795
  115    HA   ARG  15           HA       ARG  15   0.553  -1.409  -8.159
  116    HB2  ARG  15           2HB      ARG  15   2.849  -1.498  -9.298
  117    HB3  ARG  15           1HB      ARG  15   2.744  -3.245  -9.155
  118    HG2  ARG  15           2HG      ARG  15   0.527  -3.042 -10.425
  119    HG3  ARG  15           1HG      ARG  15   1.036  -1.394 -10.797
  120    HD2  ARG  15           2HD      ARG  15   2.444  -3.961 -11.537
  121    HD3  ARG  15           1HD      ARG  15   1.657  -2.822 -12.628
  122    HE   ARG  15           HE       ARG  15   3.734  -1.560 -11.155
  123   HH11  ARG  15          1HH1      ARG  15   3.200  -3.685 -13.824
  124   HH12  ARG  15          2HH1      ARG  15   4.719  -3.302 -14.558
  125   HH21  ARG  15          1HH2      ARG  15   5.662  -1.082 -12.110
  126   HH22  ARG  15          2HH2      ARG  15   6.089  -1.835 -13.611
  127    H    ARG  16           H        ARG  16  -0.656  -3.213  -9.239
  128    HA   ARG  16           HA       ARG  16  -1.446  -5.329  -9.561
  129    HB2  ARG  16           2HB      ARG  16   0.256  -6.259  -7.241
  130    HB3  ARG  16           1HB      ARG  16  -0.588  -7.278  -8.396
  131    HG2  ARG  16           2HG      ARG  16   1.739  -5.453  -8.994
  132    HG3  ARG  16           1HG      ARG  16   1.789  -7.210  -8.871
  133    HD2  ARG  16           2HD      ARG  16   0.309  -7.401 -10.803
  134    HD3  ARG  16           1HD      ARG  16   0.204  -5.642 -10.911
  135    HE   ARG  16           HE       ARG  16   2.908  -6.419 -11.009
  136   HH11  ARG  16          1HH1      ARG  16   0.050  -6.482 -12.941
  137   HH12  ARG  16          2HH1      ARG  16   0.931  -6.528 -14.427
  138   HH21  ARG  16          1HH2      ARG  16   4.019  -6.448 -12.904
  139   HH22  ARG  16          2HH2      ARG  16   3.164  -6.510 -14.409
  140    H    LEU  17           H        LEU  17  -1.858  -3.413  -6.882
  141    HA   LEU  17           HA       LEU  17  -3.513  -5.065  -5.251
  142    HB2  LEU  17           2HB      LEU  17  -3.084  -2.092  -5.410
  143    HB3  LEU  17           1HB      LEU  17  -4.309  -2.768  -4.357
  144    HG   LEU  17           HG       LEU  17  -2.298  -2.295  -3.092
  145   HD11  LEU  17          1HD1      LEU  17  -1.921  -4.483  -2.078
  146   HD12  LEU  17          2HD1      LEU  17  -2.691  -5.264  -3.461
  147   HD13  LEU  17          3HD1      LEU  17  -3.632  -4.209  -2.405
  148   HD21  LEU  17          3HD2      LEU  17  -0.659  -2.434  -4.887
  149   HD22  LEU  17          1HD2      LEU  17  -0.890  -4.182  -4.983
  150   HD23  LEU  17          2HD2      LEU  17  -0.192  -3.461  -3.532
  151    HA   PRO  18           HA       PRO  18  -7.303  -4.354  -7.651
  152    HB2  PRO  18           2HB      PRO  18  -8.335  -6.801  -7.334
  153    HB3  PRO  18           1HB      PRO  18  -6.955  -6.534  -8.405
  154    HG2  PRO  18           2HG      PRO  18  -7.046  -7.824  -5.740
  155    HG3  PRO  18           1HG      PRO  18  -5.898  -8.065  -7.066
  156    HD2  PRO  18           2HD      PRO  18  -5.606  -6.396  -4.725
  157    HD3  PRO  18           1HD      PRO  18  -4.433  -6.674  -6.027
  158    HA   PRO  19           HA       PRO  19 -10.353  -3.462  -4.448
  159    HB2  PRO  19           2HB      PRO  19 -12.320  -5.107  -5.980
  160    HB3  PRO  19           1HB      PRO  19 -12.443  -3.434  -5.423
  161    HG2  PRO  19           2HG      PRO  19 -12.001  -3.967  -7.992
  162    HG3  PRO  19           1HG      PRO  19 -11.180  -2.610  -7.196
  163    HD2  PRO  19           2HD      PRO  19 -10.108  -5.316  -7.913
  164    HD3  PRO  19           1HD      PRO  19  -9.318  -3.728  -8.009
  165    H    GLY  20           H        GLY  20 -10.967  -4.389  -2.511
  166    HA2  GLY  20           2HA      GLY  20 -11.658  -7.139  -2.211
  167    HA3  GLY  20           1HA      GLY  20  -9.977  -6.877  -1.773
  168    H    LEU  21           H        LEU  21  -9.910  -6.997   0.404
  169    HA   LEU  21           HA       LEU  21 -11.949  -6.228   2.168
  170    HB2  LEU  21           2HB      LEU  21 -10.377  -6.488   3.947
  171    HB3  LEU  21           1HB      LEU  21 -10.077  -7.744   2.766
  172    HG   LEU  21           HG       LEU  21  -8.419  -5.230   3.073
  173   HD11  LEU  21          1HD1      LEU  21  -8.216  -6.698   5.013
  174   HD12  LEU  21          2HD1      LEU  21  -6.731  -6.677   4.063
  175   HD13  LEU  21          3HD1      LEU  21  -7.827  -8.055   3.951
  176   HD21  LEU  21          3HD2      LEU  21  -6.806  -6.401   1.623
  177   HD22  LEU  21          1HD2      LEU  21  -8.331  -6.086   0.796
  178   HD23  LEU  21          2HD2      LEU  21  -7.971  -7.706   1.393
  179    H    THR  22           H        THR  22 -12.006  -4.452   3.699
  180    HA   THR  22           HA       THR  22 -11.747  -1.942   2.385
  181    HB   THR  22           HB       THR  22 -12.238  -2.359   5.347
  182    HG1  THR  22           HG1      THR  22 -14.341  -2.035   3.494
  183   HG21  THR  22          3HG2      THR  22 -13.043  -0.134   3.461
  184   HG22  THR  22          1HG2      THR  22 -11.793  -0.037   4.702
  185   HG23  THR  22          2HG2      THR  22 -13.481  -0.243   5.166
  186    H    LYS  23           H        LYS  23 -10.384  -0.178   2.867
  187    HA   LYS  23           HA       LYS  23  -7.713  -0.670   3.230
  188    HB2  LYS  23           2HB      LYS  23  -7.416   1.730   3.635
  189    HB3  LYS  23           1HB      LYS  23  -8.523   1.424   2.307
  190    HG2  LYS  23           2HG      LYS  23 -10.414   2.002   3.640
  191    HG3  LYS  23           1HG      LYS  23  -9.436   2.052   5.109
  192    HD2  LYS  23           2HD      LYS  23  -9.184   3.916   2.739
  193    HD3  LYS  23           1HD      LYS  23  -9.916   4.312   4.297
  194    HE2  LYS  23           2HE      LYS  23  -7.745   3.872   5.394
  195    HE3  LYS  23           1HE      LYS  23  -7.028   3.563   3.815
  196    HZ1  LYS  23           3HZ      LYS  23  -7.518   5.828   3.179
  197    HZ2  LYS  23           1HZ      LYS  23  -6.585   5.806   4.590
  198    HZ3  LYS  23           2HZ      LYS  23  -8.245   6.127   4.674
  199    H    GLU  24           H        GLU  24 -10.102  -0.097   5.742
  200    HA   GLU  24           HA       GLU  24  -8.648   0.480   7.980
  201    HB2  GLU  24           2HB      GLU  24 -10.890  -1.554   7.834
  202    HB3  GLU  24           1HB      GLU  24 -10.368  -0.689   9.275
  203    HG2  GLU  24           2HG      GLU  24 -11.052   1.430   8.250
  204    HG3  GLU  24           1HG      GLU  24 -11.574   0.560   6.810
  205    H    GLN  25           H        GLN  25  -8.900  -2.671   6.413
  206    HA   GLN  25           HA       GLN  25  -6.861  -3.763   8.252
  207    HB2  GLN  25           2HB      GLN  25  -8.648  -5.202   6.268
  208    HB3  GLN  25           1HB      GLN  25  -7.503  -5.968   7.360
  209    HG2  GLN  25           2HG      GLN  25  -8.803  -5.161   9.280
  210    HG3  GLN  25           1HG      GLN  25  -9.953  -4.409   8.174
  211   HE21  GLN  25          1HE2      GLN  25 -11.363  -5.708   7.003
  212   HE22  GLN  25          2HE2      GLN  25 -11.635  -7.363   7.411
  213    H    LEU  26           H        LEU  26  -7.678  -3.377   4.834
  214    HA   LEU  26           HA       LEU  26  -5.564  -4.638   3.612
  215    HB2  LEU  26           2HB      LEU  26  -7.266  -3.969   2.211
  216    HB3  LEU  26           1HB      LEU  26  -7.342  -2.356   2.878
  217    HG   LEU  26           HG       LEU  26  -5.172  -1.852   1.695
  218   HD11  LEU  26          1HD1      LEU  26  -4.351  -4.129   1.432
  219   HD12  LEU  26          2HD1      LEU  26  -4.475  -3.317  -0.129
  220   HD13  LEU  26          3HD1      LEU  26  -5.693  -4.504   0.348
  221   HD21  LEU  26          3HD2      LEU  26  -7.506  -2.682  -0.036
  222   HD22  LEU  26          1HD2      LEU  26  -6.213  -1.576  -0.502
  223   HD23  LEU  26          2HD2      LEU  26  -7.323  -1.135   0.793
  224    H    GLU  27           H        GLU  27  -5.495  -1.451   5.143
  225    HA   GLU  27           HA       GLU  27  -3.052  -0.660   3.866
  226    HB2  GLU  27           2HB      GLU  27  -3.108   1.293   5.263
  227    HB3  GLU  27           1HB      GLU  27  -4.729   0.977   4.667
  228    HG2  GLU  27           2HG      GLU  27  -5.301  -0.039   6.845
  229    HG3  GLU  27           1HG      GLU  27  -3.686   0.358   7.429
  230    H    GLU  28           H        GLU  28  -3.743  -2.511   6.753
  231    HA   GLU  28           HA       GLU  28  -1.482  -1.730   8.258
  232    HB2  GLU  28           2HB      GLU  28  -1.976  -3.527   9.752
  233    HB3  GLU  28           1HB      GLU  28  -3.501  -2.857   9.206
  234    HG2  GLU  28           2HG      GLU  28  -3.773  -4.722   7.657
  235    HG3  GLU  28           1HG      GLU  28  -2.226  -5.384   8.176
  236    H    GLN  29           H        GLN  29  -1.874  -4.234   5.796
  237    HA   GLN  29           HA       GLN  29   0.855  -5.177   6.166
  238    HB2  GLN  29           2HB      GLN  29   0.418  -6.582   4.142
  239    HB3  GLN  29           1HB      GLN  29  -0.693  -6.864   5.474
  240    HG2  GLN  29           2HG      GLN  29  -1.484  -4.941   3.335
  241    HG3  GLN  29           1HG      GLN  29  -1.534  -6.669   2.990
  242   HE21  GLN  29          1HE2      GLN  29  -3.798  -6.573   2.795
  243   HE22  GLN  29          2HE2      GLN  29  -4.817  -6.465   4.180
  244    H    LEU  30           H        LEU  30  -0.731  -2.735   4.320
  245    HA   LEU  30           HA       LEU  30   1.392  -2.508   2.340
  246    HB2  LEU  30           2HB      LEU  30  -0.966  -0.697   2.884
  247    HB3  LEU  30           1HB      LEU  30   0.121  -0.577   1.511
  248    HG   LEU  30           HG       LEU  30  -1.836  -2.809   2.086
  249   HD11  LEU  30          1HD1      LEU  30  -2.861  -2.093  -0.018
  250   HD12  LEU  30          2HD1      LEU  30  -1.680  -0.790  -0.153
  251   HD13  LEU  30          3HD1      LEU  30  -2.846  -0.791   1.171
  252   HD21  LEU  30          3HD2      LEU  30   0.171  -2.587  -0.161
  253   HD22  LEU  30          1HD2      LEU  30  -1.088  -3.814  -0.021
  254   HD23  LEU  30          2HD2      LEU  30   0.220  -3.753   1.160
  255    H    ARG  31           H        ARG  31   0.713  -1.254   5.474
  256    HA   ARG  31           HA       ARG  31   3.148   0.383   5.279
  257    HB2  ARG  31           2HB      ARG  31   2.148   2.150   6.671
  258    HB3  ARG  31           1HB      ARG  31   1.317   1.971   5.135
  259    HG2  ARG  31           2HG      ARG  31  -0.570   0.997   6.125
  260    HG3  ARG  31           1HG      ARG  31   0.286   0.633   7.623
  261    HD2  ARG  31           2HD      ARG  31   0.490   3.082   8.034
  262    HD3  ARG  31           1HD      ARG  31  -0.493   3.364   6.599
  263    HE   ARG  31           HE       ARG  31  -2.371   2.583   7.741
  264   HH11  ARG  31          1HH1      ARG  31   0.449   2.311   9.715
  265   HH12  ARG  31          2HH1      ARG  31  -0.468   2.114  11.165
  266   HH21  ARG  31          1HH2      ARG  31  -3.509   2.323   9.614
  267   HH22  ARG  31          2HH2      ARG  31  -2.661   2.133  11.114
  268    HA   PRO  32           HA       PRO  32   3.109  -2.184   9.222
  269    HB2  PRO  32           2HB      PRO  32   4.699  -4.231   8.585
  270    HB3  PRO  32           1HB      PRO  32   2.996  -4.231   8.101
  271    HG2  PRO  32           2HG      PRO  32   5.428  -3.577   6.475
  272    HG3  PRO  32           1HG      PRO  32   4.006  -4.534   6.021
  273    HD2  PRO  32           2HD      PRO  32   4.390  -1.869   5.361
  274    HD3  PRO  32           1HD      PRO  32   2.810  -2.673   5.425
  275    H    LEU  33           H        LEU  33   4.759   0.058   8.063
  276    HA   LEU  33           HA       LEU  33   7.518  -0.527   8.593
  277    HB2  LEU  33           2HB      LEU  33   6.040   2.020   7.937
  278    HB3  LEU  33           1HB      LEU  33   7.763   1.984   8.249
  279    HG   LEU  33           HG       LEU  33   8.054   0.432   6.321
  280   HD11  LEU  33          1HD1      LEU  33   6.244   0.155   4.708
  281   HD12  LEU  33          2HD1      LEU  33   5.136   0.997   5.791
  282   HD13  LEU  33          3HD1      LEU  33   5.824  -0.556   6.264
  283   HD21  LEU  33          3HD2      LEU  33   7.664   2.131   4.571
  284   HD22  LEU  33          1HD2      LEU  33   8.441   2.794   6.008
  285   HD23  LEU  33          2HD2      LEU  33   6.724   3.076   5.726
  286    HA   PRO  34           HA       PRO  34   7.878   0.172  12.920
  287    HB2  PRO  34           2HB      PRO  34  10.201   1.729  12.985
  288    HB3  PRO  34           1HB      PRO  34  10.147  -0.035  12.924
  289    HG2  PRO  34           2HG      PRO  34  10.521   1.931  10.697
  290    HG3  PRO  34           1HG      PRO  34  11.318   0.367  10.955
  291    HD2  PRO  34           2HD      PRO  34   9.357   0.626   9.161
  292    HD3  PRO  34           1HD      PRO  34   9.481  -0.836  10.164
  293    H    ALA  35           H        ALA  35   9.085   3.247  11.512
  294    HA   ALA  35           HA       ALA  35   6.731   4.648  12.534
  295    HB1  ALA  35           3HB      ALA  35   9.522   5.493  13.330
  296    HB2  ALA  35           1HB      ALA  35   8.333   4.744  14.396
  297    HB3  ALA  35           2HB      ALA  35   8.024   6.341  13.717
  298    H    HIS  36           H        HIS  36   6.306   4.860  10.257
  299    HA   HIS  36           HA       HIS  36   7.769   7.086   9.027
  300    HB2  HIS  36           2HB      HIS  36   7.159   4.502   7.563
  301    HB3  HIS  36           1HB      HIS  36   7.890   5.941   6.858
  302    HD1  HIS  36           HD1      HIS  36  10.239   6.645   8.295
  303    HD2  HIS  36           HD2      HIS  36   9.035   2.675   8.245
  304    HE1  HIS  36           HE1      HIS  36  12.289   5.315   8.845
  305    HE2  HIS  36           HE2      HIS  36  11.585   2.921   8.548
  306    H    ASP  37           H        ASP  37   6.612   8.099   7.257
  307    HA   ASP  37           HA       ASP  37   3.854   8.480   7.881
  308    HB2  ASP  37           2HB      ASP  37   5.400  10.283   7.136
  309    HB3  ASP  37           1HB      ASP  37   5.474   9.535   5.545
  310    H    TYR  38           H        TYR  38   2.022   8.138   6.512
  311    HA   TYR  38           HA       TYR  38   2.427   6.137   4.378
  312    HB2  TYR  38           2HB      TYR  38   0.249   5.115   5.047
  313    HB3  TYR  38           1HB      TYR  38   1.518   4.954   6.253
  314    HD1  TYR  38           HD2      TYR  38   1.439   6.364   8.325
  315    HD2  TYR  38           HD1      TYR  38  -1.790   6.276   5.545
  316    HE1  TYR  38           HE2      TYR  38  -0.056   7.301  10.038
  317    HE2  TYR  38           HE1      TYR  38  -3.290   7.212   7.255
  318    HH   TYR  38           HH       TYR  38  -3.416   7.317   9.759
  319    H    PHE  39           H        PHE  39   0.829   6.062   2.704
  320    HA   PHE  39           HA       PHE  39  -0.262   8.733   2.118
  321    HB2  PHE  39           2HB      PHE  39   1.359   7.009   0.627
  322    HB3  PHE  39           1HB      PHE  39  -0.226   6.831  -0.110
  323    HD1  PHE  39           HD2      PHE  39   2.513   9.163   0.617
  324    HD2  PHE  39           HD1      PHE  39  -1.222   8.643  -1.368
  325    HE1  PHE  39           HE2      PHE  39   2.888  11.245  -0.640
  326    HE2  PHE  39           HE1      PHE  39  -0.847  10.719  -2.625
  327    HZ   PHE  39           HZ       PHE  39   1.206  12.025  -2.265
  328    H    GLU  40           H        GLU  40  -2.005   7.891   0.010
  329    HA   GLU  40           HA       GLU  40  -4.336   7.216   1.523
  330    HB2  GLU  40           2HB      GLU  40  -5.538   7.425  -0.596
  331    HB3  GLU  40           1HB      GLU  40  -4.462   8.792  -0.344
  332    HG2  GLU  40           2HG      GLU  40  -2.874   7.908  -1.928
  333    HG3  GLU  40           1HG      GLU  40  -3.805   6.419  -2.090
  334    H    PHE  41           H        PHE  41  -5.548   5.374   1.515
  335    HA   PHE  41           HA       PHE  41  -4.603   3.079  -0.086
  336    HB2  PHE  41           2HB      PHE  41  -5.692   2.979   2.745
  337    HB3  PHE  41           1HB      PHE  41  -5.252   1.580   1.767
  338    HD1  PHE  41           HD1      PHE  41  -2.846   1.257   1.105
  339    HD2  PHE  41           HD2      PHE  41  -4.065   4.175   3.963
  340    HE1  PHE  41           HE1      PHE  41  -0.528   1.425   1.927
  341    HE2  PHE  41           HE2      PHE  41  -1.752   4.339   4.788
  342    HZ   PHE  41           HZ       PHE  41   0.017   2.967   3.768
  343    H    PHE  42           H        PHE  42  -6.089   2.479  -1.508
  344    HA   PHE  42           HA       PHE  42  -8.577   3.721  -1.736
  345    HB2  PHE  42           2HB      PHE  42  -8.998   2.196  -3.585
  346    HB3  PHE  42           1HB      PHE  42  -7.338   2.774  -3.635
  347    HD1  PHE  42           HD2      PHE  42  -5.484   1.244  -2.891
  348    HD2  PHE  42           HD1      PHE  42  -9.491  -0.119  -3.423
  349    HE1  PHE  42           HE2      PHE  42  -4.682  -1.076  -2.998
  350    HE2  PHE  42           HE1      PHE  42  -8.689  -2.441  -3.529
  351    HZ   PHE  42           HZ       PHE  42  -6.281  -2.920  -3.318
  352    H    ALA  43           H        ALA  43 -10.671   3.114  -1.374
  353    HA   ALA  43           HA       ALA  43 -11.112   0.668   0.226
  354    HB1  ALA  43           3HB      ALA  43 -11.563   2.702   1.496
  355    HB2  ALA  43           1HB      ALA  43 -13.053   1.801   1.211
  356    HB3  ALA  43           2HB      ALA  43 -12.696   3.240   0.255
  357    H    ALA  44           H        ALA  44 -11.651  -0.803  -1.310
  358    HA   ALA  44           HA       ALA  44 -14.151  -0.348  -2.790
  359    HB1  ALA  44           3HB      ALA  44 -12.341   0.068  -4.375
  360    HB2  ALA  44           1HB      ALA  44 -13.215  -1.405  -4.797
  361    HB3  ALA  44           2HB      ALA  44 -11.640  -1.509  -4.010
  362    H    ASP  45           H        ASP  45 -15.535  -1.874  -2.151
  363    HA   ASP  45           HA       ASP  45 -14.901  -3.964  -0.440
  364    HB2  ASP  45           2HB      ASP  45 -17.325  -3.786  -2.240
  365    HB3  ASP  45           1HB      ASP  45 -17.186  -4.751  -0.775
  366    H    LEU  46           H        LEU  46 -14.807  -6.173  -0.599
  367    HA   LEU  46           HA       LEU  46 -13.729  -7.336  -2.979
  368    HB2  LEU  46           2HB      LEU  46 -13.871  -9.468  -1.553
  369    HB3  LEU  46           1HB      LEU  46 -12.823  -8.173  -1.008
  370    HG   LEU  46           HG       LEU  46 -14.720  -7.452   0.535
  371   HD11  LEU  46          1HD1      LEU  46 -15.785 -10.186  -0.158
  372   HD12  LEU  46          2HD1      LEU  46 -16.553  -8.639  -0.520
  373   HD13  LEU  46          3HD1      LEU  46 -16.358  -9.155   1.153
  374   HD21  LEU  46          3HD2      LEU  46 -14.153  -9.102   2.236
  375   HD22  LEU  46          1HD2      LEU  46 -12.723  -8.591   1.338
  376   HD23  LEU  46          2HD2      LEU  46 -13.466 -10.155   0.998
  377    H    SER  47           H        SER  47 -16.564  -6.374  -3.113
  378    HA   SER  47           HA       SER  47 -18.131  -8.808  -3.427
  379    HB2  SER  47           2HB      SER  47 -19.264  -6.948  -2.378
  380    HB3  SER  47           1HB      SER  47 -18.873  -5.888  -3.731
  381    HG   SER  47           HG       SER  47 -20.973  -7.519  -3.432
  382    H    LEU  48           H        LEU  48 -19.651  -8.796  -5.416
  383    HA   LEU  48           HA       LEU  48 -17.954  -8.933  -7.752
  384    HB2  LEU  48           2HB      LEU  48 -19.618 -10.684  -7.179
  385    HB3  LEU  48           1HB      LEU  48 -20.903  -9.527  -7.461
  386    HG   LEU  48           HG       LEU  48 -20.225  -9.362  -9.833
  387   HD11  LEU  48          1HD1      LEU  48 -18.638 -10.994 -10.756
  388   HD12  LEU  48          2HD1      LEU  48 -18.247 -11.528  -9.121
  389   HD13  LEU  48          3HD1      LEU  48 -17.868  -9.882  -9.626
  390   HD21  LEU  48          3HD2      LEU  48 -20.761 -12.183  -8.896
  391   HD22  LEU  48          1HD2      LEU  48 -21.028 -11.563 -10.525
  392   HD23  LEU  48          2HD2      LEU  48 -21.974 -10.934  -9.177
  393    H    TYR  49           H        TYR  49 -20.042  -6.580  -6.416
  394    HA   TYR  49           HA       TYR  49 -21.120  -5.282  -8.618
  395    HB2  TYR  49           2HB      TYR  49 -20.045  -4.136  -6.033
  396    HB3  TYR  49           1HB      TYR  49 -20.901  -3.166  -7.226
  397    HD1  TYR  49           HD2      TYR  49 -23.294  -3.940  -7.864
  398    HD2  TYR  49           HD1      TYR  49 -21.252  -5.276  -4.372
  399    HE1  TYR  49           HE2      TYR  49 -25.443  -4.571  -6.852
  400    HE2  TYR  49           HE1      TYR  49 -23.398  -5.909  -3.354
  401    HH   TYR  49           HH       TYR  49 -25.774  -5.327  -3.550
  402    HA   PRO  50           HA       PRO  50 -17.725  -3.875 -11.084
  403    HB2  PRO  50           2HB      PRO  50 -19.363  -1.434 -11.574
  404    HB3  PRO  50           1HB      PRO  50 -18.662  -2.573 -12.731
  405    HG2  PRO  50           2HG      PRO  50 -21.276  -2.592 -12.222
  406    HG3  PRO  50           1HG      PRO  50 -20.389  -4.111 -12.454
  407    HD2  PRO  50           2HD      PRO  50 -21.322  -2.829  -9.906
  408    HD3  PRO  50           1HD      PRO  50 -21.333  -4.543 -10.374
  409    H    HIS  51           H        HIS  51 -16.003  -3.323  -9.799
  410    HA   HIS  51           HA       HIS  51 -15.968  -0.643  -8.567
  411    HB2  HIS  51           2HB      HIS  51 -14.113  -3.006  -8.167
  412    HB3  HIS  51           1HB      HIS  51 -13.948  -1.448  -7.363
  413    HD1  HIS  51           HD1      HIS  51 -15.897  -4.610  -7.295
  414    HD2  HIS  51           HD2      HIS  51 -15.868  -0.945  -5.337
  415    HE1  HIS  51           HE1      HIS  51 -17.340  -4.921  -5.266
  416    HE2  HIS  51           HE2      HIS  51 -17.481  -2.635  -4.229
  417    H    LEU  52           H        LEU  52 -13.815   0.508  -8.681
  418    HA   LEU  52           HA       LEU  52 -12.928   0.538 -11.476
  419    HB2  LEU  52           2HB      LEU  52 -12.575   2.524  -9.224
  420    HB3  LEU  52           1HB      LEU  52 -11.830   2.708 -10.799
  421    HG   LEU  52           HG       LEU  52 -14.134   2.724 -11.811
  422   HD11  LEU  52          1HD1      LEU  52 -15.360   1.609 -10.029
  423   HD12  LEU  52          2HD1      LEU  52 -16.039   3.202 -10.354
  424   HD13  LEU  52          3HD1      LEU  52 -15.022   2.951  -8.935
  425   HD21  LEU  52          3HD2      LEU  52 -14.602   5.036 -11.189
  426   HD22  LEU  52          1HD2      LEU  52 -12.875   4.783 -11.426
  427   HD23  LEU  52          2HD2      LEU  52 -13.536   4.890  -9.792
  428    H    TYR  53           H        TYR  53 -10.606   0.935 -11.924
  429    HA   TYR  53           HA       TYR  53  -8.973  -0.945 -10.465
  430    HB2  TYR  53           2HB      TYR  53  -8.275   0.853 -12.802
  431    HB3  TYR  53           1HB      TYR  53  -7.252  -0.432 -12.167
  432    HD1  TYR  53           HD2      TYR  53 -10.416   0.287 -13.935
  433    HD2  TYR  53           HD1      TYR  53  -7.668  -2.731 -12.728
  434    HE1  TYR  53           HE2      TYR  53 -11.543  -1.318 -15.413
  435    HE2  TYR  53           HE1      TYR  53  -8.789  -4.347 -14.203
  436    HH   TYR  53           HH       TYR  53 -11.088  -3.392 -16.563
  437    H    SER  54           H        SER  54  -8.771  -0.024  -8.428
  438    HA   SER  54           HA       SER  54  -7.566   2.610  -8.125
  439    HB2  SER  54           2HB      SER  54  -8.409   0.620  -5.999
  440    HB3  SER  54           1HB      SER  54  -7.981   2.310  -5.735
  441    HG   SER  54           HG       SER  54  -9.933   2.849  -6.282
  442    H    ARG  55           H        ARG  55  -5.877   2.682  -6.170
  443    HA   ARG  55           HA       ARG  55  -3.992   0.500  -6.120
  444    HB2  ARG  55           2HB      ARG  55  -2.086   1.695  -7.055
  445    HB3  ARG  55           1HB      ARG  55  -3.364   1.557  -8.248
  446    HG2  ARG  55           2HG      ARG  55  -2.804   4.040  -6.624
  447    HG3  ARG  55           1HG      ARG  55  -2.200   3.749  -8.253
  448    HD2  ARG  55           2HD      ARG  55  -4.659   3.445  -8.914
  449    HD3  ARG  55           1HD      ARG  55  -5.041   4.177  -7.356
  450    HE   ARG  55           HE       ARG  55  -3.507   5.506  -9.498
  451   HH11  ARG  55          1HH1      ARG  55  -5.631   5.673  -6.789
  452   HH12  ARG  55          2HH1      ARG  55  -5.911   7.366  -6.975
  453   HH21  ARG  55          1HH2      ARG  55  -3.889   7.680  -9.735
  454   HH22  ARG  55          2HH2      ARG  55  -4.942   8.488  -8.627
  455    H    ALA  56           H        ALA  56  -1.854   1.351  -4.933
  456    HA   ALA  56           HA       ALA  56  -2.611   3.282  -2.841
  457    HB1  ALA  56           3HB      ALA  56  -1.756   1.813  -1.089
  458    HB2  ALA  56           1HB      ALA  56  -1.407   0.566  -2.289
  459    HB3  ALA  56           2HB      ALA  56  -3.075   1.039  -1.969
  460    H    TYR  57           H        TYR  57  -0.756   4.060  -1.561
  461    HA   TYR  57           HA       TYR  57   1.784   3.997  -3.071
  462    HB2  TYR  57           2HB      TYR  57   0.463   6.464  -1.905
  463    HB3  TYR  57           1HB      TYR  57   2.034   6.420  -2.696
  464    HD1  TYR  57           HD1      TYR  57  -1.613   6.107  -3.233
  465    HD2  TYR  57           HD2      TYR  57   2.209   6.408  -5.088
  466    HE1  TYR  57           HE1      TYR  57  -2.702   6.506  -5.401
  467    HE2  TYR  57           HE2      TYR  57   1.127   6.802  -7.256
  468    HH   TYR  57           HH       TYR  57  -0.972   6.421  -8.357
  469    H    ILE  58           H        ILE  58   3.675   4.116  -1.858
  470    HA   ILE  58           HA       ILE  58   3.334   4.058   1.085
  471    HB   ILE  58           HB       ILE  58   5.419   2.542  -0.508
  472   HG12  ILE  58          2HG1      ILE  58   2.964   1.498   0.941
  473   HG13  ILE  58          1HG1      ILE  58   3.132   1.615  -0.807
  474   HG21  ILE  58          1HG2      ILE  58   6.185   3.222   1.719
  475   HG22  ILE  58          2HG2      ILE  58   5.967   1.475   1.628
  476   HG23  ILE  58          3HG2      ILE  58   4.763   2.472   2.445
  477   HD11  ILE  58          3HD1      ILE  58   4.975   0.007  -0.726
  478   HD12  ILE  58          1HD1      ILE  58   3.484  -0.653  -0.055
  479   HD13  ILE  58          2HD1      ILE  58   4.775  -0.124   1.022
  480    H    ASN  59           H        ASN  59   4.188   5.836   1.987
  481    HA   ASN  59           HA       ASN  59   6.273   7.318   0.578
  482    HB2  ASN  59           2HB      ASN  59   4.277   8.519   1.430
  483    HB3  ASN  59           1HB      ASN  59   4.731   8.075   3.071
  484   HD21  ASN  59          1HD2      ASN  59   4.932  10.212   3.690
  485   HD22  ASN  59          2HD2      ASN  59   6.242  11.206   3.171
  486    H    PHE  60           H        PHE  60   8.053   5.959   0.952
  487    HA   PHE  60           HA       PHE  60   8.971   5.182   3.506
  488    HB2  PHE  60           2HB      PHE  60  10.266   5.415   0.808
  489    HB3  PHE  60           1HB      PHE  60  11.251   5.072   2.226
  490    HD1  PHE  60           HD1      PHE  60  10.869   3.041   3.537
  491    HD2  PHE  60           HD2      PHE  60   8.852   3.720  -0.146
  492    HE1  PHE  60           HE1      PHE  60  10.304   0.664   3.427
  493    HE2  PHE  60           HE2      PHE  60   8.276   1.329  -0.273
  494    HZ   PHE  60           HZ       PHE  60   8.999  -0.205   1.516
  495    H    ARG  61           H        ARG  61  10.774   5.999   4.742
  496    HA   ARG  61           HA       ARG  61  11.201   8.911   4.399
  497    HB2  ARG  61           2HB      ARG  61  10.776   7.445   7.012
  498    HB3  ARG  61           1HB      ARG  61  11.102   9.163   6.842
  499    HG2  ARG  61           2HG      ARG  61   8.691   7.878   5.585
  500    HG3  ARG  61           1HG      ARG  61   8.686   8.422   7.261
  501    HD2  ARG  61           2HD      ARG  61   7.737  10.159   5.933
  502    HD3  ARG  61           1HD      ARG  61   9.333  10.697   6.447
  503    HE   ARG  61           HE       ARG  61   9.655   9.546   3.950
  504   HH11  ARG  61          1HH1      ARG  61   7.856  12.168   5.275
  505   HH12  ARG  61          2HH1      ARG  61   7.972  13.113   3.829
  506   HH21  ARG  61          1HH2      ARG  61   9.790  10.769   2.101
  507   HH22  ARG  61          2HH2      ARG  61   9.038  12.329   2.062
  508    H    ASN  62           H        ASN  62  12.835   6.180   4.090
  509    HA   ASN  62           HA       ASN  62  15.365   7.373   4.771
  510    HB2  ASN  62           2HB      ASN  62  14.519   6.372   6.953
  511    HB3  ASN  62           1HB      ASN  62  14.665   4.798   6.196
  512   HD21  ASN  62          1HD2      ASN  62  16.643   3.865   6.014
  513   HD22  ASN  62          2HD2      ASN  62  18.101   4.559   6.616
  514    HA   PRO  63           HA       PRO  63  16.529   5.009   1.173
  515    HB2  PRO  63           2HB      PRO  63  19.244   4.757   1.743
  516    HB3  PRO  63           1HB      PRO  63  18.493   6.149   0.960
  517    HG2  PRO  63           2HG      PRO  63  19.236   5.764   3.833
  518    HG3  PRO  63           1HG      PRO  63  19.413   7.204   2.813
  519    HD2  PRO  63           2HD      PRO  63  17.434   7.016   4.602
  520    HD3  PRO  63           1HD      PRO  63  17.157   7.772   3.016
  521    H    ASP  64           H        ASP  64  18.068   3.909   4.213
  522    HA   ASP  64           HA       ASP  64  18.410   1.214   3.468
  523    HB2  ASP  64           2HB      ASP  64  17.934   2.255   6.269
  524    HB3  ASP  64           1HB      ASP  64  18.805   0.794   5.809
  525    H    ASP  65           H        ASP  65  15.723   2.923   4.934
  526    HA   ASP  65           HA       ASP  65  14.131   0.744   5.724
  527    HB2  ASP  65           2HB      ASP  65  13.899   3.125   6.456
  528    HB3  ASP  65           1HB      ASP  65  13.273   3.524   4.864
  529    H    ILE  66           H        ILE  66  14.393   2.547   2.697
  530    HA   ILE  66           HA       ILE  66  12.259   1.436   1.271
  531    HB   ILE  66           HB       ILE  66  14.940   2.333   0.179
  532   HG12  ILE  66          2HG1      ILE  66  12.345   3.875   0.500
  533   HG13  ILE  66          1HG1      ILE  66  13.771   4.067   1.513
  534   HG21  ILE  66          1HG2      ILE  66  13.704   2.695  -1.936
  535   HG22  ILE  66          2HG2      ILE  66  12.284   1.939  -1.214
  536   HG23  ILE  66          3HG2      ILE  66  13.755   0.998  -1.459
  537   HD11  ILE  66          3HD1      ILE  66  13.628   5.843  -0.118
  538   HD12  ILE  66          1HD1      ILE  66  13.585   4.667  -1.431
  539   HD13  ILE  66          2HD1      ILE  66  15.037   4.832  -0.441
  540    H    LEU  67           H        LEU  67  15.713   0.434   1.081
  541    HA   LEU  67           HA       LEU  67  15.168  -1.849  -0.498
  542    HB2  LEU  67           2HB      LEU  67  17.494  -2.539   0.032
  543    HB3  LEU  67           1HB      LEU  67  17.351  -0.908  -0.586
  544    HG   LEU  67           HG       LEU  67  17.446  -0.203   1.930
  545   HD11  LEU  67          1HD1      LEU  67  17.242  -2.429   2.900
  546   HD12  LEU  67          2HD1      LEU  67  18.781  -1.692   3.336
  547   HD13  LEU  67          3HD1      LEU  67  18.724  -2.934   2.087
  548   HD21  LEU  67          3HD2      LEU  67  19.155   0.353   0.300
  549   HD22  LEU  67          1HD2      LEU  67  19.871  -1.250   0.469
  550   HD23  LEU  67          2HD2      LEU  67  19.899  -0.124   1.826
  551    H    LEU  68           H        LEU  68  15.304  -1.381   2.972
  552    HA   LEU  68           HA       LEU  68  15.406  -4.003   3.897
  553    HB2  LEU  68           2HB      LEU  68  15.544  -2.243   5.475
  554    HB3  LEU  68           1HB      LEU  68  14.035  -1.530   4.941
  555    HG   LEU  68           HG       LEU  68  12.790  -3.424   5.916
  556   HD11  LEU  68          1HD1      LEU  68  15.494  -4.326   6.926
  557   HD12  LEU  68          2HD1      LEU  68  14.477  -5.166   5.754
  558   HD13  LEU  68          3HD1      LEU  68  13.937  -4.992   7.423
  559   HD21  LEU  68          3HD2      LEU  68  14.661  -2.034   7.845
  560   HD22  LEU  68          1HD2      LEU  68  13.138  -2.820   8.267
  561   HD23  LEU  68          2HD2      LEU  68  13.135  -1.398   7.227
  562    H    PHE  69           H        PHE  69  12.433  -2.082   3.367
  563    HA   PHE  69           HA       PHE  69  10.752  -4.382   3.619
  564    HB2  PHE  69           2HB      PHE  69  10.308  -1.493   2.972
  565    HB3  PHE  69           1HB      PHE  69   8.998  -2.650   2.739
  566    HD1  PHE  69           HD1      PHE  69  11.140  -0.981   5.215
  567    HD2  PHE  69           HD2      PHE  69   7.944  -3.728   4.617
  568    HE1  PHE  69           HE1      PHE  69  10.604  -0.878   7.611
  569    HE2  PHE  69           HE2      PHE  69   7.401  -3.627   7.012
  570    HZ   PHE  69           HZ       PHE  69   8.735  -2.200   8.515
  571    H    ARG  70           H        ARG  70  12.046  -2.589   0.853
  572    HA   ARG  70           HA       ARG  70  10.491  -3.689  -1.177
  573    HB2  ARG  70           2HB      ARG  70  12.158  -1.858  -1.460
  574    HB3  ARG  70           1HB      ARG  70  13.448  -3.040  -1.322
  575    HG2  ARG  70           2HG      ARG  70  11.358  -3.337  -3.452
  576    HG3  ARG  70           1HG      ARG  70  12.692  -2.206  -3.665
  577    HD2  ARG  70           2HD      ARG  70  12.971  -5.171  -3.133
  578    HD3  ARG  70           1HD      ARG  70  13.154  -4.387  -4.702
  579    HE   ARG  70           HE       ARG  70  14.981  -3.076  -3.311
  580   HH11  ARG  70          1HH1      ARG  70  14.306  -6.450  -3.403
  581   HH12  ARG  70          2HH1      ARG  70  15.936  -6.902  -3.051
  582   HH21  ARG  70          1HH2      ARG  70  17.071  -3.653  -2.886
  583   HH22  ARG  70          2HH2      ARG  70  17.497  -5.325  -2.757
  584    H    ASP  71           H        ASP  71  13.411  -4.994   0.351
  585    HA   ASP  71           HA       ASP  71  13.732  -7.263  -1.280
  586    HB2  ASP  71           2HB      ASP  71  15.536  -6.473   0.099
  587    HB3  ASP  71           1HB      ASP  71  14.585  -6.692   1.564
  588    H    ARG  72           H        ARG  72  11.429  -6.652   1.227
  589    HA   ARG  72           HA       ARG  72  10.695  -9.518   1.281
  590    HB2  ARG  72           2HB      ARG  72   9.729  -9.065   3.552
  591    HB3  ARG  72           1HB      ARG  72  11.479  -8.920   3.461
  592    HG2  ARG  72           2HG      ARG  72  11.291  -6.490   3.368
  593    HG3  ARG  72           1HG      ARG  72   9.532  -6.616   3.419
  594    HD2  ARG  72           2HD      ARG  72  11.380  -7.630   5.584
  595    HD3  ARG  72           1HD      ARG  72  10.582  -6.057   5.612
  596    HE   ARG  72           HE       ARG  72   8.618  -8.012   5.254
  597   HH11  ARG  72          1HH1      ARG  72  10.885  -7.061   7.669
  598   HH12  ARG  72          2HH1      ARG  72   9.883  -7.584   8.977
  599   HH21  ARG  72          1HH2      ARG  72   7.341  -8.688   6.936
  600   HH22  ARG  72          2HH2      ARG  72   7.886  -8.478   8.565
  601    H    PHE  73           H        PHE  73   9.748  -6.871  -0.213
  602    HA   PHE  73           HA       PHE  73   6.914  -7.629  -0.148
  603    HB2  PHE  73           2HB      PHE  73   8.008  -4.906   0.473
  604    HB3  PHE  73           1HB      PHE  73   6.434  -5.073  -0.287
  605    HD1  PHE  73           HD1      PHE  73   4.625  -6.335   0.908
  606    HD2  PHE  73           HD2      PHE  73   8.299  -5.313   2.799
  607    HE1  PHE  73           HE1      PHE  73   3.595  -6.728   3.105
  608    HE2  PHE  73           HE2      PHE  73   7.275  -5.706   5.000
  609    HZ   PHE  73           HZ       PHE  73   4.921  -6.414   5.155
  610    H    ASP  74           H        ASP  74   9.410  -7.487  -2.045
  611    HA   ASP  74           HA       ASP  74   8.610  -5.848  -4.228
  612    HB2  ASP  74           2HB      ASP  74  10.387  -6.948  -5.485
  613    HB3  ASP  74           1HB      ASP  74  10.949  -6.535  -3.869
  614    H    GLY  75           H        GLY  75   6.826  -8.225  -3.145
  615    HA2  GLY  75           2HA      GLY  75   5.062  -8.563  -5.101
  616    HA3  GLY  75           1HA      GLY  75   6.323  -9.668  -5.628
  617    H    TYR  76           H        TYR  76   4.091  -8.957  -2.951
  618    HA   TYR  76           HA       TYR  76   4.318 -11.793  -2.145
  619    HB2  TYR  76           2HB      TYR  76   3.833 -11.230   0.086
  620    HB3  TYR  76           1HB      TYR  76   4.955  -9.988  -0.448
  621    HD1  TYR  76           HD1      TYR  76   4.047  -7.679  -1.003
  622    HD2  TYR  76           HD2      TYR  76   1.665 -10.678   0.863
  623    HE1  TYR  76           HE1      TYR  76   2.456  -5.955  -0.254
  624    HE2  TYR  76           HE2      TYR  76   0.077  -8.958   1.607
  625    HH   TYR  76           HH       TYR  76   0.123  -5.776   0.413
  626    H    ILE  77           H        ILE  77   2.360 -12.857  -1.382
  627    HA   ILE  77           HA       ILE  77  -0.053 -11.901  -2.803
  628    HB   ILE  77           HB       ILE  77   0.751 -14.731  -2.079
  629   HG12  ILE  77          2HG1      ILE  77   1.992 -13.751  -3.997
  630   HG13  ILE  77          1HG1      ILE  77   0.968 -15.101  -4.474
  631   HG21  ILE  77          1HG2      ILE  77  -1.655 -14.494  -1.899
  632   HG22  ILE  77          2HG2      ILE  77  -1.253 -15.431  -3.336
  633   HG23  ILE  77          3HG2      ILE  77  -1.729 -13.740  -3.492
  634   HD11  ILE  77          3HD1      ILE  77   0.878 -13.307  -6.099
  635   HD12  ILE  77          1HD1      ILE  77   0.339 -12.180  -4.854
  636   HD13  ILE  77          2HD1      ILE  77  -0.694 -13.529  -5.331
  637    H    PHE  78           H        PHE  78  -1.392 -10.932  -1.365
  638    HA   PHE  78           HA       PHE  78  -1.653 -11.978   1.354
  639    HB2  PHE  78           2HB      PHE  78  -1.508  -9.525   0.998
  640    HB3  PHE  78           1HB      PHE  78  -3.006  -9.579   0.075
  641    HD1  PHE  78           HD1      PHE  78  -1.536 -10.062   3.433
  642    HD2  PHE  78           HD2      PHE  78  -5.123  -9.629   1.171
  643    HE1  PHE  78           HE1      PHE  78  -2.815  -9.796   5.518
  644    HE2  PHE  78           HE2      PHE  78  -6.404  -9.362   3.252
  645    HZ   PHE  78           HZ       PHE  78  -5.254  -9.441   5.427
  646    H    LEU  79           H        LEU  79  -3.137 -13.464   1.846
  647    HA   LEU  79           HA       LEU  79  -5.325 -14.030   0.009
  648    HB2  LEU  79           2HB      LEU  79  -4.268 -15.430   2.461
  649    HB3  LEU  79           1HB      LEU  79  -5.726 -15.949   1.634
  650    HG   LEU  79           HG       LEU  79  -3.067 -15.724   0.221
  651   HD11  LEU  79          1HD1      LEU  79  -2.838 -17.317   2.071
  652   HD12  LEU  79          2HD1      LEU  79  -2.824 -18.136   0.511
  653   HD13  LEU  79          3HD1      LEU  79  -4.275 -18.175   1.513
  654   HD21  LEU  79          3HD2      LEU  79  -4.129 -17.216  -1.397
  655   HD22  LEU  79          1HD2      LEU  79  -5.044 -15.722  -1.208
  656   HD23  LEU  79          2HD2      LEU  79  -5.612 -17.207  -0.442
  657    H    ASP  80           H        ASP  80  -7.185 -13.028   0.198
  658    HA   ASP  80           HA       ASP  80  -8.068 -11.512   2.403
  659    HB2  ASP  80           2HB      ASP  80  -8.748 -11.261  -0.011
  660    HB3  ASP  80           1HB      ASP  80  -9.756 -12.687   0.180
  661    H    SER  81           H        SER  81 -10.256 -11.890   3.491
  662    HA   SER  81           HA       SER  81 -10.375 -14.312   4.919
  663    HB2  SER  81           2HB      SER  81 -12.595 -12.300   4.418
  664    HB3  SER  81           1HB      SER  81 -12.612 -13.548   5.664
  665    HG   SER  81           HG       SER  81 -11.217 -11.142   5.559
  666    H    LYS  82           H        LYS  82 -11.789 -13.331   1.878
  667    HA   LYS  82           HA       LYS  82 -13.459 -15.668   1.575
  668    HB2  LYS  82           2HB      LYS  82 -12.563 -13.640  -0.489
  669    HB3  LYS  82           1HB      LYS  82 -13.830 -14.839  -0.711
  670    HG2  LYS  82           2HG      LYS  82 -13.887 -12.558   1.266
  671    HG3  LYS  82           1HG      LYS  82 -14.735 -12.613  -0.279
  672    HD2  LYS  82           2HD      LYS  82 -15.962 -14.632   0.537
  673    HD3  LYS  82           1HD      LYS  82 -15.196 -14.400   2.112
  674    HE2  LYS  82           2HE      LYS  82 -17.399 -13.433   2.168
  675    HE3  LYS  82           1HE      LYS  82 -16.206 -12.138   2.221
  676    HZ1  LYS  82           3HZ      LYS  82 -16.554 -11.885  -0.223
  677    HZ2  LYS  82           1HZ      LYS  82 -17.915 -11.511   0.714
  678    HZ3  LYS  82           2HZ      LYS  82 -17.835 -12.981  -0.113
  679    H    GLY  83           H        GLY  83 -10.166 -15.200   1.399
  680    HA2  GLY  83           2HA      GLY  83  -8.543 -16.782   0.809
  681    HA3  GLY  83           1HA      GLY  83  -9.749 -17.655  -0.122
  682    H    LEU  84           H        LEU  84  -9.794 -14.350  -0.822
  683    HA   LEU  84           HA       LEU  84  -8.942 -14.773  -3.508
  684    HB2  LEU  84           2HB      LEU  84  -9.472 -12.184  -2.038
  685    HB3  LEU  84           1HB      LEU  84  -9.287 -12.345  -3.774
  686    HG   LEU  84           HG       LEU  84 -11.508 -13.583  -2.133
  687   HD11  LEU  84          1HD1      LEU  84 -12.955 -11.949  -3.236
  688   HD12  LEU  84          2HD1      LEU  84 -11.552 -11.229  -4.025
  689   HD13  LEU  84          3HD1      LEU  84 -11.710 -11.154  -2.270
  690   HD21  LEU  84          3HD2      LEU  84 -10.974 -14.945  -4.075
  691   HD22  LEU  84          1HD2      LEU  84 -11.062 -13.526  -5.121
  692   HD23  LEU  84          2HD2      LEU  84 -12.513 -14.117  -4.312
  693    H    GLU  85           H        GLU  85  -6.946 -14.765  -4.290
  694    HA   GLU  85           HA       GLU  85  -4.663 -13.993  -2.724
  695    HB2  GLU  85           2HB      GLU  85  -4.777 -14.767  -5.649
  696    HB3  GLU  85           1HB      GLU  85  -3.356 -14.781  -4.613
  697    HG2  GLU  85           2HG      GLU  85  -4.255 -16.588  -3.310
  698    HG3  GLU  85           1HG      GLU  85  -5.780 -16.514  -4.191
  699    H    TYR  86           H        TYR  86  -4.306 -11.839  -2.449
  700    HA   TYR  86           HA       TYR  86  -4.518 -10.034  -4.762
  701    HB2  TYR  86           2HB      TYR  86  -3.968  -9.344  -1.867
  702    HB3  TYR  86           1HB      TYR  86  -4.288  -8.204  -3.169
  703    HD1  TYR  86           HD1      TYR  86  -6.608  -9.155  -4.527
  704    HD2  TYR  86           HD2      TYR  86  -5.710  -9.368  -0.372
  705    HE1  TYR  86           HE1      TYR  86  -9.011  -9.261  -4.018
  706    HE2  TYR  86           HE2      TYR  86  -8.103  -9.473   0.145
  707    HH   TYR  86           HH       TYR  86 -10.199  -9.134  -0.709
  708    HA   PRO  87           HA       PRO  87   0.029 -10.355  -4.918
  709    HB2  PRO  87           2HB      PRO  87   0.305  -9.493  -7.460
  710    HB3  PRO  87           1HB      PRO  87  -0.206 -11.143  -7.083
  711    HG2  PRO  87           2HG      PRO  87  -1.866  -8.787  -7.908
  712    HG3  PRO  87           1HG      PRO  87  -1.982 -10.476  -8.434
  713    HD2  PRO  87           2HD      PRO  87  -3.608  -9.356  -6.524
  714    HD3  PRO  87           1HD      PRO  87  -3.229 -11.088  -6.606
  715    H    ALA  88           H        ALA  88   1.529  -8.757  -4.509
  716    HA   ALA  88           HA       ALA  88   0.884  -5.977  -5.155
  717    HB1  ALA  88           3HB      ALA  88   1.470  -6.859  -2.328
  718    HB2  ALA  88           1HB      ALA  88  -0.105  -6.361  -2.945
  719    HB3  ALA  88           2HB      ALA  88   1.221  -5.203  -2.877
  720    H    VAL  89           H        VAL  89   2.607  -5.145  -6.095
  721    HA   VAL  89           HA       VAL  89   5.302  -6.056  -5.285
  722    HB   VAL  89           HB       VAL  89   4.417  -4.987  -7.980
  723   HG11  VAL  89          1HG1      VAL  89   7.112  -6.056  -7.116
  724   HG12  VAL  89          2HG1      VAL  89   6.734  -4.367  -7.456
  725   HG13  VAL  89          3HG1      VAL  89   6.671  -5.563  -8.752
  726   HG21  VAL  89          3HG2      VAL  89   3.579  -7.249  -7.576
  727   HG22  VAL  89          1HG2      VAL  89   5.204  -7.790  -7.154
  728   HG23  VAL  89          2HG2      VAL  89   4.849  -7.267  -8.799
  729    H    VAL  90           H        VAL  90   6.388  -4.564  -4.153
  730    HA   VAL  90           HA       VAL  90   5.698  -1.759  -4.239
  731    HB   VAL  90           HB       VAL  90   6.406  -2.906  -2.141
  732   HG11  VAL  90          1HG1      VAL  90   9.169  -2.888  -3.359
  733   HG12  VAL  90          2HG1      VAL  90   8.173  -4.320  -3.107
  734   HG13  VAL  90          3HG1      VAL  90   8.747  -3.394  -1.721
  735   HG21  VAL  90          3HG2      VAL  90   8.137  -0.575  -2.969
  736   HG22  VAL  90          1HG2      VAL  90   7.844  -1.098  -1.309
  737   HG23  VAL  90          2HG2      VAL  90   6.512  -0.483  -2.288
  738    H    GLU  91           H        GLU  91   6.762  -0.121  -5.336
  739    HA   GLU  91           HA       GLU  91   9.379  -0.541  -6.504
  740    HB2  GLU  91           2HB      GLU  91   8.662  -0.251  -8.836
  741    HB3  GLU  91           1HB      GLU  91   7.991  -1.711  -8.122
  742    HG2  GLU  91           2HG      GLU  91   5.858  -0.541  -7.765
  743    HG3  GLU  91           1HG      GLU  91   6.532   0.895  -8.532
  744    H    PHE  92           H        PHE  92  10.342   1.314  -7.377
  745    HA   PHE  92           HA       PHE  92   9.389   3.799  -6.255
  746    HB2  PHE  92           2HB      PHE  92  11.731   3.326  -6.088
  747    HB3  PHE  92           1HB      PHE  92  11.860   3.025  -7.815
  748    HD1  PHE  92           HD2      PHE  92  10.746   5.802  -5.553
  749    HD2  PHE  92           HD1      PHE  92  12.905   4.664  -9.048
  750    HE1  PHE  92           HE2      PHE  92  11.426   8.142  -5.898
  751    HE2  PHE  92           HE1      PHE  92  13.584   7.002  -9.391
  752    HZ   PHE  92           HZ       PHE  92  12.847   8.744  -7.815
  753    H    ALA  93           H        ALA  93   8.830   5.690  -7.360
  754    HA   ALA  93           HA       ALA  93   7.733   5.389 -10.018
  755    HB1  ALA  93           3HB      ALA  93   6.575   6.727  -8.323
  756    HB2  ALA  93           1HB      ALA  93   6.976   7.696  -9.741
  757    HB3  ALA  93           2HB      ALA  93   7.936   7.847  -8.269
  758    HA   PRO  94           HA       PRO  94  11.667   6.071 -12.028
  759    HB2  PRO  94           2HB      PRO  94  10.537   6.954 -14.458
  760    HB3  PRO  94           1HB      PRO  94  10.959   5.293 -14.030
  761    HG2  PRO  94           2HG      PRO  94   8.313   6.674 -13.891
  762    HG3  PRO  94           1HG      PRO  94   8.683   4.994 -14.325
  763    HD2  PRO  94           2HD      PRO  94   7.660   5.587 -11.932
  764    HD3  PRO  94           1HD      PRO  94   8.919   4.340 -12.093
  765    H    PHE  95           H        PHE  95  13.003   7.736 -11.824
  766    HA   PHE  95           HA       PHE  95  12.011  10.496 -11.904
  767    HB2  PHE  95           2HB      PHE  95  13.394   9.768  -9.976
  768    HB3  PHE  95           1HB      PHE  95  14.720   9.405 -11.073
  769    HD1  PHE  95           HD1      PHE  95  12.700  12.118  -9.595
  770    HD2  PHE  95           HD2      PHE  95  16.150  11.139 -11.899
  771    HE1  PHE  95           HE1      PHE  95  13.519  14.426  -9.349
  772    HE2  PHE  95           HE2      PHE  95  16.969  13.446 -11.655
  773    HZ   PHE  95           HZ       PHE  95  15.655  15.092 -10.378
  774    H    GLN  96           H        GLN  96  12.769  12.038 -13.373
  775    HA   GLN  96           HA       GLN  96  14.615  11.131 -15.475
  776    HB2  GLN  96           2HB      GLN  96  11.803  12.116 -15.868
  777    HB3  GLN  96           1HB      GLN  96  13.009  12.363 -17.123
  778    HG2  GLN  96           2HG      GLN  96  12.255   9.680 -15.965
  779    HG3  GLN  96           1HG      GLN  96  11.636  10.346 -17.478
  780   HE21  GLN  96          1HE2      GLN  96  14.474   9.128 -15.847
  781   HE22  GLN  96          2HE2      GLN  96  15.401   8.838 -17.273
  782    H    LYS  97           H        LYS  97  15.779  12.694 -16.533
  783    HA   LYS  97           HA       LYS  97  16.221  15.164 -15.157
  784    HB2  LYS  97           2HB      LYS  97  17.960  13.749 -16.368
  785    HB3  LYS  97           1HB      LYS  97  17.305  14.368 -17.874
  786    HG2  LYS  97           2HG      LYS  97  18.327  16.214 -15.729
  787    HG3  LYS  97           1HG      LYS  97  19.410  15.472 -16.905
  788    HD2  LYS  97           2HD      LYS  97  18.149  16.506 -18.732
  789    HD3  LYS  97           1HD      LYS  97  17.030  17.220 -17.570
  790    HE2  LYS  97           2HE      LYS  97  18.621  18.895 -18.253
  791    HE3  LYS  97           1HE      LYS  97  18.934  18.467 -16.572
  792    HZ1  LYS  97           3HZ      LYS  97  20.754  17.058 -17.308
  793    HZ2  LYS  97           1HZ      LYS  97  20.976  18.644 -17.851
  794    HZ3  LYS  97           2HZ      LYS  97  20.441  17.452 -18.920
  Start of MODEL   14
    1    H1   MET   1           1H       MET   1  16.139  25.058  -9.328
    2    H2   MET   1           2H       MET   1  17.132  26.135  -8.480
    3    H3   MET   1           3H       MET   1  15.901  25.303  -7.674
    4    HA   MET   1           HA       MET   1  16.989  23.213  -7.974
    5    HB2  MET   1           2HB      MET   1  19.145  23.043  -9.102
    6    HB3  MET   1           1HB      MET   1  17.957  23.734 -10.197
    7    HG2  MET   1           2HG      MET   1  20.105  25.223  -8.695
    8    HG3  MET   1           1HG      MET   1  20.066  24.881 -10.424
    9    HE1  MET   1           3HE      MET   1  19.540  28.782 -10.165
   10    HE2  MET   1           1HE      MET   1  20.570  27.497 -10.795
   11    HE3  MET   1           2HE      MET   1  20.497  27.796  -9.059
   12    H    GLY   2           H        GLY   2  16.718  25.102  -5.918
   13    HA2  GLY   2           2HA      GLY   2  19.163  26.104  -4.903
   14    HA3  GLY   2           1HA      GLY   2  17.657  25.984  -4.020
   15    H    HIS   3           H        HIS   3  20.509  24.133  -5.016
   16    HA   HIS   3           HA       HIS   3  21.811  22.630  -3.932
   17    HB2  HIS   3           2HB      HIS   3  20.526  23.704  -1.411
   18    HB3  HIS   3           1HB      HIS   3  22.077  22.875  -1.534
   19    HD1  HIS   3           HD1      HIS   3  20.550  26.191  -1.689
   20    HD2  HIS   3           HD2      HIS   3  24.080  24.433  -2.996
   21    HE1  HIS   3           HE1      HIS   3  22.080  28.094  -2.247
   22    HE2  HIS   3           HE2      HIS   3  24.187  27.015  -3.090
   23    H    HIS   4           H        HIS   4  21.103  20.637  -4.566
   24    HA   HIS   4           HA       HIS   4  18.888  19.390  -3.077
   25    HB2  HIS   4           2HB      HIS   4  20.248  18.572  -5.655
   26    HB3  HIS   4           1HB      HIS   4  18.969  17.650  -4.870
   27    HD1  HIS   4           HD1      HIS   4  19.213  19.561  -7.666
   28    HD2  HIS   4           HD2      HIS   4  16.739  19.878  -4.344
   29    HE1  HIS   4           HE1      HIS   4  17.232  20.882  -8.432
   30    HE2  HIS   4           HE2      HIS   4  15.639  20.800  -6.496
   31    H    HIS   5           H        HIS   5  19.300  17.978  -1.512
   32    HA   HIS   5           HA       HIS   5  21.912  16.819  -1.103
   33    HB2  HIS   5           2HB      HIS   5  20.451  17.453   0.788
   34    HB3  HIS   5           1HB      HIS   5  19.257  16.276   0.266
   35    HD1  HIS   5           HD1      HIS   5  19.544  13.909   1.077
   36    HD2  HIS   5           HD2      HIS   5  22.865  16.285   1.853
   37    HE1  HIS   5           HE1      HIS   5  21.009  12.546   2.597
   38    HE2  HIS   5           HE2      HIS   5  23.064  13.951   2.950
   39    H    HIS   6           H        HIS   6  22.450  15.411  -2.751
   40    HA   HIS   6           HA       HIS   6  20.615  14.112  -4.379
   41    HB2  HIS   6           2HB      HIS   6  22.484  12.888  -5.352
   42    HB3  HIS   6           1HB      HIS   6  22.902  14.575  -5.095
   43    HD1  HIS   6           HD1      HIS   6  23.539  11.151  -3.631
   44    HD2  HIS   6           HD2      HIS   6  25.156  14.977  -3.570
   45    HE1  HIS   6           HE1      HIS   6  25.749  10.924  -2.472
   46    HE2  HIS   6           HE2      HIS   6  26.763  13.222  -2.553
   47    H    HIS   7           H        HIS   7  21.931  12.939  -1.353
   48    HA   HIS   7           HA       HIS   7  20.840  10.265  -1.818
   49    HB2  HIS   7           2HB      HIS   7  22.982  10.607  -0.547
   50    HB3  HIS   7           1HB      HIS   7  22.051  11.383   0.727
   51    HD1  HIS   7           HD1      HIS   7  21.831   9.803   2.617
   52    HD2  HIS   7           HD2      HIS   7  21.551   7.855  -1.045
   53    HE1  HIS   7           HE1      HIS   7  21.429   7.391   3.165
   54    HE2  HIS   7           HE2      HIS   7  21.385   6.208   0.949
   55    H    HIS   8           H        HIS   8  18.777  11.697  -2.200
   56    HA   HIS   8           HA       HIS   8  17.313  12.242   0.277
   57    HB2  HIS   8           2HB      HIS   8  17.245  13.970  -1.447
   58    HB3  HIS   8           1HB      HIS   8  16.637  12.812  -2.625
   59    HD1  HIS   8           HD1      HIS   8  15.527  14.215   0.747
   60    HD2  HIS   8           HD2      HIS   8  13.931  12.920  -2.865
   61    HE1  HIS   8           HE1      HIS   8  13.058  14.630   0.914
   62    HE2  HIS   8           HE2      HIS   8  12.094  13.707  -1.216
   63    H    SER   9           H        SER   9  15.474  11.159   0.900
   64    HA   SER   9           HA       SER   9  15.050   8.495   0.157
   65    HB2  SER   9           2HB      SER   9  13.056  10.396   1.433
   66    HB3  SER   9           1HB      SER   9  12.964   8.635   1.456
   67    HG   SER   9           HG       SER   9  13.906   9.710   3.365
   68    H    HIS  10           H        HIS  10  14.164   7.628  -1.622
   69    HA   HIS  10           HA       HIS  10  12.742   9.345  -3.499
   70    HB2  HIS  10           2HB      HIS  10  13.721   6.490  -3.778
   71    HB3  HIS  10           1HB      HIS  10  12.995   7.444  -5.069
   72    HD1  HIS  10           HD1      HIS  10  16.200   6.480  -3.877
   73    HD2  HIS  10           HD2      HIS  10  14.610  10.001  -5.413
   74    HE1  HIS  10           HE1      HIS  10  18.171   7.841  -4.622
   75    HE2  HIS  10           HE2      HIS  10  17.176   9.880  -5.706
   76    H    MET  11           H        MET  11  10.675   8.994  -4.274
   77    HA   MET  11           HA       MET  11   8.845   7.780  -2.438
   78    HB2  MET  11           2HB      MET  11   7.098   8.539  -4.064
   79    HB3  MET  11           1HB      MET  11   8.157   9.814  -3.481
   80    HG2  MET  11           2HG      MET  11   8.426   8.427  -6.144
   81    HG3  MET  11           1HG      MET  11   7.642   9.984  -5.884
   82    HE1  MET  11           3HE      MET  11  10.975  10.935  -7.742
   83    HE2  MET  11           1HE      MET  11   9.216  11.039  -7.770
   84    HE3  MET  11           2HE      MET  11  10.010   9.480  -7.997
   85    H    VAL  12           H        VAL  12   9.227   5.585  -2.408
   86    HA   VAL  12           HA       VAL  12   8.703   4.055  -4.872
   87    HB   VAL  12           HB       VAL  12   9.833   3.130  -2.216
   88   HG11  VAL  12          1HG1      VAL  12  10.394   1.049  -3.394
   89   HG12  VAL  12          2HG1      VAL  12   9.555   1.637  -4.832
   90   HG13  VAL  12          3HG1      VAL  12   8.652   1.321  -3.349
   91   HG21  VAL  12          3HG2      VAL  12  11.204   3.662  -4.860
   92   HG22  VAL  12          1HG2      VAL  12  11.968   2.956  -3.436
   93   HG23  VAL  12          2HG2      VAL  12  11.369   4.611  -3.384
   94    H    VAL  13           H        VAL  13   6.943   2.716  -5.059
   95    HA   VAL  13           HA       VAL  13   5.003   2.748  -2.833
   96    HB   VAL  13           HB       VAL  13   3.179   3.021  -4.456
   97   HG11  VAL  13          1HG1      VAL  13   4.144   4.996  -3.366
   98   HG12  VAL  13          2HG1      VAL  13   3.547   5.373  -4.982
   99   HG13  VAL  13          3HG1      VAL  13   5.279   5.180  -4.703
  100   HG21  VAL  13          3HG2      VAL  13   5.376   3.360  -6.512
  101   HG22  VAL  13          1HG2      VAL  13   3.653   3.630  -6.786
  102   HG23  VAL  13          2HG2      VAL  13   4.243   2.012  -6.416
  103    H    ILE  14           H        ILE  14   3.043   1.262  -3.559
  104    HA   ILE  14           HA       ILE  14   4.182  -1.415  -4.004
  105    HB   ILE  14           HB       ILE  14   3.051  -0.972  -1.840
  106   HG12  ILE  14          2HG1      ILE  14   1.383  -2.927  -1.986
  107   HG13  ILE  14          1HG1      ILE  14   1.832  -3.031  -3.685
  108   HG21  ILE  14          1HG2      ILE  14   0.579  -0.570  -3.518
  109   HG22  ILE  14          2HG2      ILE  14   1.414   0.655  -2.565
  110   HG23  ILE  14          3HG2      ILE  14   0.611  -0.693  -1.759
  111   HD11  ILE  14          3HD1      ILE  14   3.642  -3.373  -1.306
  112   HD12  ILE  14          1HD1      ILE  14   4.188  -3.357  -2.984
  113   HD13  ILE  14          2HD1      ILE  14   3.097  -4.622  -2.422
  114    H    ARG  15           H        ARG  15   2.903  -2.972  -5.262
  115    HA   ARG  15           HA       ARG  15   1.154  -1.736  -7.301
  116    HB2  ARG  15           2HB      ARG  15   3.313  -2.062  -8.336
  117    HB3  ARG  15           1HB      ARG  15   3.415  -3.707  -7.731
  118    HG2  ARG  15           2HG      ARG  15   1.470  -4.306  -9.150
  119    HG3  ARG  15           1HG      ARG  15   1.493  -2.675  -9.814
  120    HD2  ARG  15           2HD      ARG  15   3.873  -4.516  -9.936
  121    HD3  ARG  15           1HD      ARG  15   2.630  -4.486 -11.184
  122    HE   ARG  15           HE       ARG  15   3.835  -1.929 -10.561
  123   HH11  ARG  15          1HH1      ARG  15   3.885  -4.719 -12.580
  124   HH12  ARG  15          2HH1      ARG  15   4.719  -3.908 -13.859
  125   HH21  ARG  15          1HH2      ARG  15   4.913  -0.903 -12.196
  126   HH22  ARG  15          2HH2      ARG  15   5.300  -1.773 -13.644
  127    H    ARG  16           H        ARG  16  -0.379  -3.149  -8.312
  128    HA   ARG  16           HA       ARG  16  -1.859  -4.845  -8.539
  129    HB2  ARG  16           2HB      ARG  16   0.135  -6.381  -6.867
  130    HB3  ARG  16           1HB      ARG  16  -1.340  -7.098  -7.499
  131    HG2  ARG  16           2HG      ARG  16   0.843  -5.868  -9.181
  132    HG3  ARG  16           1HG      ARG  16   0.634  -7.595  -8.883
  133    HD2  ARG  16           2HD      ARG  16  -1.395  -5.798 -10.223
  134    HD3  ARG  16           1HD      ARG  16  -0.296  -6.896 -11.056
  135    HE   ARG  16           HE       ARG  16  -1.461  -8.693  -9.694
  136   HH11  ARG  16          1HH1      ARG  16  -3.050  -5.838 -10.808
  137   HH12  ARG  16          2HH1      ARG  16  -4.617  -6.566 -10.755
  138   HH21  ARG  16          1HH2      ARG  16  -3.484  -9.606  -9.661
  139   HH22  ARG  16          2HH2      ARG  16  -4.856  -8.659 -10.124
  140    H    LEU  17           H        LEU  17  -2.732  -2.981  -6.955
  141    HA   LEU  17           HA       LEU  17  -3.951  -4.374  -4.657
  142    HB2  LEU  17           2HB      LEU  17  -3.535  -1.423  -5.161
  143    HB3  LEU  17           1HB      LEU  17  -4.590  -2.031  -3.902
  144    HG   LEU  17           HG       LEU  17  -2.500  -1.404  -2.910
  145   HD11  LEU  17          1HD1      LEU  17  -1.821  -3.488  -1.855
  146   HD12  LEU  17          2HD1      LEU  17  -2.651  -4.409  -3.109
  147   HD13  LEU  17          3HD1      LEU  17  -3.576  -3.391  -2.005
  148   HD21  LEU  17          3HD2      LEU  17  -1.094  -1.504  -4.902
  149   HD22  LEU  17          1HD2      LEU  17  -1.161  -3.267  -4.868
  150   HD23  LEU  17          2HD2      LEU  17  -0.368  -2.389  -3.559
  151    HA   PRO  18           HA       PRO  18  -7.527  -3.849  -7.465
  152    HB2  PRO  18           2HB      PRO  18  -8.448  -6.351  -7.404
  153    HB3  PRO  18           1HB      PRO  18  -6.999  -5.938  -8.330
  154    HG2  PRO  18           2HG      PRO  18  -7.231  -7.326  -5.699
  155    HG3  PRO  18           1HG      PRO  18  -6.066  -7.586  -7.006
  156    HD2  PRO  18           2HD      PRO  18  -5.659  -6.054  -4.660
  157    HD3  PRO  18           1HD      PRO  18  -4.608  -6.101  -6.090
  158    HA   PRO  19           HA       PRO  19 -10.702  -3.190  -4.366
  159    HB2  PRO  19           2HB      PRO  19 -12.658  -4.051  -6.440
  160    HB3  PRO  19           1HB      PRO  19 -12.568  -2.534  -5.534
  161    HG2  PRO  19           2HG      PRO  19 -11.869  -2.632  -8.109
  162    HG3  PRO  19           1HG      PRO  19 -10.974  -1.623  -6.958
  163    HD2  PRO  19           2HD      PRO  19 -10.237  -4.297  -8.107
  164    HD3  PRO  19           1HD      PRO  19  -9.213  -2.876  -7.806
  165    H    GLY  20           H        GLY  20 -10.053  -5.044  -3.098
  166    HA2  GLY  20           2HA      GLY  20 -12.057  -7.215  -3.215
  167    HA3  GLY  20           1HA      GLY  20 -10.352  -7.611  -3.083
  168    H    LEU  21           H        LEU  21 -10.781  -4.825  -1.354
  169    HA   LEU  21           HA       LEU  21 -11.912  -5.787   1.055
  170    HB2  LEU  21           2HB      LEU  21  -9.988  -6.053   2.452
  171    HB3  LEU  21           1HB      LEU  21  -9.837  -7.133   1.084
  172    HG   LEU  21           HG       LEU  21  -8.358  -4.511   1.407
  173   HD11  LEU  21          1HD1      LEU  21  -7.600  -6.155   3.018
  174   HD12  LEU  21          2HD1      LEU  21  -6.384  -5.922   1.764
  175   HD13  LEU  21          3HD1      LEU  21  -7.412  -7.356   1.740
  176   HD21  LEU  21          3HD2      LEU  21  -7.018  -5.280  -0.502
  177   HD22  LEU  21          1HD2      LEU  21  -8.710  -5.048  -0.940
  178   HD23  LEU  21          2HD2      LEU  21  -8.082  -6.676  -0.680
  179    H    THR  22           H        THR  22 -11.683  -4.268   2.855
  180    HA   THR  22           HA       THR  22 -11.909  -1.571   1.837
  181    HB   THR  22           HB       THR  22 -12.253  -2.558   4.689
  182    HG1  THR  22           HG1      THR  22 -14.596  -2.118   3.769
  183   HG21  THR  22          3HG2      THR  22 -11.945  -0.128   4.553
  184   HG22  THR  22          1HG2      THR  22 -13.613  -0.517   4.975
  185   HG23  THR  22          2HG2      THR  22 -13.212  -0.026   3.329
  186    H    LYS  23           H        LYS  23 -10.710   0.220   2.519
  187    HA   LYS  23           HA       LYS  23  -7.996   0.056   2.734
  188    HB2  LYS  23           2HB      LYS  23  -8.056   2.398   3.547
  189    HB3  LYS  23           1HB      LYS  23  -9.127   2.119   2.180
  190    HG2  LYS  23           2HG      LYS  23 -11.020   1.901   3.807
  191    HG3  LYS  23           1HG      LYS  23  -9.902   2.403   5.077
  192    HD2  LYS  23           2HD      LYS  23 -10.593   4.016   2.614
  193    HD3  LYS  23           1HD      LYS  23 -11.268   4.274   4.222
  194    HE2  LYS  23           2HE      LYS  23  -9.023   4.775   5.081
  195    HE3  LYS  23           1HE      LYS  23  -8.349   4.509   3.473
  196    HZ1  LYS  23           3HZ      LYS  23  -8.698   6.868   3.967
  197    HZ2  LYS  23           1HZ      LYS  23 -10.356   6.590   4.150
  198    HZ3  LYS  23           2HZ      LYS  23  -9.619   6.364   2.642
  199    H    GLU  24           H        GLU  24 -10.251  -0.405   5.348
  200    HA   GLU  24           HA       GLU  24  -8.526   0.139   7.528
  201    HB2  GLU  24           2HB      GLU  24 -10.846  -1.803   7.484
  202    HB3  GLU  24           1HB      GLU  24 -10.168  -0.991   8.889
  203    HG2  GLU  24           2HG      GLU  24 -10.917   1.166   8.011
  204    HG3  GLU  24           1HG      GLU  24 -11.598   0.356   6.600
  205    H    GLN  25           H        GLN  25  -9.183  -2.861   5.729
  206    HA   GLN  25           HA       GLN  25  -7.134  -4.296   7.258
  207    HB2  GLN  25           2HB      GLN  25  -8.895  -5.217   4.962
  208    HB3  GLN  25           1HB      GLN  25  -7.785  -6.241   5.863
  209    HG2  GLN  25           2HG      GLN  25  -9.094  -5.819   7.908
  210    HG3  GLN  25           1HG      GLN  25 -10.227  -4.853   6.959
  211   HE21  GLN  25          1HE2      GLN  25 -11.617  -5.900   5.514
  212   HE22  GLN  25          2HE2      GLN  25 -11.875  -7.606   5.562
  213    H    LEU  26           H        LEU  26  -7.787  -3.157   3.993
  214    HA   LEU  26           HA       LEU  26  -5.602  -4.063   2.589
  215    HB2  LEU  26           2HB      LEU  26  -7.365  -3.018   1.439
  216    HB3  LEU  26           1HB      LEU  26  -7.270  -1.568   2.411
  217    HG   LEU  26           HG       LEU  26  -5.069  -1.065   1.306
  218   HD11  LEU  26          1HD1      LEU  26  -5.861  -3.343  -0.510
  219   HD12  LEU  26          2HD1      LEU  26  -4.491  -3.335   0.601
  220   HD13  LEU  26          3HD1      LEU  26  -4.519  -2.228  -0.770
  221   HD21  LEU  26          3HD2      LEU  26  -7.447  -1.335  -0.525
  222   HD22  LEU  26          1HD2      LEU  26  -6.067  -0.263  -0.763
  223   HD23  LEU  26          2HD2      LEU  26  -7.158  -0.007   0.598
  224    H    GLU  27           H        GLU  27  -5.689  -1.517   4.981
  225    HA   GLU  27           HA       GLU  27  -3.259  -0.212   4.313
  226    HB2  GLU  27           2HB      GLU  27  -3.402   0.803   6.515
  227    HB3  GLU  27           1HB      GLU  27  -4.999   0.772   5.778
  228    HG2  GLU  27           2HG      GLU  27  -5.545  -1.239   7.097
  229    HG3  GLU  27           1HG      GLU  27  -3.967  -1.144   7.865
  230    H    GLU  28           H        GLU  28  -3.934  -3.112   6.204
  231    HA   GLU  28           HA       GLU  28  -1.801  -2.927   8.010
  232    HB2  GLU  28           2HB      GLU  28  -2.295  -5.176   8.651
  233    HB3  GLU  28           1HB      GLU  28  -3.820  -4.420   8.230
  234    HG2  GLU  28           2HG      GLU  28  -3.864  -5.571   6.104
  235    HG3  GLU  28           1HG      GLU  28  -2.260  -6.237   6.397
  236    H    GLN  29           H        GLN  29  -1.933  -4.451   4.821
  237    HA   GLN  29           HA       GLN  29   0.766  -5.497   5.091
  238    HB2  GLN  29           2HB      GLN  29   0.478  -6.427   2.856
  239    HB3  GLN  29           1HB      GLN  29  -0.892  -6.840   3.875
  240    HG2  GLN  29           2HG      GLN  29  -1.067  -4.457   2.078
  241    HG3  GLN  29           1HG      GLN  29  -1.235  -6.072   1.396
  242   HE21  GLN  29          1HE2      GLN  29  -3.371  -5.737   0.839
  243   HE22  GLN  29          2HE2      GLN  29  -4.634  -5.662   2.004
  244    H    LEU  30           H        LEU  30  -0.602  -2.559   4.167
  245    HA   LEU  30           HA       LEU  30   1.649  -1.888   2.397
  246    HB2  LEU  30           2HB      LEU  30  -0.886  -0.331   2.911
  247    HB3  LEU  30           1HB      LEU  30   0.337   0.041   1.708
  248    HG   LEU  30           HG       LEU  30  -1.507  -2.358   1.718
  249   HD11  LEU  30          1HD1      LEU  30  -2.586  -0.288   1.026
  250   HD12  LEU  30          2HD1      LEU  30  -2.394  -1.388  -0.338
  251   HD13  LEU  30          3HD1      LEU  30  -1.312  -0.006  -0.162
  252   HD21  LEU  30          3HD2      LEU  30   0.696  -1.649  -0.222
  253   HD22  LEU  30          1HD2      LEU  30  -0.483  -2.945  -0.434
  254   HD23  LEU  30          2HD2      LEU  30   0.680  -3.018   0.889
  255    H    ARG  31           H        ARG  31   0.536  -1.381   5.609
  256    HA   ARG  31           HA       ARG  31   2.777   0.482   5.997
  257    HB2  ARG  31           2HB      ARG  31   1.507   1.898   7.496
  258    HB3  ARG  31           1HB      ARG  31   0.731   1.834   5.923
  259    HG2  ARG  31           2HG      ARG  31  -0.985   0.353   6.776
  260    HG3  ARG  31           1HG      ARG  31  -0.168   0.244   8.338
  261    HD2  ARG  31           2HD      ARG  31  -0.411   2.783   8.452
  262    HD3  ARG  31           1HD      ARG  31  -1.520   2.629   7.094
  263    HE   ARG  31           HE       ARG  31  -2.359   0.903   9.141
  264   HH11  ARG  31          1HH1      ARG  31  -2.107   4.269   8.486
  265   HH12  ARG  31          2HH1      ARG  31  -3.429   4.689   9.513
  266   HH21  ARG  31          1HH2      ARG  31  -4.039   1.454  10.480
  267   HH22  ARG  31          2HH2      ARG  31  -4.512   3.112  10.629
  268    HA   PRO  32           HA       PRO  32   2.633  -2.703   9.493
  269    HB2  PRO  32           2HB      PRO  32   4.122  -4.743   8.611
  270    HB3  PRO  32           1HB      PRO  32   2.410  -4.619   8.180
  271    HG2  PRO  32           2HG      PRO  32   4.829  -3.902   6.559
  272    HG3  PRO  32           1HG      PRO  32   3.358  -4.754   6.052
  273    HD2  PRO  32           2HD      PRO  32   3.827  -2.062   5.638
  274    HD3  PRO  32           1HD      PRO  32   2.216  -2.801   5.693
  275    H    LEU  33           H        LEU  33   4.607  -0.593   8.140
  276    HA   LEU  33           HA       LEU  33   7.206  -1.479   9.003
  277    HB2  LEU  33           2HB      LEU  33   6.255   1.203   7.982
  278    HB3  LEU  33           1HB      LEU  33   7.927   0.819   8.340
  279    HG   LEU  33           HG       LEU  33   7.677  -1.072   6.605
  280   HD11  LEU  33          1HD1      LEU  33   6.021  -0.660   4.841
  281   HD12  LEU  33          2HD1      LEU  33   5.284   0.592   5.841
  282   HD13  LEU  33          3HD1      LEU  33   5.275  -1.087   6.379
  283   HD21  LEU  33          3HD2      LEU  33   9.030   0.908   6.230
  284   HD22  LEU  33          1HD2      LEU  33   7.603   1.802   5.710
  285   HD23  LEU  33          2HD2      LEU  33   8.187   0.441   4.755
  286    HA   PRO  34           HA       PRO  34   7.231   0.116  13.159
  287    HB2  PRO  34           2HB      PRO  34   9.843   0.854  13.427
  288    HB3  PRO  34           1HB      PRO  34   9.316  -0.831  13.408
  289    HG2  PRO  34           2HG      PRO  34  10.454   0.818  11.168
  290    HG3  PRO  34           1HG      PRO  34  10.857  -0.844  11.649
  291    HD2  PRO  34           2HD      PRO  34   9.212  -0.323   9.582
  292    HD3  PRO  34           1HD      PRO  34   8.969  -1.728  10.639
  293    H    ALA  35           H        ALA  35   8.001   2.111  10.482
  294    HA   ALA  35           HA       ALA  35   7.033   4.487  11.782
  295    HB1  ALA  35           3HB      ALA  35   9.914   4.411  10.872
  296    HB2  ALA  35           1HB      ALA  35   9.362   4.515  12.545
  297    HB3  ALA  35           2HB      ALA  35   9.048   5.843  11.428
  298    H    HIS  36           H        HIS  36   8.136   6.350   9.924
  299    HA   HIS  36           HA       HIS  36   8.068   7.161   7.822
  300    HB2  HIS  36           2HB      HIS  36   8.711   5.826   6.126
  301    HB3  HIS  36           1HB      HIS  36   8.818   4.575   7.350
  302    HD1  HIS  36           HD1      HIS  36   5.722   3.956   7.538
  303    HD2  HIS  36           HD2      HIS  36   7.917   4.277   4.028
  304    HE1  HIS  36           HE1      HIS  36   4.432   2.666   5.821
  305    HE2  HIS  36           HE2      HIS  36   5.885   2.702   3.776
  306    H    ASP  37           H        ASP  37   6.560   7.879   6.231
  307    HA   ASP  37           HA       ASP  37   3.925   8.110   7.246
  308    HB2  ASP  37           2HB      ASP  37   5.116   8.943   4.590
  309    HB3  ASP  37           1HB      ASP  37   3.501   9.387   5.129
  310    H    TYR  38           H        TYR  38   1.949   7.559   6.260
  311    HA   TYR  38           HA       TYR  38   2.037   5.339   4.320
  312    HB2  TYR  38           2HB      TYR  38  -0.028   4.456   5.367
  313    HB3  TYR  38           1HB      TYR  38   1.325   4.474   6.490
  314    HD1  TYR  38           HD2      TYR  38   1.407   6.196   8.303
  315    HD2  TYR  38           HD1      TYR  38  -2.012   5.737   5.798
  316    HE1  TYR  38           HE2      TYR  38   0.055   7.454   9.923
  317    HE2  TYR  38           HE1      TYR  38  -3.367   6.998   7.414
  318    HH   TYR  38           HH       TYR  38  -3.281   7.486   9.902
  319    H    PHE  39           H        PHE  39   0.720   5.529   2.543
  320    HA   PHE  39           HA       PHE  39  -0.381   8.175   2.079
  321    HB2  PHE  39           2HB      PHE  39   1.046   6.819   0.430
  322    HB3  PHE  39           1HB      PHE  39  -0.395   5.857   0.143
  323    HD1  PHE  39           HD2      PHE  39   1.064   9.233  -0.145
  324    HD2  PHE  39           HD1      PHE  39  -2.147   6.663  -1.268
  325    HE1  PHE  39           HE2      PHE  39   0.337  10.875  -1.829
  326    HE2  PHE  39           HE1      PHE  39  -2.866   8.298  -2.957
  327    HZ   PHE  39           HZ       PHE  39  -1.630  10.409  -3.240
  328    H    GLU  40           H        GLU  40  -2.532   8.465   1.119
  329    HA   GLU  40           HA       GLU  40  -4.555   7.286   2.678
  330    HB2  GLU  40           2HB      GLU  40  -6.119   8.502   1.141
  331    HB3  GLU  40           1HB      GLU  40  -4.864   9.503   1.856
  332    HG2  GLU  40           2HG      GLU  40  -3.589   9.424  -0.210
  333    HG3  GLU  40           1HG      GLU  40  -4.810   8.381  -0.940
  334    H    PHE  41           H        PHE  41  -5.152   5.235   2.548
  335    HA   PHE  41           HA       PHE  41  -4.879   3.644   0.173
  336    HB2  PHE  41           2HB      PHE  41  -6.354   2.898   2.710
  337    HB3  PHE  41           1HB      PHE  41  -5.630   1.809   1.530
  338    HD1  PHE  41           HD1      PHE  41  -3.135   1.671   1.359
  339    HD2  PHE  41           HD2      PHE  41  -5.084   3.821   4.478
  340    HE1  PHE  41           HE1      PHE  41  -1.058   1.647   2.675
  341    HE2  PHE  41           HE2      PHE  41  -3.009   3.797   5.794
  342    HZ   PHE  41           HZ       PHE  41  -0.991   2.711   4.896
  343    H    PHE  42           H        PHE  42  -6.453   2.998  -1.283
  344    HA   PHE  42           HA       PHE  42  -8.834   4.542  -1.446
  345    HB2  PHE  42           2HB      PHE  42  -9.339   3.322  -3.459
  346    HB3  PHE  42           1HB      PHE  42  -7.616   3.660  -3.434
  347    HD1  PHE  42           HD2      PHE  42  -6.001   1.819  -2.952
  348    HD2  PHE  42           HD1      PHE  42 -10.169   1.091  -3.493
  349    HE1  PHE  42           HE2      PHE  42  -5.536  -0.560  -3.345
  350    HE2  PHE  42           HE1      PHE  42  -9.703  -1.292  -3.889
  351    HZ   PHE  42           HZ       PHE  42  -7.382  -2.121  -3.815
  352    H    ALA  43           H        ALA  43 -11.024   3.877  -1.331
  353    HA   ALA  43           HA       ALA  43 -11.470   1.631   0.524
  354    HB1  ALA  43           3HB      ALA  43 -12.178   3.811   1.358
  355    HB2  ALA  43           1HB      ALA  43 -13.567   2.748   1.126
  356    HB3  ALA  43           2HB      ALA  43 -13.226   4.024  -0.044
  357    H    ALA  44           H        ALA  44 -11.631  -0.083  -0.922
  358    HA   ALA  44           HA       ALA  44 -14.207  -0.316  -2.247
  359    HB1  ALA  44           3HB      ALA  44 -12.791   0.651  -4.005
  360    HB2  ALA  44           1HB      ALA  44 -13.300  -0.988  -4.408
  361    HB3  ALA  44           2HB      ALA  44 -11.659  -0.689  -3.831
  362    H    ASP  45           H        ASP  45 -14.902  -2.092  -1.200
  363    HA   ASP  45           HA       ASP  45 -13.073  -4.198  -0.436
  364    HB2  ASP  45           2HB      ASP  45 -14.988  -5.176   0.715
  365    HB3  ASP  45           1HB      ASP  45 -14.858  -3.460   1.091
  366    H    LEU  46           H        LEU  46 -14.578  -6.484  -0.628
  367    HA   LEU  46           HA       LEU  46 -13.868  -7.253  -3.279
  368    HB2  LEU  46           2HB      LEU  46 -14.269  -9.475  -2.613
  369    HB3  LEU  46           1HB      LEU  46 -13.593  -8.655  -1.217
  370    HG   LEU  46           HG       LEU  46 -16.535  -9.275  -1.610
  371   HD11  LEU  46          1HD1      LEU  46 -15.230 -11.307  -1.298
  372   HD12  LEU  46          2HD1      LEU  46 -16.227 -10.967   0.118
  373   HD13  LEU  46          3HD1      LEU  46 -14.496 -10.626   0.156
  374   HD21  LEU  46          3HD2      LEU  46 -16.775  -8.652   0.741
  375   HD22  LEU  46          1HD2      LEU  46 -16.182  -7.296  -0.217
  376   HD23  LEU  46          2HD2      LEU  46 -15.070  -8.205   0.808
  377    H    SER  47           H        SER  47 -16.743  -5.883  -2.184
  378    HA   SER  47           HA       SER  47 -18.779  -7.248  -3.458
  379    HB2  SER  47           2HB      SER  47 -18.381  -4.264  -3.178
  380    HB3  SER  47           1HB      SER  47 -19.867  -4.984  -3.792
  381    HG   SER  47           HG       SER  47 -18.927  -4.798  -1.222
  382    H    LEU  48           H        LEU  48 -19.472  -7.540  -5.513
  383    HA   LEU  48           HA       LEU  48 -17.582  -7.187  -7.604
  384    HB2  LEU  48           2HB      LEU  48 -20.453  -8.116  -7.699
  385    HB3  LEU  48           1HB      LEU  48 -19.330  -8.207  -9.044
  386    HG   LEU  48           HG       LEU  48 -19.085  -9.677  -6.411
  387   HD11  LEU  48          1HD1      LEU  48 -19.388 -11.687  -7.782
  388   HD12  LEU  48          2HD1      LEU  48 -19.640 -10.676  -9.207
  389   HD13  LEU  48          3HD1      LEU  48 -20.787 -10.619  -7.866
  390   HD21  LEU  48          3HD2      LEU  48 -17.252  -9.693  -8.812
  391   HD22  LEU  48          1HD2      LEU  48 -17.132 -10.775  -7.425
  392   HD23  LEU  48          2HD2      LEU  48 -16.881  -9.043  -7.214
  393    H    TYR  49           H        TYR  49 -18.771  -6.553  -9.877
  394    HA   TYR  49           HA       TYR  49 -18.971  -4.762 -11.238
  395    HB2  TYR  49           2HB      TYR  49 -21.271  -4.694 -10.397
  396    HB3  TYR  49           1HB      TYR  49 -20.764  -3.717  -9.024
  397    HD1  TYR  49           HD1      TYR  49 -20.922  -3.688 -12.755
  398    HD2  TYR  49           HD2      TYR  49 -20.801  -1.371  -9.182
  399    HE1  TYR  49           HE1      TYR  49 -21.331  -1.647 -14.067
  400    HE2  TYR  49           HE2      TYR  49 -21.208   0.670 -10.483
  401    HH   TYR  49           HH       TYR  49 -20.941   1.487 -12.765
  402    HA   PRO  50           HA       PRO  50 -15.612  -2.518  -8.887
  403    HB2  PRO  50           2HB      PRO  50 -14.251  -2.883 -11.501
  404    HB3  PRO  50           1HB      PRO  50 -13.655  -3.200  -9.869
  405    HG2  PRO  50           2HG      PRO  50 -14.302  -5.206 -11.517
  406    HG3  PRO  50           1HG      PRO  50 -14.633  -5.300  -9.776
  407    HD2  PRO  50           2HD      PRO  50 -16.520  -4.689 -12.032
  408    HD3  PRO  50           1HD      PRO  50 -16.772  -5.708 -10.597
  409    H    HIS  51           H        HIS  51 -16.754  -0.587  -8.898
  410    HA   HIS  51           HA       HIS  51 -17.606   0.826 -11.175
  411    HB2  HIS  51           2HB      HIS  51 -18.385   1.116  -8.778
  412    HB3  HIS  51           1HB      HIS  51 -16.920   2.045  -8.489
  413    HD1  HIS  51           HD1      HIS  51 -20.357   2.483  -9.338
  414    HD2  HIS  51           HD2      HIS  51 -16.818   4.396 -10.396
  415    HE1  HIS  51           HE1      HIS  51 -21.042   4.733 -10.212
  416    HE2  HIS  51           HE2      HIS  51 -18.896   5.863 -10.876
  417    H    LEU  52           H        LEU  52 -14.545   0.850  -9.451
  418    HA   LEU  52           HA       LEU  52 -13.250   2.209 -11.647
  419    HB2  LEU  52           2HB      LEU  52 -12.364   4.071 -10.435
  420    HB3  LEU  52           1HB      LEU  52 -14.107   4.096 -10.275
  421    HG   LEU  52           HG       LEU  52 -12.216   3.088  -8.132
  422   HD11  LEU  52          1HD1      LEU  52 -12.713   5.181  -6.953
  423   HD12  LEU  52          2HD1      LEU  52 -13.617   5.756  -8.356
  424   HD13  LEU  52          3HD1      LEU  52 -11.882   5.466  -8.479
  425   HD21  LEU  52          3HD2      LEU  52 -14.425   2.091  -7.967
  426   HD22  LEU  52          1HD2      LEU  52 -15.178   3.686  -8.053
  427   HD23  LEU  52          2HD2      LEU  52 -14.183   3.251  -6.662
  428    H    TYR  53           H        TYR  53 -10.851   2.411 -11.262
  429    HA   TYR  53           HA       TYR  53  -9.867   0.351  -9.388
  430    HB2  TYR  53           2HB      TYR  53  -9.182   0.749 -12.292
  431    HB3  TYR  53           1HB      TYR  53  -8.001   0.032 -11.202
  432    HD1  TYR  53           HD2      TYR  53 -11.256  -0.453 -12.857
  433    HD2  TYR  53           HD1      TYR  53  -8.338  -2.182 -10.279
  434    HE1  TYR  53           HE2      TYR  53 -12.326  -2.649 -13.119
  435    HE2  TYR  53           HE1      TYR  53  -9.404  -4.379 -10.538
  436    HH   TYR  53           HH       TYR  53 -11.612  -5.289 -11.116
  437    H    SER  54           H        SER  54  -9.290   1.872  -7.838
  438    HA   SER  54           HA       SER  54  -7.116   3.735  -8.571
  439    HB2  SER  54           2HB      SER  54  -9.117   4.774  -7.523
  440    HB3  SER  54           1HB      SER  54  -8.874   3.766  -6.097
  441    HG   SER  54           HG       SER  54  -7.921   6.080  -6.343
  442    H    ARG  55           H        ARG  55  -5.220   3.807  -7.247
  443    HA   ARG  55           HA       ARG  55  -4.693   1.229  -5.907
  444    HB2  ARG  55           2HB      ARG  55  -3.313   1.826  -7.923
  445    HB3  ARG  55           1HB      ARG  55  -2.670   3.190  -7.016
  446    HG2  ARG  55           2HG      ARG  55  -2.036   1.356  -5.255
  447    HG3  ARG  55           1HG      ARG  55  -2.200   0.261  -6.627
  448    HD2  ARG  55           2HD      ARG  55  -0.333   2.622  -6.386
  449    HD3  ARG  55           1HD      ARG  55   0.105   0.916  -6.407
  450    HE   ARG  55           HE       ARG  55  -1.202   2.106  -8.749
  451   HH11  ARG  55          1HH1      ARG  55   1.564   0.612  -7.321
  452   HH12  ARG  55          2HH1      ARG  55   2.372   0.423  -8.838
  453   HH21  ARG  55          1HH2      ARG  55  -0.145   1.867 -10.673
  454   HH22  ARG  55          2HH2      ARG  55   1.415   1.118 -10.710
  455    H    ALA  56           H        ALA  56  -3.863   1.149  -3.847
  456    HA   ALA  56           HA       ALA  56  -3.595   3.624  -2.324
  457    HB1  ALA  56           3HB      ALA  56  -3.316   2.141  -0.387
  458    HB2  ALA  56           1HB      ALA  56  -3.317   0.739  -1.459
  459    HB3  ALA  56           2HB      ALA  56  -4.768   1.731  -1.301
  460    H    TYR  57           H        TYR  57  -1.668   4.648  -2.254
  461    HA   TYR  57           HA       TYR  57   0.728   3.212  -3.137
  462    HB2  TYR  57           2HB      TYR  57   0.230   6.172  -2.750
  463    HB3  TYR  57           1HB      TYR  57   1.723   5.474  -3.369
  464    HD1  TYR  57           HD1      TYR  57  -1.883   5.947  -4.090
  465    HD2  TYR  57           HD2      TYR  57   1.918   4.849  -5.662
  466    HE1  TYR  57           HE1      TYR  57  -2.807   6.021  -6.367
  467    HE2  TYR  57           HE2      TYR  57   1.004   4.922  -7.942
  468    HH   TYR  57           HH       TYR  57  -1.957   6.336  -8.698
  469    H    ILE  58           H        ILE  58   2.821   4.345  -2.065
  470    HA   ILE  58           HA       ILE  58   2.504   4.427   0.863
  471    HB   ILE  58           HB       ILE  58   4.638   2.828  -0.587
  472   HG12  ILE  58          2HG1      ILE  58   2.310   1.880   1.115
  473   HG13  ILE  58          1HG1      ILE  58   2.443   1.707  -0.632
  474   HG21  ILE  58          1HG2      ILE  58   5.352   2.109   1.643
  475   HG22  ILE  58          2HG2      ILE  58   4.137   3.162   2.372
  476   HG23  ILE  58          3HG2      ILE  58   5.477   3.860   1.463
  477   HD11  ILE  58          3HD1      ILE  58   4.374   0.247  -0.342
  478   HD12  ILE  58          1HD1      ILE  58   2.958  -0.369   0.508
  479   HD13  ILE  58          2HD1      ILE  58   4.249   0.425   1.410
  480    H    ASN  59           H        ASN  59   4.145   5.660   1.966
  481    HA   ASN  59           HA       ASN  59   5.937   7.219   0.213
  482    HB2  ASN  59           2HB      ASN  59   4.052   8.625   0.912
  483    HB3  ASN  59           1HB      ASN  59   4.393   8.262   2.601
  484   HD21  ASN  59          1HD2      ASN  59   4.640  10.486   2.994
  485   HD22  ASN  59          2HD2      ASN  59   6.072  11.330   2.521
  486    H    PHE  60           H        PHE  60   7.904   6.427   0.623
  487    HA   PHE  60           HA       PHE  60   8.679   5.517   3.264
  488    HB2  PHE  60           2HB      PHE  60   9.987   5.492   0.560
  489    HB3  PHE  60           1HB      PHE  60  10.939   5.169   2.007
  490    HD1  PHE  60           HD2      PHE  60   8.177   3.936  -0.110
  491    HD2  PHE  60           HD1      PHE  60  10.696   3.144   3.228
  492    HE1  PHE  60           HE2      PHE  60   7.448   1.581  -0.117
  493    HE2  PHE  60           HE1      PHE  60   9.978   0.801   3.231
  494    HZ   PHE  60           HZ       PHE  60   8.350   0.010   1.554
  495    H    ARG  61           H        ARG  61  10.322   6.365   4.567
  496    HA   ARG  61           HA       ARG  61  10.961   9.205   4.024
  497    HB2  ARG  61           2HB      ARG  61  10.530   7.806   6.671
  498    HB3  ARG  61           1HB      ARG  61  11.036   9.482   6.497
  499    HG2  ARG  61           2HG      ARG  61   8.436   8.328   5.493
  500    HG3  ARG  61           1HG      ARG  61   8.638   9.275   6.968
  501    HD2  ARG  61           2HD      ARG  61   9.178  10.228   4.150
  502    HD3  ARG  61           1HD      ARG  61   7.786  10.663   5.142
  503    HE   ARG  61           HE       ARG  61  10.523  11.611   5.447
  504   HH11  ARG  61          1HH1      ARG  61   7.306  11.530   6.692
  505   HH12  ARG  61          2HH1      ARG  61   7.546  12.919   7.689
  506   HH21  ARG  61          1HH2      ARG  61  10.805  13.401   6.717
  507   HH22  ARG  61          2HH2      ARG  61   9.499  13.982   7.692
  508    H    ASN  62           H        ASN  62  12.423   6.285   3.996
  509    HA   ASN  62           HA       ASN  62  15.049   7.420   4.581
  510    HB2  ASN  62           2HB      ASN  62  14.232   6.440   6.720
  511    HB3  ASN  62           1HB      ASN  62  14.062   4.890   5.920
  512   HD21  ASN  62          1HD2      ASN  62  15.507   3.866   7.265
  513   HD22  ASN  62          2HD2      ASN  62  17.207   4.168   7.204
  514    HA   PRO  63           HA       PRO  63  15.919   5.124   0.795
  515    HB2  PRO  63           2HB      PRO  63  18.687   5.056   1.204
  516    HB3  PRO  63           1HB      PRO  63  17.799   6.341   0.381
  517    HG2  PRO  63           2HG      PRO  63  18.752   6.206   3.213
  518    HG3  PRO  63           1HG      PRO  63  18.734   7.587   2.100
  519    HD2  PRO  63           2HD      PRO  63  16.911   7.368   4.036
  520    HD3  PRO  63           1HD      PRO  63  16.455   7.979   2.430
  521    H    ASP  64           H        ASP  64  17.441   4.223   3.892
  522    HA   ASP  64           HA       ASP  64  17.964   1.513   3.135
  523    HB2  ASP  64           2HB      ASP  64  17.774   2.760   5.891
  524    HB3  ASP  64           1HB      ASP  64  18.472   1.183   5.522
  525    H    ASP  65           H        ASP  65  15.301   3.136   4.797
  526    HA   ASP  65           HA       ASP  65  13.817   0.884   5.603
  527    HB2  ASP  65           2HB      ASP  65  13.384   3.194   6.374
  528    HB3  ASP  65           1HB      ASP  65  12.834   3.630   4.761
  529    H    ILE  66           H        ILE  66  13.925   2.672   2.559
  530    HA   ILE  66           HA       ILE  66  11.880   1.429   1.126
  531    HB   ILE  66           HB       ILE  66  14.553   2.392   0.066
  532   HG12  ILE  66          2HG1      ILE  66  11.889   3.838   0.247
  533   HG13  ILE  66          1HG1      ILE  66  13.275   4.129   1.292
  534   HG21  ILE  66          1HG2      ILE  66  13.405   2.591  -2.093
  535   HG22  ILE  66          2HG2      ILE  66  11.950   1.888  -1.386
  536   HG23  ILE  66          3HG2      ILE  66  13.421   0.924  -1.521
  537   HD11  ILE  66          3HD1      ILE  66  14.570   4.919  -0.596
  538   HD12  ILE  66          1HD1      ILE  66  13.055   5.814  -0.467
  539   HD13  ILE  66          2HD1      ILE  66  13.234   4.555  -1.689
  540    H    LEU  67           H        LEU  67  15.362   0.600   0.919
  541    HA   LEU  67           HA       LEU  67  14.956  -1.750  -0.579
  542    HB2  LEU  67           2HB      LEU  67  17.323  -2.268  -0.026
  543    HB3  LEU  67           1HB      LEU  67  17.071  -0.660  -0.667
  544    HG   LEU  67           HG       LEU  67  17.064   0.070   1.847
  545   HD11  LEU  67          1HD1      LEU  67  17.049  -2.135   2.846
  546   HD12  LEU  67          2HD1      LEU  67  18.533  -1.283   3.268
  547   HD13  LEU  67          3HD1      LEU  67  18.560  -2.543   2.032
  548   HD21  LEU  67          3HD2      LEU  67  18.728   0.762   0.207
  549   HD22  LEU  67          1HD2      LEU  67  19.609  -0.748   0.447
  550   HD23  LEU  67          2HD2      LEU  67  19.476   0.415   1.767
  551    H    LEU  68           H        LEU  68  14.941  -1.187   2.860
  552    HA   LEU  68           HA       LEU  68  15.254  -3.806   3.804
  553    HB2  LEU  68           2HB      LEU  68  15.351  -1.927   5.301
  554    HB3  LEU  68           1HB      LEU  68  13.710  -1.457   4.906
  555    HG   LEU  68           HG       LEU  68  12.867  -3.509   6.006
  556   HD11  LEU  68          1HD1      LEU  68  14.807  -4.949   5.693
  557   HD12  LEU  68          2HD1      LEU  68  14.387  -4.840   7.401
  558   HD13  LEU  68          3HD1      LEU  68  15.760  -3.930   6.772
  559   HD21  LEU  68          3HD2      LEU  68  14.661  -1.803   7.739
  560   HD22  LEU  68          1HD2      LEU  68  13.318  -2.797   8.305
  561   HD23  LEU  68          2HD2      LEU  68  13.011  -1.415   7.255
  562    H    PHE  69           H        PHE  69  12.205  -2.013   3.244
  563    HA   PHE  69           HA       PHE  69  10.693  -4.425   3.680
  564    HB2  PHE  69           2HB      PHE  69  10.075  -1.556   3.461
  565    HB3  PHE  69           1HB      PHE  69   8.808  -2.637   2.879
  566    HD1  PHE  69           HD1      PHE  69  10.913  -1.805   5.823
  567    HD2  PHE  69           HD2      PHE  69   7.494  -3.893   4.371
  568    HE1  PHE  69           HE1      PHE  69  10.221  -2.277   8.133
  569    HE2  PHE  69           HE2      PHE  69   6.797  -4.365   6.676
  570    HZ   PHE  69           HZ       PHE  69   8.159  -3.558   8.566
  571    H    ARG  70           H        ARG  70  11.753  -2.686   0.795
  572    HA   ARG  70           HA       ARG  70  10.072  -3.909  -1.082
  573    HB2  ARG  70           2HB      ARG  70  11.660  -2.211  -1.814
  574    HB3  ARG  70           1HB      ARG  70  13.019  -3.233  -1.352
  575    HG2  ARG  70           2HG      ARG  70  12.235  -4.905  -3.057
  576    HG3  ARG  70           1HG      ARG  70  11.050  -3.716  -3.592
  577    HD2  ARG  70           2HD      ARG  70  14.016  -3.184  -3.539
  578    HD3  ARG  70           1HD      ARG  70  13.183  -3.861  -4.936
  579    HE   ARG  70           HE       ARG  70  12.755  -1.160  -3.841
  580   HH11  ARG  70          1HH1      ARG  70  12.489  -3.430  -6.433
  581   HH12  ARG  70          2HH1      ARG  70  12.080  -2.217  -7.591
  582   HH21  ARG  70          1HH2      ARG  70  12.246   0.383  -5.358
  583   HH22  ARG  70          2HH2      ARG  70  11.948  -0.097  -6.996
  584    H    ASP  71           H        ASP  71  13.083  -5.086   0.363
  585    HA   ASP  71           HA       ASP  71  13.378  -7.463  -1.074
  586    HB2  ASP  71           2HB      ASP  71  15.186  -6.529   0.225
  587    HB3  ASP  71           1HB      ASP  71  14.274  -6.723   1.719
  588    H    ARG  72           H        ARG  72  11.960  -7.078   2.208
  589    HA   ARG  72           HA       ARG  72  11.251  -9.807   2.464
  590    HB2  ARG  72           2HB      ARG  72   9.842  -9.043   4.383
  591    HB3  ARG  72           1HB      ARG  72  11.518  -8.517   4.454
  592    HG2  ARG  72           2HG      ARG  72  10.860  -6.300   3.655
  593    HG3  ARG  72           1HG      ARG  72   9.178  -6.824   3.581
  594    HD2  ARG  72           2HD      ARG  72  10.816  -6.896   6.111
  595    HD3  ARG  72           1HD      ARG  72   9.847  -5.504   5.633
  596    HE   ARG  72           HE       ARG  72   7.954  -7.276   5.595
  597   HH11  ARG  72          1HH1      ARG  72  10.605  -7.305   7.803
  598   HH12  ARG  72          2HH1      ARG  72   9.648  -7.934   9.099
  599   HH21  ARG  72          1HH2      ARG  72   6.755  -8.090   7.277
  600   HH22  ARG  72          2HH2      ARG  72   7.517  -8.380   8.806
  601    H    PHE  73           H        PHE  73   9.635  -7.180   0.883
  602    HA   PHE  73           HA       PHE  73   7.140  -8.663   0.662
  603    HB2  PHE  73           2HB      PHE  73   8.049  -5.933  -0.185
  604    HB3  PHE  73           1HB      PHE  73   6.664  -6.652  -0.997
  605    HD1  PHE  73           HD2      PHE  73   7.917  -6.156   2.506
  606    HD2  PHE  73           HD1      PHE  73   4.588  -6.147  -0.154
  607    HE1  PHE  73           HE2      PHE  73   6.451  -5.438   4.344
  608    HE2  PHE  73           HE1      PHE  73   3.124  -5.429   1.682
  609    HZ   PHE  73           HZ       PHE  73   4.054  -5.073   3.934
  610    H    ASP  74           H        ASP  74   8.810  -7.009  -1.987
  611    HA   ASP  74           HA       ASP  74   8.843  -7.585  -4.221
  612    HB2  ASP  74           2HB      ASP  74  11.050  -8.106  -3.177
  613    HB3  ASP  74           1HB      ASP  74  10.543  -9.786  -3.028
  614    H    GLY  75           H        GLY  75   6.598  -8.209  -4.495
  615    HA2  GLY  75           2HA      GLY  75   5.025  -9.623  -5.424
  616    HA3  GLY  75           1HA      GLY  75   6.289 -10.826  -5.614
  617    H    TYR  76           H        TYR  76   5.050  -9.281  -2.678
  618    HA   TYR  76           HA       TYR  76   4.956 -11.810  -1.301
  619    HB2  TYR  76           2HB      TYR  76   5.718 -10.200   0.122
  620    HB3  TYR  76           1HB      TYR  76   4.775  -8.925  -0.625
  621    HD1  TYR  76           HD2      TYR  76   4.244 -11.977   1.508
  622    HD2  TYR  76           HD1      TYR  76   3.096  -7.988   0.591
  623    HE1  TYR  76           HE2      TYR  76   2.716 -11.979   3.439
  624    HE2  TYR  76           HE1      TYR  76   1.574  -7.968   2.499
  625    HH   TYR  76           HH       TYR  76   0.445  -9.387   3.996
  626    H    ILE  77           H        ILE  77   3.307 -13.149  -1.532
  627    HA   ILE  77           HA       ILE  77   0.738 -12.318  -2.509
  628    HB   ILE  77           HB       ILE  77   1.601 -15.025  -1.458
  629   HG12  ILE  77          2HG1      ILE  77   2.929 -14.258  -3.410
  630   HG13  ILE  77          1HG1      ILE  77   1.924 -15.650  -3.797
  631   HG21  ILE  77          1HG2      ILE  77  -0.821 -14.784  -1.426
  632   HG22  ILE  77          2HG2      ILE  77  -0.335 -15.900  -2.702
  633   HG23  ILE  77          3HG2      ILE  77  -0.813 -14.252  -3.107
  634   HD11  ILE  77          3HD1      ILE  77   0.311 -14.176  -4.891
  635   HD12  ILE  77          1HD1      ILE  77   1.919 -14.024  -5.595
  636   HD13  ILE  77          2HD1      ILE  77   1.318 -12.783  -4.498
  637    H    PHE  78           H        PHE  78  -0.567 -11.202  -1.156
  638    HA   PHE  78           HA       PHE  78  -0.977 -12.209   1.585
  639    HB2  PHE  78           2HB      PHE  78  -0.412  -9.831   1.425
  640    HB3  PHE  78           1HB      PHE  78  -1.760  -9.563   0.323
  641    HD1  PHE  78           HD1      PHE  78  -0.972 -10.679   3.788
  642    HD2  PHE  78           HD2      PHE  78  -3.862  -8.961   1.166
  643    HE1  PHE  78           HE1      PHE  78  -2.433 -10.206   5.709
  644    HE2  PHE  78           HE2      PHE  78  -5.324  -8.488   3.087
  645    HZ   PHE  78           HZ       PHE  78  -4.609  -9.111   5.359
  646    H    LEU  79           H        LEU  79  -2.810 -13.268   2.090
  647    HA   LEU  79           HA       LEU  79  -4.916 -13.460   0.048
  648    HB2  LEU  79           2HB      LEU  79  -4.181 -15.214   2.387
  649    HB3  LEU  79           1HB      LEU  79  -5.647 -15.447   1.451
  650    HG   LEU  79           HG       LEU  79  -2.871 -15.527   0.247
  651   HD11  LEU  79          1HD1      LEU  79  -3.146 -17.338   1.885
  652   HD12  LEU  79          2HD1      LEU  79  -3.086 -17.952   0.232
  653   HD13  LEU  79          3HD1      LEU  79  -4.633 -17.838   1.076
  654   HD21  LEU  79          3HD2      LEU  79  -4.010 -16.591  -1.635
  655   HD22  LEU  79          1HD2      LEU  79  -4.652 -14.977  -1.325
  656   HD23  LEU  79          2HD2      LEU  79  -5.559 -16.398  -0.813
  657    H    ASP  80           H        ASP  80  -6.850 -12.568   0.326
  658    HA   ASP  80           HA       ASP  80  -7.630 -11.134   2.655
  659    HB2  ASP  80           2HB      ASP  80  -8.402 -10.617   0.341
  660    HB3  ASP  80           1HB      ASP  80  -9.333 -12.109   0.339
  661    H    SER  81           H        SER  81  -9.853 -11.605   3.723
  662    HA   SER  81           HA       SER  81  -9.894 -14.042   5.084
  663    HB2  SER  81           2HB      SER  81 -12.205 -12.156   4.531
  664    HB3  SER  81           1HB      SER  81 -12.227 -13.450   5.727
  665    HG   SER  81           HG       SER  81 -10.728 -11.058   5.716
  666    H    LYS  82           H        LYS  82 -11.426 -13.119   2.050
  667    HA   LYS  82           HA       LYS  82 -12.767 -15.681   1.745
  668    HB2  LYS  82           2HB      LYS  82 -12.572 -13.194   0.066
  669    HB3  LYS  82           1HB      LYS  82 -13.255 -14.672  -0.597
  670    HG2  LYS  82           2HG      LYS  82 -14.263 -13.291   1.890
  671    HG3  LYS  82           1HG      LYS  82 -14.954 -13.096   0.276
  672    HD2  LYS  82           2HD      LYS  82 -15.424 -15.514   0.196
  673    HD3  LYS  82           1HD      LYS  82 -14.759 -15.690   1.823
  674    HE2  LYS  82           2HE      LYS  82 -16.503 -14.258   2.719
  675    HE3  LYS  82           1HE      LYS  82 -17.133 -13.966   1.098
  676    HZ1  LYS  82           3HZ      LYS  82 -18.428 -15.628   2.268
  677    HZ2  LYS  82           1HZ      LYS  82 -17.057 -16.597   2.476
  678    HZ3  LYS  82           2HZ      LYS  82 -17.667 -16.313   0.925
  679    H    GLY  83           H        GLY  83  -9.639 -15.043   1.607
  680    HA2  GLY  83           2HA      GLY  83  -7.881 -16.271   0.754
  681    HA3  GLY  83           1HA      GLY  83  -9.049 -17.290  -0.067
  682    H    LEU  84           H        LEU  84  -8.919 -13.814  -0.557
  683    HA   LEU  84           HA       LEU  84  -8.446 -14.188  -3.383
  684    HB2  LEU  84           2HB      LEU  84  -8.682 -11.637  -1.775
  685    HB3  LEU  84           1HB      LEU  84  -8.686 -11.744  -3.526
  686    HG   LEU  84           HG       LEU  84 -10.799 -12.905  -1.695
  687   HD11  LEU  84          1HD1      LEU  84 -12.257 -11.169  -2.617
  688   HD12  LEU  84          2HD1      LEU  84 -10.899 -10.505  -3.527
  689   HD13  LEU  84          3HD1      LEU  84 -10.884 -10.468  -1.763
  690   HD21  LEU  84          3HD2      LEU  84 -10.517 -14.242  -3.721
  691   HD22  LEU  84          1HD2      LEU  84 -10.682 -12.791  -4.713
  692   HD23  LEU  84          2HD2      LEU  84 -12.046 -13.364  -3.752
  693    H    GLU  85           H        GLU  85  -6.506 -14.210  -4.351
  694    HA   GLU  85           HA       GLU  85  -4.097 -13.809  -2.840
  695    HB2  GLU  85           2HB      GLU  85  -4.470 -14.401  -5.788
  696    HB3  GLU  85           1HB      GLU  85  -2.951 -14.496  -4.910
  697    HG2  GLU  85           2HG      GLU  85  -3.865 -16.290  -3.519
  698    HG3  GLU  85           1HG      GLU  85  -5.390 -16.193  -4.398
  699    H    TYR  86           H        TYR  86  -3.307 -11.816  -2.463
  700    HA   TYR  86           HA       TYR  86  -3.323  -9.832  -4.654
  701    HB2  TYR  86           2HB      TYR  86  -2.835  -9.308  -1.709
  702    HB3  TYR  86           1HB      TYR  86  -3.055  -8.104  -2.973
  703    HD1  TYR  86           HD1      TYR  86  -5.393  -8.589  -4.358
  704    HD2  TYR  86           HD2      TYR  86  -4.619  -9.530  -0.279
  705    HE1  TYR  86           HE1      TYR  86  -7.806  -8.536  -3.892
  706    HE2  TYR  86           HE2      TYR  86  -7.026  -9.483   0.194
  707    HH   TYR  86           HH       TYR  86  -9.068  -8.574  -0.703
  708    HA   PRO  87           HA       PRO  87   1.126 -10.898  -4.520
  709    HB2  PRO  87           2HB      PRO  87   1.709 -10.202  -7.062
  710    HB3  PRO  87           1HB      PRO  87   0.909 -11.728  -6.661
  711    HG2  PRO  87           2HG      PRO  87  -0.281  -9.173  -7.681
  712    HG3  PRO  87           1HG      PRO  87  -0.650 -10.843  -8.148
  713    HD2  PRO  87           2HD      PRO  87  -2.173  -9.367  -6.399
  714    HD3  PRO  87           1HD      PRO  87  -2.097 -11.139  -6.387
  715    H    ALA  88           H        ALA  88   1.460  -9.175  -3.000
  716    HA   ALA  88           HA       ALA  88   1.564  -6.446  -3.710
  717    HB1  ALA  88           3HB      ALA  88   2.899  -7.885  -1.415
  718    HB2  ALA  88           1HB      ALA  88   1.292  -7.159  -1.407
  719    HB3  ALA  88           2HB      ALA  88   2.720  -6.138  -1.557
  720    H    VAL  89           H        VAL  89   2.793  -6.144  -5.557
  721    HA   VAL  89           HA       VAL  89   5.657  -6.800  -5.510
  722    HB   VAL  89           HB       VAL  89   4.026  -5.513  -7.725
  723   HG11  VAL  89          1HG1      VAL  89   6.801  -6.708  -7.756
  724   HG12  VAL  89          2HG1      VAL  89   6.395  -4.999  -7.902
  725   HG13  VAL  89          3HG1      VAL  89   5.921  -6.127  -9.172
  726   HG21  VAL  89          3HG2      VAL  89   3.236  -7.781  -7.224
  727   HG22  VAL  89          1HG2      VAL  89   4.876  -8.398  -7.418
  728   HG23  VAL  89          2HG2      VAL  89   4.023  -7.707  -8.800
  729    H    VAL  90           H        VAL  90   7.292  -5.186  -5.619
  730    HA   VAL  90           HA       VAL  90   6.397  -2.505  -4.753
  731    HB   VAL  90           HB       VAL  90   9.118  -3.790  -4.387
  732   HG11  VAL  90          1HG1      VAL  90   7.961  -1.230  -3.261
  733   HG12  VAL  90          2HG1      VAL  90   9.246  -1.359  -4.463
  734   HG13  VAL  90          3HG1      VAL  90   9.521  -1.928  -2.817
  735   HG21  VAL  90          3HG2      VAL  90   7.387  -4.952  -3.086
  736   HG22  VAL  90          1HG2      VAL  90   6.885  -3.418  -2.375
  737   HG23  VAL  90          2HG2      VAL  90   8.489  -4.066  -2.032
  738    H    GLU  91           H        GLU  91   6.896  -0.710  -5.922
  739    HA   GLU  91           HA       GLU  91   9.003  -0.811  -7.952
  740    HB2  GLU  91           2HB      GLU  91   7.600  -0.050  -9.751
  741    HB3  GLU  91           1HB      GLU  91   6.887  -1.510  -9.085
  742    HG2  GLU  91           2HG      GLU  91   5.258  -0.151  -7.851
  743    HG3  GLU  91           1HG      GLU  91   5.974   1.313  -8.525
  744    H    PHE  92           H        PHE  92   9.613   1.358  -8.744
  745    HA   PHE  92           HA       PHE  92   9.095   3.390  -6.673
  746    HB2  PHE  92           2HB      PHE  92  11.176   4.362  -7.168
  747    HB3  PHE  92           1HB      PHE  92  11.487   2.640  -7.324
  748    HD1  PHE  92           HD1      PHE  92  11.393   1.647  -9.714
  749    HD2  PHE  92           HD2      PHE  92  11.712   5.816  -8.907
  750    HE1  PHE  92           HE1      PHE  92  12.266   2.020 -11.983
  751    HE2  PHE  92           HE2      PHE  92  12.584   6.193 -11.174
  752    HZ   PHE  92           HZ       PHE  92  12.863   4.290 -12.719
  753    H    ALA  93           H        ALA  93   8.473   5.511  -7.203
  754    HA   ALA  93           HA       ALA  93   7.010   5.814  -9.681
  755    HB1  ALA  93           3HB      ALA  93   6.088   6.714  -7.598
  756    HB2  ALA  93           1HB      ALA  93   6.336   7.991  -8.789
  757    HB3  ALA  93           2HB      ALA  93   7.468   7.801  -7.451
  758    HA   PRO  94           HA       PRO  94  10.434   7.421 -11.997
  759    HB2  PRO  94           2HB      PRO  94   9.045   8.751 -13.957
  760    HB3  PRO  94           1HB      PRO  94   9.270   6.998 -13.923
  761    HG2  PRO  94           2HG      PRO  94   6.915   8.624 -13.017
  762    HG3  PRO  94           1HG      PRO  94   6.940   7.116 -13.953
  763    HD2  PRO  94           2HD      PRO  94   6.404   7.124 -11.318
  764    HD3  PRO  94           1HD      PRO  94   7.327   5.805 -12.070
  765    H    PHE  95           H        PHE  95  11.672   9.234 -12.112
  766    HA   PHE  95           HA       PHE  95  10.537  11.740 -11.030
  767    HB2  PHE  95           2HB      PHE  95  12.751  12.203 -10.059
  768    HB3  PHE  95           1HB      PHE  95  12.095  10.687  -9.455
  769    HD1  PHE  95           HD2      PHE  95  13.014   8.526 -10.270
  770    HD2  PHE  95           HD1      PHE  95  14.784  12.261 -11.305
  771    HE1  PHE  95           HE2      PHE  95  15.070   7.361 -10.953
  772    HE2  PHE  95           HE1      PHE  95  16.840  11.101 -11.988
  773    HZ   PHE  95           HZ       PHE  95  16.989   8.648 -11.812
  774    H    GLN  96           H        GLN  96  12.140  13.651 -11.589
  775    HA   GLN  96           HA       GLN  96  12.833  13.443 -14.454
  776    HB2  GLN  96           2HB      GLN  96  11.590  15.744 -12.942
  777    HB3  GLN  96           1HB      GLN  96  12.316  15.933 -14.536
  778    HG2  GLN  96           2HG      GLN  96  10.055  14.042 -13.896
  779    HG3  GLN  96           1HG      GLN  96   9.859  15.647 -14.600
  780   HE21  GLN  96          1HE2      GLN  96  11.149  12.429 -15.145
  781   HE22  GLN  96          2HE2      GLN  96  11.192  12.540 -16.867
  782    H    LYS  97           H        LYS  97  14.526  14.817 -15.232
  783    HA   LYS  97           HA       LYS  97  16.875  14.708 -13.735
  784    HB2  LYS  97           2HB      LYS  97  16.836  14.747 -16.185
  785    HB3  LYS  97           1HB      LYS  97  16.251  16.403 -16.167
  786    HG2  LYS  97           2HG      LYS  97  18.607  16.368 -16.683
  787    HG3  LYS  97           1HG      LYS  97  18.351  17.124 -15.109
  788    HD2  LYS  97           2HD      LYS  97  18.975  15.025 -14.001
  789    HD3  LYS  97           1HD      LYS  97  19.226  14.265 -15.573
  790    HE2  LYS  97           2HE      LYS  97  21.351  14.957 -14.600
  791    HE3  LYS  97           1HE      LYS  97  21.009  15.878 -16.063
  792    HZ1  LYS  97           3HZ      LYS  97  20.516  16.850 -13.300
  793    HZ2  LYS  97           1HZ      LYS  97  20.322  17.739 -14.726
  794    HZ3  LYS  97           2HZ      LYS  97  21.862  17.253 -14.239
  Start of MODEL   15
    1    H1   MET   1           1H       MET   1  37.318   9.653  10.300
    2    H2   MET   1           2H       MET   1  36.234   9.482   9.016
    3    H3   MET   1           3H       MET   1  35.699   9.271  10.604
    4    HA   MET   1           HA       MET   1  36.079  11.571  11.111
    5    HB2  MET   1           2HB      MET   1  36.986  11.740   8.225
    6    HB3  MET   1           1HB      MET   1  36.732  13.125   9.278
    7    HG2  MET   1           2HG      MET   1  38.488  12.291  10.777
    8    HG3  MET   1           1HG      MET   1  38.753  10.930   9.689
    9    HE1  MET   1           3HE      MET   1  41.952  13.147   9.191
   10    HE2  MET   1           1HE      MET   1  41.338  11.555   9.635
   11    HE3  MET   1           2HE      MET   1  41.046  12.938  10.689
   12    H    GLY   2           H        GLY   2  34.528  13.290  10.568
   13    HA2  GLY   2           2HA      GLY   2  32.608  14.163   9.611
   14    HA3  GLY   2           1HA      GLY   2  32.638  12.872   8.427
   15    H    HIS   3           H        HIS   3  31.793  10.744   9.114
   16    HA   HIS   3           HA       HIS   3  30.063   9.466   9.837
   17    HB2  HIS   3           2HB      HIS   3  30.438  11.116  12.340
   18    HB3  HIS   3           1HB      HIS   3  29.325   9.757  12.238
   19    HD1  HIS   3           HD1      HIS   3  32.656  10.521  13.248
   20    HD2  HIS   3           HD2      HIS   3  30.831   7.281  11.393
   21    HE1  HIS   3           HE1      HIS   3  34.210   8.588  13.592
   22    HE2  HIS   3           HE2      HIS   3  32.997   6.607  12.639
   23    H    HIS   4           H        HIS   4  29.516  12.094   8.484
   24    HA   HIS   4           HA       HIS   4  26.883  12.787   9.542
   25    HB2  HIS   4           2HB      HIS   4  28.282  14.643   8.824
   26    HB3  HIS   4           1HB      HIS   4  28.438  13.945   7.213
   27    HD1  HIS   4           HD1      HIS   4  25.681  15.254   9.495
   28    HD2  HIS   4           HD2      HIS   4  26.560  14.846   5.451
   29    HE1  HIS   4           HE1      HIS   4  23.770  16.330   8.276
   30    HE2  HIS   4           HE2      HIS   4  24.260  15.961   5.839
   31    H    HIS   5           H        HIS   5  25.295  11.422   9.044
   32    HA   HIS   5           HA       HIS   5  25.110  10.306   6.327
   33    HB2  HIS   5           2HB      HIS   5  23.699   9.565   8.901
   34    HB3  HIS   5           1HB      HIS   5  23.338   8.833   7.341
   35    HD1  HIS   5           HD1      HIS   5  24.179   6.494   7.761
   36    HD2  HIS   5           HD2      HIS   5  27.004   9.387   8.714
   37    HE1  HIS   5           HE1      HIS   5  26.291   5.236   8.247
   38    HE2  HIS   5           HE2      HIS   5  28.024   7.014   8.614
   39    H    HIS   6           H        HIS   6  22.503   9.941   5.873
   40    HA   HIS   6           HA       HIS   6  21.156  12.522   6.255
   41    HB2  HIS   6           2HB      HIS   6  20.599  12.471   3.738
   42    HB3  HIS   6           1HB      HIS   6  22.211  12.992   4.213
   43    HD1  HIS   6           HD1      HIS   6  24.059  11.915   2.976
   44    HD2  HIS   6           HD2      HIS   6  20.626   9.576   2.945
   45    HE1  HIS   6           HE1      HIS   6  24.606   9.942   1.531
   46    HE2  HIS   6           HE2      HIS   6  22.616   8.430   1.759
   47    H    HIS   7           H        HIS   7  18.919  12.504   6.095
   48    HA   HIS   7           HA       HIS   7  17.657   9.863   6.262
   49    HB2  HIS   7           2HB      HIS   7  16.555  12.630   6.824
   50    HB3  HIS   7           1HB      HIS   7  15.661  11.129   7.045
   51    HD1  HIS   7           HD1      HIS   7  17.270  13.498   9.013
   52    HD2  HIS   7           HD2      HIS   7  17.450   9.351   8.883
   53    HE1  HIS   7           HE1      HIS   7  18.097  12.793  11.270
   54    HE2  HIS   7           HE2      HIS   7  17.956  10.286  11.238
   55    H    HIS   8           H        HIS   8  18.259  12.141   3.908
   56    HA   HIS   8           HA       HIS   8  15.911  12.380   2.446
   57    HB2  HIS   8           2HB      HIS   8  17.909  13.691   1.955
   58    HB3  HIS   8           1HB      HIS   8  18.762  12.241   1.433
   59    HD1  HIS   8           HD1      HIS   8  18.415  11.485  -0.958
   60    HD2  HIS   8           HD2      HIS   8  15.842  14.552   0.160
   61    HE1  HIS   8           HE1      HIS   8  17.267  12.200  -3.067
   62    HE2  HIS   8           HE2      HIS   8  15.810  14.137  -2.394
   63    H    SER   9           H        SER   9  14.641  10.903   1.533
   64    HA   SER   9           HA       SER   9  15.842   8.564   0.191
   65    HB2  SER   9           2HB      SER   9  14.018   7.129   1.045
   66    HB3  SER   9           1HB      SER   9  14.982   7.789   2.367
   67    HG   SER   9           HG       SER   9  12.342   8.320   1.639
   68    H    HIS  10           H        HIS  10  14.365   7.544  -1.397
   69    HA   HIS  10           HA       HIS  10  12.779   9.548  -2.814
   70    HB2  HIS  10           2HB      HIS  10  13.712   6.768  -3.547
   71    HB3  HIS  10           1HB      HIS  10  12.618   7.699  -4.564
   72    HD1  HIS  10           HD1      HIS  10  14.075   8.260  -6.510
   73    HD2  HIS  10           HD2      HIS  10  15.924   9.083  -2.881
   74    HE1  HIS  10           HE1      HIS  10  16.208   9.444  -7.097
   75    HE2  HIS  10           HE2      HIS  10  17.389   9.774  -4.897
   76    H    MET  11           H        MET  11  10.678   8.840  -3.808
   77    HA   MET  11           HA       MET  11   9.006   7.671  -1.719
   78    HB2  MET  11           2HB      MET  11   7.105   8.585  -3.068
   79    HB3  MET  11           1HB      MET  11   8.242   9.794  -2.491
   80    HG2  MET  11           2HG      MET  11   8.169   8.667  -5.284
   81    HG3  MET  11           1HG      MET  11   7.496  10.218  -4.786
   82    HE1  MET  11           3HE      MET  11   8.882  11.463  -6.690
   83    HE2  MET  11           1HE      MET  11   9.555   9.919  -7.209
   84    HE3  MET  11           2HE      MET  11  10.625  11.288  -6.901
   85    H    VAL  12           H        VAL  12   8.698   5.561  -1.788
   86    HA   VAL  12           HA       VAL  12   8.448   4.185  -4.391
   87    HB   VAL  12           HB       VAL  12   9.204   3.023  -1.693
   88   HG11  VAL  12          1HG1      VAL  12   8.064   1.381  -3.086
   89   HG12  VAL  12          2HG1      VAL  12   9.781   0.995  -2.966
   90   HG13  VAL  12          3HG1      VAL  12   9.147   1.745  -4.431
   91   HG21  VAL  12          3HG2      VAL  12  10.918   3.616  -4.112
   92   HG22  VAL  12          1HG2      VAL  12  11.455   2.774  -2.658
   93   HG23  VAL  12          2HG2      VAL  12  10.966   4.465  -2.569
   94    H    VAL  13           H        VAL  13   6.617   2.995  -4.835
   95    HA   VAL  13           HA       VAL  13   4.454   3.103  -2.821
   96    HB   VAL  13           HB       VAL  13   2.841   3.473  -4.610
   97   HG11  VAL  13          1HG1      VAL  13   3.842   5.433  -3.550
   98   HG12  VAL  13          2HG1      VAL  13   3.478   5.755  -5.244
   99   HG13  VAL  13          3HG1      VAL  13   5.139   5.433  -4.745
  100   HG21  VAL  13          3HG2      VAL  13   5.226   3.511  -6.473
  101   HG22  VAL  13          1HG2      VAL  13   3.570   3.925  -6.918
  102   HG23  VAL  13          2HG2      VAL  13   3.962   2.281  -6.421
  103    H    ILE  14           H        ILE  14   2.553   1.616  -3.522
  104    HA   ILE  14           HA       ILE  14   3.666  -1.055  -4.115
  105    HB   ILE  14           HB       ILE  14   2.668  -0.644  -1.834
  106   HG12  ILE  14          2HG1      ILE  14   1.199  -2.744  -1.912
  107   HG13  ILE  14          1HG1      ILE  14   1.531  -2.781  -3.642
  108   HG21  ILE  14          1HG2      ILE  14   0.054  -0.520  -3.341
  109   HG22  ILE  14          2HG2      ILE  14   0.834   0.827  -2.510
  110   HG23  ILE  14          3HG2      ILE  14   0.248  -0.557  -1.585
  111   HD11  ILE  14          3HD1      ILE  14   3.567  -2.944  -1.428
  112   HD12  ILE  14          1HD1      ILE  14   3.936  -2.938  -3.154
  113   HD13  ILE  14          2HD1      ILE  14   3.016  -4.269  -2.451
  114    H    ARG  15           H        ARG  15   2.496  -2.455  -5.571
  115    HA   ARG  15           HA       ARG  15   0.443  -1.105  -7.209
  116    HB2  ARG  15           2HB      ARG  15   1.567  -1.646  -9.255
  117    HB3  ARG  15           1HB      ARG  15   2.720  -0.825  -8.211
  118    HG2  ARG  15           2HG      ARG  15   3.592  -3.093  -7.554
  119    HG3  ARG  15           1HG      ARG  15   2.573  -3.768  -8.824
  120    HD2  ARG  15           2HD      ARG  15   4.856  -1.827  -9.139
  121    HD3  ARG  15           1HD      ARG  15   4.785  -3.496  -9.701
  122    HE   ARG  15           HE       ARG  15   2.801  -1.668 -10.787
  123   HH11  ARG  15          1HH1      ARG  15   5.811  -3.273 -11.245
  124   HH12  ARG  15          2HH1      ARG  15   5.814  -2.999 -12.951
  125   HH21  ARG  15          1HH2      ARG  15   2.822  -1.323 -12.965
  126   HH22  ARG  15          2HH2      ARG  15   4.152  -1.905 -13.912
  127    H    ARG  16           H        ARG  16  -0.655  -2.538  -8.756
  128    HA   ARG  16           HA       ARG  16  -1.758  -4.387  -9.444
  129    HB2  ARG  16           2HB      ARG  16   0.375  -5.862  -7.892
  130    HB3  ARG  16           1HB      ARG  16  -0.878  -6.668  -8.830
  131    HG2  ARG  16           2HG      ARG  16  -0.057  -5.448 -10.851
  132    HG3  ARG  16           1HG      ARG  16   1.282  -4.838  -9.874
  133    HD2  ARG  16           2HD      ARG  16   2.039  -7.111  -9.449
  134    HD3  ARG  16           1HD      ARG  16   0.660  -7.759 -10.341
  135    HE   ARG  16           HE       ARG  16   2.670  -6.057 -11.666
  136   HH11  ARG  16          1HH1      ARG  16   0.927  -9.031 -11.464
  137   HH12  ARG  16          2HH1      ARG  16   1.502  -9.586 -12.998
  138   HH21  ARG  16          1HH2      ARG  16   3.380  -6.791 -13.628
  139   HH22  ARG  16          2HH2      ARG  16   2.859  -8.334 -14.206
  140    H    LEU  17           H        LEU  17  -2.302  -3.008  -6.808
  141    HA   LEU  17           HA       LEU  17  -3.522  -4.950  -5.088
  142    HB2  LEU  17           2HB      LEU  17  -3.677  -1.953  -5.301
  143    HB3  LEU  17           1HB      LEU  17  -4.743  -2.825  -4.219
  144    HG   LEU  17           HG       LEU  17  -2.802  -1.918  -3.032
  145   HD11  LEU  17          1HD1      LEU  17  -3.829  -3.936  -2.170
  146   HD12  LEU  17          2HD1      LEU  17  -2.086  -3.980  -1.905
  147   HD13  LEU  17          3HD1      LEU  17  -2.803  -4.934  -3.204
  148   HD21  LEU  17          3HD2      LEU  17  -1.153  -3.717  -4.813
  149   HD22  LEU  17          1HD2      LEU  17  -0.557  -2.789  -3.437
  150   HD23  LEU  17          2HD2      LEU  17  -1.182  -1.953  -4.858
  151    HA   PRO  18           HA       PRO  18  -7.324  -5.087  -7.575
  152    HB2  PRO  18           2HB      PRO  18  -8.007  -7.610  -6.988
  153    HB3  PRO  18           1HB      PRO  18  -6.658  -7.254  -8.072
  154    HG2  PRO  18           2HG      PRO  18  -6.626  -8.207  -5.263
  155    HG3  PRO  18           1HG      PRO  18  -5.459  -8.492  -6.564
  156    HD2  PRO  18           2HD      PRO  18  -5.286  -6.559  -4.467
  157    HD3  PRO  18           1HD      PRO  18  -4.176  -6.767  -5.835
  158    HA   PRO  19           HA       PRO  19 -10.507  -4.069  -4.631
  159    HB2  PRO  19           2HB      PRO  19 -12.353  -5.834  -6.161
  160    HB3  PRO  19           1HB      PRO  19 -12.505  -4.120  -5.767
  161    HG2  PRO  19           2HG      PRO  19 -11.883  -4.893  -8.240
  162    HG3  PRO  19           1HG      PRO  19 -11.131  -3.456  -7.520
  163    HD2  PRO  19           2HD      PRO  19  -9.994  -6.206  -7.894
  164    HD3  PRO  19           1HD      PRO  19  -9.209  -4.623  -8.095
  165    H    GLY  20           H        GLY  20 -10.452  -4.913  -2.627
  166    HA2  GLY  20           2HA      GLY  20 -11.679  -7.522  -2.149
  167    HA3  GLY  20           1HA      GLY  20 -10.001  -7.354  -1.654
  168    H    LEU  21           H        LEU  21  -9.900  -7.102   0.492
  169    HA   LEU  21           HA       LEU  21 -11.978  -6.108   2.113
  170    HB2  LEU  21           2HB      LEU  21 -10.456  -6.209   3.950
  171    HB3  LEU  21           1HB      LEU  21 -10.187  -7.607   2.927
  172    HG   LEU  21           HG       LEU  21  -8.427  -5.141   3.041
  173   HD11  LEU  21          1HD1      LEU  21  -8.296  -6.474   5.077
  174   HD12  LEU  21          2HD1      LEU  21  -6.807  -6.604   4.142
  175   HD13  LEU  21          3HD1      LEU  21  -7.977  -7.925   4.126
  176   HD21  LEU  21          3HD2      LEU  21  -6.843  -6.462   1.693
  177   HD22  LEU  21          1HD2      LEU  21  -8.347  -6.149   0.829
  178   HD23  LEU  21          2HD2      LEU  21  -8.052  -7.738   1.535
  179    H    THR  22           H        THR  22 -12.046  -4.174   3.417
  180    HA   THR  22           HA       THR  22 -11.560  -1.837   1.828
  181    HB   THR  22           HB       THR  22 -12.621  -2.055   4.661
  182    HG1  THR  22           HG1      THR  22 -13.786  -2.312   2.122
  183   HG21  THR  22          3HG2      THR  22 -12.751   0.255   2.708
  184   HG22  THR  22          1HG2      THR  22 -11.810   0.209   4.201
  185   HG23  THR  22          2HG2      THR  22 -13.575   0.184   4.267
  186    H    LYS  23           H        LYS  23 -10.398   0.059   2.501
  187    HA   LYS  23           HA       LYS  23  -7.742  -0.338   2.891
  188    HB2  LYS  23           2HB      LYS  23  -7.529   2.055   3.356
  189    HB3  LYS  23           1HB      LYS  23  -8.653   1.746   2.041
  190    HG2  LYS  23           2HG      LYS  23 -10.542   2.110   3.547
  191    HG3  LYS  23           1HG      LYS  23  -9.430   2.382   4.891
  192    HD2  LYS  23           2HD      LYS  23  -9.617   4.064   2.381
  193    HD3  LYS  23           1HD      LYS  23 -10.269   4.498   3.962
  194    HE2  LYS  23           2HE      LYS  23  -8.029   4.536   4.908
  195    HE3  LYS  23           1HE      LYS  23  -7.344   4.009   3.371
  196    HZ1  LYS  23           3HZ      LYS  23  -8.204   6.068   2.372
  197    HZ2  LYS  23           1HZ      LYS  23  -7.083   6.369   3.603
  198    HZ3  LYS  23           2HZ      LYS  23  -8.735   6.576   3.892
  199    H    GLU  24           H        GLU  24 -10.099   0.148   5.490
  200    HA   GLU  24           HA       GLU  24  -8.464   0.790   7.612
  201    HB2  GLU  24           2HB      GLU  24 -10.846  -1.075   7.676
  202    HB3  GLU  24           1HB      GLU  24 -10.131  -0.287   9.078
  203    HG2  GLU  24           2HG      GLU  24 -10.685   1.907   8.091
  204    HG3  GLU  24           1HG      GLU  24 -11.473   1.079   6.749
  205    H    GLN  25           H        GLN  25  -8.979  -2.411   6.213
  206    HA   GLN  25           HA       GLN  25  -6.925  -3.528   8.022
  207    HB2  GLN  25           2HB      GLN  25  -8.805  -5.000   6.150
  208    HB3  GLN  25           1HB      GLN  25  -7.728  -5.727   7.338
  209    HG2  GLN  25           2HG      GLN  25  -9.016  -4.656   9.141
  210    HG3  GLN  25           1HG      GLN  25 -10.104  -3.964   7.937
  211   HE21  GLN  25          1HE2      GLN  25 -11.555  -5.327   6.854
  212   HE22  GLN  25          2HE2      GLN  25 -11.914  -6.914   7.431
  213    H    LEU  26           H        LEU  26  -7.792  -3.127   4.631
  214    HA   LEU  26           HA       LEU  26  -5.766  -4.497   3.356
  215    HB2  LEU  26           2HB      LEU  26  -7.475  -3.710   2.007
  216    HB3  LEU  26           1HB      LEU  26  -7.419  -2.099   2.681
  217    HG   LEU  26           HG       LEU  26  -5.284  -1.709   1.438
  218   HD11  LEU  26          1HD1      LEU  26  -5.920  -4.359   0.137
  219   HD12  LEU  26          2HD1      LEU  26  -4.565  -4.037   1.222
  220   HD13  LEU  26          3HD1      LEU  26  -4.646  -3.233  -0.345
  221   HD21  LEU  26          3HD2      LEU  26  -7.651  -2.513  -0.259
  222   HD22  LEU  26          1HD2      LEU  26  -6.338  -1.440  -0.746
  223   HD23  LEU  26          2HD2      LEU  26  -7.435  -0.959   0.548
  224    H    GLU  27           H        GLU  27  -5.572  -1.319   4.889
  225    HA   GLU  27           HA       GLU  27  -3.135  -0.553   3.599
  226    HB2  GLU  27           2HB      GLU  27  -3.173   1.389   5.002
  227    HB3  GLU  27           1HB      GLU  27  -4.824   1.055   4.498
  228    HG2  GLU  27           2HG      GLU  27  -5.243  -0.022   6.680
  229    HG3  GLU  27           1HG      GLU  27  -3.612   0.410   7.183
  230    H    GLU  28           H        GLU  28  -3.789  -2.459   6.443
  231    HA   GLU  28           HA       GLU  28  -1.607  -1.730   8.038
  232    HB2  GLU  28           2HB      GLU  28  -2.008  -3.700   9.325
  233    HB3  GLU  28           1HB      GLU  28  -3.565  -3.097   8.784
  234    HG2  GLU  28           2HG      GLU  28  -3.581  -4.787   6.995
  235    HG3  GLU  28           1HG      GLU  28  -2.043  -5.405   7.587
  236    H    GLN  29           H        GLN  29  -1.796  -4.319   5.579
  237    HA   GLN  29           HA       GLN  29   1.009  -4.968   5.951
  238    HB2  GLN  29           2HB      GLN  29   0.644  -6.523   3.995
  239    HB3  GLN  29           1HB      GLN  29  -0.335  -6.844   5.415
  240    HG2  GLN  29           2HG      GLN  29  -1.487  -5.155   3.242
  241    HG3  GLN  29           1HG      GLN  29  -1.363  -6.895   2.993
  242   HE21  GLN  29          1HE2      GLN  29  -3.717  -5.157   3.300
  243   HE22  GLN  29          2HE2      GLN  29  -4.619  -5.824   4.618
  244    H    LEU  30           H        LEU  30  -0.660  -2.606   4.231
  245    HA   LEU  30           HA       LEU  30   1.367  -2.345   2.152
  246    HB2  LEU  30           2HB      LEU  30  -1.035  -0.620   2.774
  247    HB3  LEU  30           1HB      LEU  30   0.030  -0.410   1.396
  248    HG   LEU  30           HG       LEU  30  -1.812  -2.757   1.910
  249   HD11  LEU  30          1HD1      LEU  30  -2.957  -0.759   1.128
  250   HD12  LEU  30          2HD1      LEU  30  -2.934  -1.996  -0.129
  251   HD13  LEU  30          3HD1      LEU  30  -1.832  -0.621  -0.223
  252   HD21  LEU  30          3HD2      LEU  30   0.135  -2.311  -0.360
  253   HD22  LEU  30          1HD2      LEU  30  -1.066  -3.604  -0.272
  254   HD23  LEU  30          2HD2      LEU  30   0.259  -3.551   0.888
  255    H    ARG  31           H        ARG  31   0.723  -1.133   5.316
  256    HA   ARG  31           HA       ARG  31   3.204   0.422   5.103
  257    HB2  ARG  31           2HB      ARG  31   2.286   2.188   6.582
  258    HB3  ARG  31           1HB      ARG  31   1.509   2.118   5.011
  259    HG2  ARG  31           2HG      ARG  31  -0.479   1.228   5.907
  260    HG3  ARG  31           1HG      ARG  31   0.301   0.797   7.433
  261    HD2  ARG  31           2HD      ARG  31   0.571   3.146   7.994
  262    HD3  ARG  31           1HD      ARG  31  -0.084   3.621   6.429
  263    HE   ARG  31           HE       ARG  31  -2.233   2.759   7.162
  264   HH11  ARG  31          1HH1      ARG  31   0.137   3.164   9.645
  265   HH12  ARG  31          2HH1      ARG  31  -1.055   3.423  10.872
  266   HH21  ARG  31          1HH2      ARG  31  -3.726   3.110   8.747
  267   HH22  ARG  31          2HH2      ARG  31  -3.205   3.366  10.380
  268    HA   PRO  32           HA       PRO  32   3.306  -2.173   8.966
  269    HB2  PRO  32           2HB      PRO  32   4.737  -4.279   8.200
  270    HB3  PRO  32           1HB      PRO  32   3.026  -4.162   7.768
  271    HG2  PRO  32           2HG      PRO  32   5.441  -3.621   6.086
  272    HG3  PRO  32           1HG      PRO  32   3.932  -4.442   5.647
  273    HD2  PRO  32           2HD      PRO  32   4.538  -1.763   5.123
  274    HD3  PRO  32           1HD      PRO  32   2.915  -2.477   5.096
  275    H    LEU  33           H        LEU  33   5.199  -0.135   7.441
  276    HA   LEU  33           HA       LEU  33   7.844  -0.885   8.259
  277    HB2  LEU  33           2HB      LEU  33   6.727   1.756   7.301
  278    HB3  LEU  33           1HB      LEU  33   8.423   1.479   7.644
  279    HG   LEU  33           HG       LEU  33   8.368  -0.343   5.871
  280   HD11  LEU  33          1HD1      LEU  33   5.740   0.968   5.174
  281   HD12  LEU  33          2HD1      LEU  33   5.963  -0.684   5.752
  282   HD13  LEU  33          3HD1      LEU  33   6.608  -0.206   4.183
  283   HD21  LEU  33          3HD2      LEU  33   8.587   1.250   4.031
  284   HD22  LEU  33          1HD2      LEU  33   9.389   1.834   5.487
  285   HD23  LEU  33          2HD2      LEU  33   7.826   2.501   5.014
  286    HA   PRO  34           HA       PRO  34   8.032   0.584  12.434
  287    HB2  PRO  34           2HB      PRO  34  10.437   1.949  12.458
  288    HB3  PRO  34           1HB      PRO  34  10.280   0.193  12.574
  289    HG2  PRO  34           2HG      PRO  34  10.893   1.892  10.184
  290    HG3  PRO  34           1HG      PRO  34  11.612   0.345  10.672
  291    HD2  PRO  34           2HD      PRO  34   9.760   0.476   8.732
  292    HD3  PRO  34           1HD      PRO  34   9.810  -0.890   9.868
  293    H    ALA  35           H        ALA  35   9.240   3.166  10.236
  294    HA   ALA  35           HA       ALA  35   7.223   4.999  11.278
  295    HB1  ALA  35           3HB      ALA  35  10.162   5.687  11.425
  296    HB2  ALA  35           1HB      ALA  35   9.143   5.270  12.801
  297    HB3  ALA  35           2HB      ALA  35   8.816   6.734  11.876
  298    H    HIS  36           H        HIS  36   6.308   5.935   9.558
  299    HA   HIS  36           HA       HIS  36   7.722   7.406   7.616
  300    HB2  HIS  36           2HB      HIS  36   7.595   6.086   5.649
  301    HB3  HIS  36           1HB      HIS  36   8.245   5.003   6.876
  302    HD1  HIS  36           HD1      HIS  36   5.768   3.960   8.236
  303    HD2  HIS  36           HD2      HIS  36   5.977   4.545   4.129
  304    HE1  HIS  36           HE1      HIS  36   3.978   2.503   7.261
  305    HE2  HIS  36           HE2      HIS  36   4.006   3.014   4.799
  306    H    ASP  37           H        ASP  37   6.321   8.501   6.120
  307    HA   ASP  37           HA       ASP  37   3.632   8.867   6.956
  308    HB2  ASP  37           2HB      ASP  37   5.021   9.696   4.400
  309    HB3  ASP  37           1HB      ASP  37   3.450  10.286   4.928
  310    H    TYR  38           H        TYR  38   1.704   8.484   5.710
  311    HA   TYR  38           HA       TYR  38   1.889   6.385   3.660
  312    HB2  TYR  38           2HB      TYR  38  -0.117   5.274   4.660
  313    HB3  TYR  38           1HB      TYR  38   1.322   5.192   5.671
  314    HD1  TYR  38           HD2      TYR  38   1.481   6.567   7.722
  315    HD2  TYR  38           HD1      TYR  38  -2.086   6.466   5.394
  316    HE1  TYR  38           HE2      TYR  38   0.230   7.528   9.605
  317    HE2  TYR  38           HE1      TYR  38  -3.347   7.429   7.276
  318    HH   TYR  38           HH       TYR  38  -1.825   8.809   9.987
  319    H    PHE  39           H        PHE  39   0.380   6.511   2.008
  320    HA   PHE  39           HA       PHE  39  -0.995   9.093   1.836
  321    HB2  PHE  39           2HB      PHE  39   0.241   7.233  -0.102
  322    HB3  PHE  39           1HB      PHE  39  -1.214   8.046  -0.665
  323    HD1  PHE  39           HD2      PHE  39   2.268   8.513   0.426
  324    HD2  PHE  39           HD1      PHE  39  -1.253  10.403  -1.052
  325    HE1  PHE  39           HE2      PHE  39   3.574  10.532  -0.105
  326    HE2  PHE  39           HE1      PHE  39   0.039  12.413  -1.583
  327    HZ   PHE  39           HZ       PHE  39   2.461  12.489  -1.113
  328    H    GLU  40           H        GLU  40  -2.822   8.696  -0.073
  329    HA   GLU  40           HA       GLU  40  -5.054   7.700   1.336
  330    HB2  GLU  40           2HB      GLU  40  -6.237   8.094  -0.894
  331    HB3  GLU  40           1HB      GLU  40  -5.447   9.480  -0.152
  332    HG2  GLU  40           2HG      GLU  40  -3.544   9.225  -1.659
  333    HG3  GLU  40           1HG      GLU  40  -4.295   7.811  -2.389
  334    H    PHE  41           H        PHE  41  -5.191   5.563   1.779
  335    HA   PHE  41           HA       PHE  41  -4.777   3.546  -0.274
  336    HB2  PHE  41           2HB      PHE  41  -5.856   3.304   2.552
  337    HB3  PHE  41           1HB      PHE  41  -5.499   1.949   1.488
  338    HD1  PHE  41           HD1      PHE  41  -3.165   1.411   0.895
  339    HD2  PHE  41           HD2      PHE  41  -4.120   4.473   3.702
  340    HE1  PHE  41           HE1      PHE  41  -0.841   1.405   1.703
  341    HE2  PHE  41           HE2      PHE  41  -1.800   4.460   4.513
  342    HZ   PHE  41           HZ       PHE  41  -0.155   2.928   3.513
  343    H    PHE  42           H        PHE  42  -6.326   2.804  -1.620
  344    HA   PHE  42           HA       PHE  42  -8.811   4.129  -1.786
  345    HB2  PHE  42           2HB      PHE  42  -9.278   2.708  -3.686
  346    HB3  PHE  42           1HB      PHE  42  -7.595   3.208  -3.741
  347    HD1  PHE  42           HD2      PHE  42  -5.846   1.527  -2.826
  348    HD2  PHE  42           HD1      PHE  42  -9.838   0.458  -3.866
  349    HE1  PHE  42           HE2      PHE  42  -5.160  -0.821  -3.057
  350    HE2  PHE  42           HE1      PHE  42  -9.152  -1.889  -4.098
  351    HZ   PHE  42           HZ       PHE  42  -6.809  -2.531  -3.698
  352    H    ALA  43           H        ALA  43 -10.901   3.499  -1.375
  353    HA   ALA  43           HA       ALA  43 -11.324   1.472   0.638
  354    HB1  ALA  43           3HB      ALA  43 -12.550   3.597   0.706
  355    HB2  ALA  43           1HB      ALA  43 -13.651   2.221   0.608
  356    HB3  ALA  43           2HB      ALA  43 -13.329   3.200  -0.824
  357    H    ALA  44           H        ALA  44 -11.324  -0.613   0.027
  358    HA   ALA  44           HA       ALA  44 -12.329  -1.343  -2.631
  359    HB1  ALA  44           3HB      ALA  44 -10.036  -2.003  -2.087
  360    HB2  ALA  44           1HB      ALA  44 -11.064  -3.408  -2.368
  361    HB3  ALA  44           2HB      ALA  44 -10.627  -2.947  -0.722
  362    H    ASP  45           H        ASP  45 -13.976  -2.733  -2.963
  363    HA   ASP  45           HA       ASP  45 -15.209  -4.080  -0.647
  364    HB2  ASP  45           2HB      ASP  45 -16.552  -2.730  -3.000
  365    HB3  ASP  45           1HB      ASP  45 -17.392  -3.861  -1.944
  366    H    LEU  46           H        LEU  46 -14.543  -6.144  -0.872
  367    HA   LEU  46           HA       LEU  46 -13.962  -7.485  -3.248
  368    HB2  LEU  46           2HB      LEU  46 -13.995  -9.546  -1.977
  369    HB3  LEU  46           1HB      LEU  46 -13.196  -8.281  -1.069
  370    HG   LEU  46           HG       LEU  46 -16.058  -9.133  -0.567
  371   HD11  LEU  46          1HD1      LEU  46 -13.551 -10.018   0.865
  372   HD12  LEU  46          2HD1      LEU  46 -14.567 -11.017  -0.174
  373   HD13  LEU  46          3HD1      LEU  46 -15.207 -10.391   1.342
  374   HD21  LEU  46          3HD2      LEU  46 -15.520  -6.887   0.229
  375   HD22  LEU  46          1HD2      LEU  46 -14.126  -7.517   1.109
  376   HD23  LEU  46          2HD2      LEU  46 -15.758  -7.995   1.579
  377    H    SER  47           H        SER  47 -15.144  -8.340  -4.807
  378    HA   SER  47           HA       SER  47 -16.802  -9.329  -5.989
  379    HB2  SER  47           2HB      SER  47 -17.092 -10.857  -4.078
  380    HB3  SER  47           1HB      SER  47 -18.218  -9.719  -3.342
  381    HG   SER  47           HG       SER  47 -18.654 -10.702  -5.954
  382    H    LEU  48           H        LEU  48 -17.916  -6.940  -3.623
  383    HA   LEU  48           HA       LEU  48 -20.365  -6.310  -4.874
  384    HB2  LEU  48           2HB      LEU  48 -19.698  -5.750  -2.519
  385    HB3  LEU  48           1HB      LEU  48 -18.636  -4.514  -3.152
  386    HG   LEU  48           HG       LEU  48 -20.907  -3.782  -2.205
  387   HD11  LEU  48          1HD1      LEU  48 -21.176  -2.002  -3.838
  388   HD12  LEU  48          2HD1      LEU  48 -20.175  -2.886  -4.989
  389   HD13  LEU  48          3HD1      LEU  48 -19.472  -2.285  -3.487
  390   HD21  LEU  48          3HD2      LEU  48 -22.243  -5.517  -3.310
  391   HD22  LEU  48          1HD2      LEU  48 -21.866  -4.802  -4.876
  392   HD23  LEU  48          2HD2      LEU  48 -22.814  -3.894  -3.698
  393    H    TYR  49           H        TYR  49 -20.346  -5.847  -6.995
  394    HA   TYR  49           HA       TYR  49 -19.901  -4.910  -9.006
  395    HB2  TYR  49           2HB      TYR  49 -19.460  -2.519  -7.219
  396    HB3  TYR  49           1HB      TYR  49 -19.462  -2.410  -8.975
  397    HD1  TYR  49           HD2      TYR  49 -21.602  -3.517 -10.126
  398    HD2  TYR  49           HD1      TYR  49 -21.465  -2.104  -6.110
  399    HE1  TYR  49           HE2      TYR  49 -24.052  -3.299 -10.123
  400    HE2  TYR  49           HE1      TYR  49 -23.911  -1.887  -6.100
  401    HH   TYR  49           HH       TYR  49 -25.908  -3.275  -8.402
  402    HA   PRO  50           HA       PRO  50 -15.357  -5.638  -9.052
  403    HB2  PRO  50           2HB      PRO  50 -16.067  -6.663 -11.740
  404    HB3  PRO  50           1HB      PRO  50 -15.148  -7.442 -10.448
  405    HG2  PRO  50           2HG      PRO  50 -17.631  -8.238 -11.044
  406    HG3  PRO  50           1HG      PRO  50 -17.058  -8.201  -9.365
  407    HD2  PRO  50           2HD      PRO  50 -18.817  -6.241 -10.805
  408    HD3  PRO  50           1HD      PRO  50 -18.967  -6.891  -9.158
  409    H    HIS  51           H        HIS  51 -13.867  -5.296 -11.168
  410    HA   HIS  51           HA       HIS  51 -12.896  -3.844 -12.611
  411    HB2  HIS  51           2HB      HIS  51 -15.672  -2.686 -12.961
  412    HB3  HIS  51           1HB      HIS  51 -14.277  -2.319 -13.969
  413    HD1  HIS  51           HD1      HIS  51 -13.250  -4.511 -15.253
  414    HD2  HIS  51           HD2      HIS  51 -17.147  -4.794 -13.837
  415    HE1  HIS  51           HE1      HIS  51 -14.284  -6.416 -16.512
  416    HE2  HIS  51           HE2      HIS  51 -16.694  -6.428 -15.787
  417    H    LEU  52           H        LEU  52 -13.585  -3.130  -9.658
  418    HA   LEU  52           HA       LEU  52 -13.402  -0.277  -9.589
  419    HB2  LEU  52           2HB      LEU  52 -14.297  -1.577  -7.700
  420    HB3  LEU  52           1HB      LEU  52 -12.727  -2.315  -7.454
  421    HG   LEU  52           HG       LEU  52 -11.790  -0.087  -6.878
  422   HD11  LEU  52          1HD1      LEU  52 -13.317   1.321  -8.147
  423   HD12  LEU  52          2HD1      LEU  52 -13.308   1.789  -6.449
  424   HD13  LEU  52          3HD1      LEU  52 -14.654   0.852  -7.097
  425   HD21  LEU  52          3HD2      LEU  52 -12.551  -1.566  -5.102
  426   HD22  LEU  52          1HD2      LEU  52 -14.190  -0.924  -5.240
  427   HD23  LEU  52          2HD2      LEU  52 -12.877   0.116  -4.684
  428    H    TYR  53           H        TYR  53 -11.695   0.223 -11.015
  429    HA   TYR  53           HA       TYR  53  -9.049  -0.872 -10.605
  430    HB2  TYR  53           2HB      TYR  53  -9.876   1.402 -12.426
  431    HB3  TYR  53           1HB      TYR  53  -8.391   0.460 -12.520
  432    HD1  TYR  53           HD1      TYR  53  -8.850  -2.200 -12.696
  433    HD2  TYR  53           HD2      TYR  53 -11.546   0.858 -13.946
  434    HE1  TYR  53           HE1      TYR  53  -9.950  -3.792 -14.213
  435    HE2  TYR  53           HE2      TYR  53 -12.647  -0.733 -15.463
  436    HH   TYR  53           HH       TYR  53 -12.087  -2.838 -16.643
  437    H    SER  54           H        SER  54  -7.838  -0.192  -8.956
  438    HA   SER  54           HA       SER  54  -7.341   2.651  -8.577
  439    HB2  SER  54           2HB      SER  54  -8.476   0.942  -6.342
  440    HB3  SER  54           1HB      SER  54  -7.809   2.560  -6.132
  441    HG   SER  54           HG       SER  54  -9.560   2.794  -8.052
  442    H    ARG  55           H        ARG  55  -5.908   2.680  -6.285
  443    HA   ARG  55           HA       ARG  55  -4.085   0.513  -5.952
  444    HB2  ARG  55           2HB      ARG  55  -2.051   1.664  -6.804
  445    HB3  ARG  55           1HB      ARG  55  -3.188   1.255  -8.083
  446    HG2  ARG  55           2HG      ARG  55  -4.010   3.587  -8.058
  447    HG3  ARG  55           1HG      ARG  55  -2.792   3.976  -6.842
  448    HD2  ARG  55           2HD      ARG  55  -1.015   3.409  -8.394
  449    HD3  ARG  55           1HD      ARG  55  -2.196   2.899  -9.602
  450    HE   ARG  55           HE       ARG  55  -2.500   5.631  -8.727
  451   HH11  ARG  55          1HH1      ARG  55  -0.927   3.550 -10.987
  452   HH12  ARG  55          2HH1      ARG  55  -0.693   4.814 -12.139
  453   HH21  ARG  55          1HH2      ARG  55  -2.184   7.218 -10.190
  454   HH22  ARG  55          2HH2      ARG  55  -1.382   6.875 -11.692
  455    H    ALA  56           H        ALA  56  -1.942   1.568  -4.772
  456    HA   ALA  56           HA       ALA  56  -2.875   3.644  -2.901
  457    HB1  ALA  56           3HB      ALA  56  -1.622   1.029  -2.062
  458    HB2  ALA  56           1HB      ALA  56  -3.310   1.482  -1.846
  459    HB3  ALA  56           2HB      ALA  56  -2.045   2.363  -0.989
  460    H    TYR  57           H        TYR  57  -1.198   4.813  -1.824
  461    HA   TYR  57           HA       TYR  57   1.444   4.598  -3.142
  462    HB2  TYR  57           2HB      TYR  57  -0.043   7.076  -2.242
  463    HB3  TYR  57           1HB      TYR  57   1.635   7.074  -2.771
  464    HD1  TYR  57           HD1      TYR  57  -1.842   6.383  -3.893
  465    HD2  TYR  57           HD2      TYR  57   2.178   7.160  -5.061
  466    HE1  TYR  57           HE1      TYR  57  -2.580   6.684  -6.219
  467    HE2  TYR  57           HE2      TYR  57   1.450   7.458  -7.385
  468    HH   TYR  57           HH       TYR  57  -0.368   6.872  -8.830
  469    H    ILE  58           H        ILE  58   3.295   4.974  -1.909
  470    HA   ILE  58           HA       ILE  58   2.951   5.132   1.022
  471    HB   ILE  58           HB       ILE  58   4.986   3.402  -0.419
  472   HG12  ILE  58          2HG1      ILE  58   2.501   2.535   1.094
  473   HG13  ILE  58          1HG1      ILE  58   2.659   2.537  -0.660
  474   HG21  ILE  58          1HG2      ILE  58   5.443   2.486   1.817
  475   HG22  ILE  58          2HG2      ILE  58   4.299   3.630   2.517
  476   HG23  ILE  58          3HG2      ILE  58   5.768   4.217   1.741
  477   HD11  ILE  58          3HD1      ILE  58   4.455   0.892  -0.497
  478   HD12  ILE  58          1HD1      ILE  58   2.966   0.314   0.249
  479   HD13  ILE  58          2HD1      ILE  58   4.292   0.888   1.260
  480    H    ASN  59           H        ASN  59   4.583   6.278   2.141
  481    HA   ASN  59           HA       ASN  59   6.626   7.608   0.475
  482    HB2  ASN  59           2HB      ASN  59   4.892   9.225   1.135
  483    HB3  ASN  59           1HB      ASN  59   5.131   8.801   2.827
  484   HD21  ASN  59          1HD2      ASN  59   5.655  10.962   3.306
  485   HD22  ASN  59          2HD2      ASN  59   7.192  11.626   2.899
  486    H    PHE  60           H        PHE  60   8.682   7.838   1.355
  487    HA   PHE  60           HA       PHE  60   9.189   6.170   3.739
  488    HB2  PHE  60           2HB      PHE  60  10.730   6.520   1.180
  489    HB3  PHE  60           1HB      PHE  60  11.552   5.989   2.643
  490    HD1  PHE  60           HD2      PHE  60   8.701   5.144   0.395
  491    HD2  PHE  60           HD1      PHE  60  11.519   3.756   3.275
  492    HE1  PHE  60           HE2      PHE  60   7.988   2.824  -0.025
  493    HE2  PHE  60           HE1      PHE  60  10.809   1.442   2.859
  494    HZ   PHE  60           HZ       PHE  60   9.043   0.972   1.206
  495    H    ARG  61           H        ARG  61  10.442   6.893   5.356
  496    HA   ARG  61           HA       ARG  61  11.467   9.655   5.204
  497    HB2  ARG  61           2HB      ARG  61  10.614   7.961   7.561
  498    HB3  ARG  61           1HB      ARG  61  11.436   9.505   7.735
  499    HG2  ARG  61           2HG      ARG  61   8.815   9.151   6.288
  500    HG3  ARG  61           1HG      ARG  61   8.956   9.615   7.984
  501    HD2  ARG  61           2HD      ARG  61  10.097  11.138   5.634
  502    HD3  ARG  61           1HD      ARG  61   8.641  11.570   6.532
  503    HE   ARG  61           HE       ARG  61  10.327  11.618   8.514
  504   HH11  ARG  61          1HH1      ARG  61  10.890  12.719   5.295
  505   HH12  ARG  61          2HH1      ARG  61  12.087  13.866   5.784
  506   HH21  ARG  61          1HH2      ARG  61  11.873  13.100   9.119
  507   HH22  ARG  61          2HH2      ARG  61  12.626  14.080   7.907
  508    H    ASN  62           H        ASN  62  12.628   6.718   4.690
  509    HA   ASN  62           HA       ASN  62  15.324   7.362   5.396
  510    HB2  ASN  62           2HB      ASN  62  14.429   6.552   7.580
  511    HB3  ASN  62           1HB      ASN  62  14.033   5.015   6.823
  512   HD21  ASN  62          1HD2      ASN  62  15.618   3.546   6.480
  513   HD22  ASN  62          2HD2      ASN  62  17.250   3.752   7.011
  514    HA   PRO  63           HA       PRO  63  15.674   4.967   1.674
  515    HB2  PRO  63           2HB      PRO  63  18.391   4.686   1.581
  516    HB3  PRO  63           1HB      PRO  63  17.547   6.190   1.186
  517    HG2  PRO  63           2HG      PRO  63  18.887   5.390   3.751
  518    HG3  PRO  63           1HG      PRO  63  18.969   6.935   2.884
  519    HD2  PRO  63           2HD      PRO  63  17.378   6.593   5.034
  520    HD3  PRO  63           1HD      PRO  63  16.901   7.633   3.676
  521    H    ASP  64           H        ASP  64  17.330   3.716   4.577
  522    HA   ASP  64           HA       ASP  64  18.089   1.209   3.615
  523    HB2  ASP  64           2HB      ASP  64  17.159   1.889   6.415
  524    HB3  ASP  64           1HB      ASP  64  18.125   0.487   5.959
  525    H    ASP  65           H        ASP  65  14.984   2.231   4.979
  526    HA   ASP  65           HA       ASP  65  13.766  -0.274   5.235
  527    HB2  ASP  65           2HB      ASP  65  12.515   2.429   4.690
  528    HB3  ASP  65           1HB      ASP  65  11.635   0.999   5.231
  529    H    ILE  66           H        ILE  66  14.188   1.751   2.402
  530    HA   ILE  66           HA       ILE  66  12.239   0.653   0.712
  531    HB   ILE  66           HB       ILE  66  14.960   1.753  -0.045
  532   HG12  ILE  66          2HG1      ILE  66  12.252   3.116   0.074
  533   HG13  ILE  66          1HG1      ILE  66  13.555   3.343   1.237
  534   HG21  ILE  66          1HG2      ILE  66  13.992   2.140  -2.268
  535   HG22  ILE  66          2HG2      ILE  66  12.499   1.353  -1.756
  536   HG23  ILE  66          3HG2      ILE  66  13.995   0.424  -1.858
  537   HD11  ILE  66          3HD1      ILE  66  13.630   4.085  -1.683
  538   HD12  ILE  66          1HD1      ILE  66  14.954   4.291  -0.533
  539   HD13  ILE  66          2HD1      ILE  66  13.452   5.191  -0.319
  540    H    LEU  67           H        LEU  67  15.730  -0.161   0.799
  541    HA   LEU  67           HA       LEU  67  15.410  -2.458  -0.859
  542    HB2  LEU  67           2HB      LEU  67  17.779  -2.961  -0.202
  543    HB3  LEU  67           1HB      LEU  67  17.513  -1.387  -0.922
  544    HG   LEU  67           HG       LEU  67  17.455  -0.511   1.527
  545   HD11  LEU  67          1HD1      LEU  67  17.354  -2.662   2.661
  546   HD12  LEU  67          2HD1      LEU  67  18.823  -1.796   3.102
  547   HD13  LEU  67          3HD1      LEU  67  18.899  -3.131   1.950
  548   HD21  LEU  67          3HD2      LEU  67  19.875  -0.218   1.522
  549   HD22  LEU  67          1HD2      LEU  67  19.208   0.011  -0.095
  550   HD23  LEU  67          2HD2      LEU  67  20.040  -1.491   0.309
  551    H    LEU  68           H        LEU  68  15.298  -1.952   2.581
  552    HA   LEU  68           HA       LEU  68  15.594  -4.621   3.458
  553    HB2  LEU  68           2HB      LEU  68  15.797  -2.878   5.057
  554    HB3  LEU  68           1HB      LEU  68  14.238  -2.199   4.628
  555    HG   LEU  68           HG       LEU  68  13.122  -4.188   5.610
  556   HD11  LEU  68          1HD1      LEU  68  15.912  -4.938   6.501
  557   HD12  LEU  68          2HD1      LEU  68  14.905  -5.822   5.356
  558   HD13  LEU  68          3HD1      LEU  68  14.420  -5.705   7.046
  559   HD21  LEU  68          3HD2      LEU  68  13.377  -2.164   6.930
  560   HD22  LEU  68          1HD2      LEU  68  14.972  -2.688   7.472
  561   HD23  LEU  68          2HD2      LEU  68  13.536  -3.589   7.957
  562    H    PHE  69           H        PHE  69  12.559  -2.738   3.257
  563    HA   PHE  69           HA       PHE  69  10.933  -5.022   3.667
  564    HB2  PHE  69           2HB      PHE  69  10.407  -2.170   2.941
  565    HB3  PHE  69           1HB      PHE  69   9.092  -3.340   2.845
  566    HD1  PHE  69           HD1      PHE  69  11.358  -1.519   5.081
  567    HD2  PHE  69           HD2      PHE  69   8.220  -4.391   4.848
  568    HE1  PHE  69           HE1      PHE  69  10.998  -1.320   7.506
  569    HE2  PHE  69           HE2      PHE  69   7.854  -4.196   7.270
  570    HZ   PHE  69           HZ       PHE  69   9.246  -2.661   8.601
  571    H    ARG  70           H        ARG  70  12.050  -3.427   0.722
  572    HA   ARG  70           HA       ARG  70  10.312  -4.633  -1.109
  573    HB2  ARG  70           2HB      ARG  70  11.952  -2.828  -1.665
  574    HB3  ARG  70           1HB      ARG  70  13.248  -4.008  -1.563
  575    HG2  ARG  70           2HG      ARG  70  10.964  -4.450  -3.458
  576    HG3  ARG  70           1HG      ARG  70  12.270  -3.346  -3.883
  577    HD2  ARG  70           2HD      ARG  70  13.896  -5.104  -3.734
  578    HD3  ARG  70           1HD      ARG  70  12.709  -6.214  -3.051
  579    HE   ARG  70           HE       ARG  70  11.757  -5.400  -5.537
  580   HH11  ARG  70          1HH1      ARG  70  14.450  -7.157  -4.285
  581   HH12  ARG  70          2HH1      ARG  70  14.568  -8.176  -5.675
  582   HH21  ARG  70          1HH2      ARG  70  11.891  -6.742  -7.291
  583   HH22  ARG  70          2HH2      ARG  70  13.121  -7.960  -7.345
  584    H    ASP  71           H        ASP  71  13.397  -5.841   0.211
  585    HA   ASP  71           HA       ASP  71  13.629  -8.156  -1.328
  586    HB2  ASP  71           2HB      ASP  71  15.456  -7.325   0.044
  587    HB3  ASP  71           1HB      ASP  71  14.541  -7.649   1.515
  588    H    ARG  72           H        ARG  72  11.845  -7.650   1.687
  589    HA   ARG  72           HA       ARG  72  11.158 -10.485   1.844
  590    HB2  ARG  72           2HB      ARG  72  10.130  -9.837   4.042
  591    HB3  ARG  72           1HB      ARG  72  11.859  -9.544   3.911
  592    HG2  ARG  72           2HG      ARG  72  11.332  -7.153   3.381
  593    HG3  ARG  72           1HG      ARG  72   9.645  -7.507   3.758
  594    HD2  ARG  72           2HD      ARG  72  11.947  -7.920   5.665
  595    HD3  ARG  72           1HD      ARG  72  10.922  -6.487   5.642
  596    HE   ARG  72           HE       ARG  72   9.122  -8.458   5.939
  597   HH11  ARG  72          1HH1      ARG  72  12.127  -7.934   7.555
  598   HH12  ARG  72          2HH1      ARG  72  11.531  -8.510   9.072
  599   HH21  ARG  72          1HH2      ARG  72   8.370  -9.181   7.891
  600   HH22  ARG  72          2HH2      ARG  72   9.426  -9.197   9.263
  601    H    PHE  73           H        PHE  73   9.704  -7.604   0.657
  602    HA   PHE  73           HA       PHE  73   7.035  -8.839   0.843
  603    HB2  PHE  73           2HB      PHE  73   7.909  -5.980   0.761
  604    HB3  PHE  73           1HB      PHE  73   6.317  -6.400   0.138
  605    HD1  PHE  73           HD2      PHE  73   8.429  -6.283   3.159
  606    HD2  PHE  73           HD1      PHE  73   4.554  -7.112   1.595
  607    HE1  PHE  73           HE2      PHE  73   7.509  -6.299   5.441
  608    HE2  PHE  73           HE1      PHE  73   3.633  -7.128   3.874
  609    HZ   PHE  73           HZ       PHE  73   5.111  -6.724   5.801
  610    H    ASP  74           H        ASP  74   9.068  -7.069  -1.538
  611    HA   ASP  74           HA       ASP  74   7.456  -6.617  -3.608
  612    HB2  ASP  74           2HB      ASP  74   9.897  -6.242  -3.628
  613    HB3  ASP  74           1HB      ASP  74  10.150  -7.958  -3.931
  614    H    GLY  75           H        GLY  75   5.750  -7.804  -4.252
  615    HA2  GLY  75           2HA      GLY  75   4.771  -9.499  -5.589
  616    HA3  GLY  75           1HA      GLY  75   6.198 -10.496  -5.343
  617    H    TYR  76           H        TYR  76   4.509  -8.856  -2.760
  618    HA   TYR  76           HA       TYR  76   4.307 -11.316  -1.280
  619    HB2  TYR  76           2HB      TYR  76   4.983  -9.636   0.111
  620    HB3  TYR  76           1HB      TYR  76   4.072  -8.405  -0.743
  621    HD1  TYR  76           HD2      TYR  76   3.510 -11.346   1.531
  622    HD2  TYR  76           HD1      TYR  76   2.247  -7.481   0.270
  623    HE1  TYR  76           HE2      TYR  76   1.852 -11.296   3.350
  624    HE2  TYR  76           HE1      TYR  76   0.603  -7.414   2.068
  625    HH   TYR  76           HH       TYR  76  -0.634  -8.977   3.510
  626    H    ILE  77           H        ILE  77   2.681 -12.666  -1.592
  627    HA   ILE  77           HA       ILE  77   0.075 -11.803  -2.516
  628    HB   ILE  77           HB       ILE  77   1.122 -14.548  -1.784
  629   HG12  ILE  77          2HG1      ILE  77   2.159 -13.527  -3.797
  630   HG13  ILE  77          1HG1      ILE  77   1.208 -14.955  -4.185
  631   HG21  ILE  77          1HG2      ILE  77  -1.278 -14.488  -1.446
  632   HG22  ILE  77          2HG2      ILE  77  -0.897 -15.430  -2.886
  633   HG23  ILE  77          3HG2      ILE  77  -1.514 -13.785  -3.047
  634   HD11  ILE  77          3HD1      ILE  77  -0.614 -13.522  -4.952
  635   HD12  ILE  77          1HD1      ILE  77   0.885 -13.201  -5.825
  636   HD13  ILE  77          2HD1      ILE  77   0.347 -12.097  -4.558
  637    H    PHE  78           H        PHE  78  -1.106 -10.769  -0.950
  638    HA   PHE  78           HA       PHE  78  -1.408 -11.997   1.688
  639    HB2  PHE  78           2HB      PHE  78  -1.255  -9.548   1.567
  640    HB3  PHE  78           1HB      PHE  78  -2.673  -9.495   0.524
  641    HD1  PHE  78           HD1      PHE  78  -1.673 -10.848   3.872
  642    HD2  PHE  78           HD2      PHE  78  -4.696  -8.987   1.519
  643    HE1  PHE  78           HE1      PHE  78  -3.120 -10.692   5.856
  644    HE2  PHE  78           HE2      PHE  78  -6.145  -8.832   3.497
  645    HZ   PHE  78           HZ       PHE  78  -5.357  -9.684   5.670
  646    H    LEU  79           H        LEU  79  -3.261 -13.047   2.400
  647    HA   LEU  79           HA       LEU  79  -5.223 -13.691   0.286
  648    HB2  LEU  79           2HB      LEU  79  -4.195 -15.334   2.594
  649    HB3  LEU  79           1HB      LEU  79  -5.600 -15.795   1.652
  650    HG   LEU  79           HG       LEU  79  -2.857 -15.373   0.456
  651   HD11  LEU  79          1HD1      LEU  79  -2.790 -17.232   2.035
  652   HD12  LEU  79          2HD1      LEU  79  -2.677 -17.809   0.373
  653   HD13  LEU  79          3HD1      LEU  79  -4.198 -17.959   1.256
  654   HD21  LEU  79          3HD2      LEU  79  -3.806 -16.588  -1.457
  655   HD22  LEU  79          1HD2      LEU  79  -4.678 -15.090  -1.130
  656   HD23  LEU  79          2HD2      LEU  79  -5.369 -16.638  -0.643
  657    H    ASP  80           H        ASP  80  -7.196 -12.948   0.544
  658    HA   ASP  80           HA       ASP  80  -8.216 -11.975   3.050
  659    HB2  ASP  80           2HB      ASP  80  -8.852 -10.963   0.890
  660    HB3  ASP  80           1HB      ASP  80  -9.619 -12.468   0.406
  661    H    SER  81           H        SER  81 -10.477 -12.754   3.776
  662    HA   SER  81           HA       SER  81 -10.441 -15.435   4.589
  663    HB2  SER  81           2HB      SER  81 -12.805 -13.551   4.362
  664    HB3  SER  81           1HB      SER  81 -12.818 -15.082   5.237
  665    HG   SER  81           HG       SER  81 -11.102 -12.873   5.797
  666    H    LYS  82           H        LYS  82 -11.721 -13.961   1.679
  667    HA   LYS  82           HA       LYS  82 -13.175 -16.284   0.785
  668    HB2  LYS  82           2HB      LYS  82 -12.179 -13.876  -0.753
  669    HB3  LYS  82           1HB      LYS  82 -13.289 -15.085  -1.382
  670    HG2  LYS  82           2HG      LYS  82 -13.844 -13.288   0.976
  671    HG3  LYS  82           1HG      LYS  82 -14.403 -13.005  -0.672
  672    HD2  LYS  82           2HD      LYS  82 -15.611 -15.189  -0.576
  673    HD3  LYS  82           1HD      LYS  82 -15.139 -15.329   1.120
  674    HE2  LYS  82           2HE      LYS  82 -16.332 -13.235   1.613
  675    HE3  LYS  82           1HE      LYS  82 -16.811 -13.116  -0.080
  676    HZ1  LYS  82           3HZ      LYS  82 -17.983 -15.242   0.179
  677    HZ2  LYS  82           1HZ      LYS  82 -18.593 -14.043   1.202
  678    HZ3  LYS  82           2HZ      LYS  82 -17.594 -15.256   1.825
  679    H    GLY  83           H        GLY  83  -9.895 -15.681   1.037
  680    HA2  GLY  83           2HA      GLY  83  -8.105 -16.986   0.304
  681    HA3  GLY  83           1HA      GLY  83  -9.191 -17.833  -0.786
  682    H    LEU  84           H        LEU  84  -9.375 -14.434  -0.971
  683    HA   LEU  84           HA       LEU  84  -8.454 -14.418  -3.679
  684    HB2  LEU  84           2HB      LEU  84  -9.164 -12.111  -1.855
  685    HB3  LEU  84           1HB      LEU  84  -8.922 -11.997  -3.589
  686    HG   LEU  84           HG       LEU  84 -11.120 -13.555  -2.214
  687   HD11  LEU  84          1HD1      LEU  84 -12.616 -11.863  -3.160
  688   HD12  LEU  84          2HD1      LEU  84 -11.225 -10.978  -3.786
  689   HD13  LEU  84          3HD1      LEU  84 -11.453 -11.149  -2.044
  690   HD21  LEU  84          3HD2      LEU  84 -10.450 -14.632  -4.288
  691   HD22  LEU  84          1HD2      LEU  84 -10.589 -13.099  -5.153
  692   HD23  LEU  84          2HD2      LEU  84 -12.027 -13.868  -4.475
  693    H    GLU  85           H        GLU  85  -6.388 -14.335  -4.295
  694    HA   GLU  85           HA       GLU  85  -4.243 -13.528  -2.579
  695    HB2  GLU  85           2HB      GLU  85  -4.229 -14.008  -5.573
  696    HB3  GLU  85           1HB      GLU  85  -2.810 -13.884  -4.543
  697    HG2  GLU  85           2HG      GLU  85  -3.530 -15.901  -3.337
  698    HG3  GLU  85           1HG      GLU  85  -4.916 -16.034  -4.419
  699    H    TYR  86           H        TYR  86  -3.529 -11.513  -2.230
  700    HA   TYR  86           HA       TYR  86  -4.015  -9.424  -4.257
  701    HB2  TYR  86           2HB      TYR  86  -3.243  -9.080  -1.343
  702    HB3  TYR  86           1HB      TYR  86  -3.659  -7.794  -2.472
  703    HD1  TYR  86           HD1      TYR  86  -6.056  -7.879  -3.490
  704    HD2  TYR  86           HD2      TYR  86  -4.905 -10.017   0.003
  705    HE1  TYR  86           HE1      TYR  86  -8.416  -8.061  -2.829
  706    HE2  TYR  86           HE2      TYR  86  -7.256 -10.202   0.673
  707    HH   TYR  86           HH       TYR  86  -9.821  -9.581  -1.399
  708    HA   PRO  87           HA       PRO  87   0.424 -10.306  -4.800
  709    HB2  PRO  87           2HB      PRO  87   0.619  -9.445  -7.358
  710    HB3  PRO  87           1HB      PRO  87  -0.074 -11.015  -6.932
  711    HG2  PRO  87           2HG      PRO  87  -1.471  -8.443  -7.597
  712    HG3  PRO  87           1HG      PRO  87  -1.850 -10.091  -8.132
  713    HD2  PRO  87           2HD      PRO  87  -3.176  -8.838  -6.099
  714    HD3  PRO  87           1HD      PRO  87  -2.974 -10.599  -6.185
  715    H    ALA  88           H        ALA  88   0.782  -8.599  -3.197
  716    HA   ALA  88           HA       ALA  88   0.983  -5.862  -3.998
  717    HB1  ALA  88           3HB      ALA  88   0.509  -6.574  -1.682
  718    HB2  ALA  88           1HB      ALA  88   1.888  -5.481  -1.785
  719    HB3  ALA  88           2HB      ALA  88   2.150  -7.209  -1.560
  720    H    VAL  89           H        VAL  89   2.380  -5.596  -5.704
  721    HA   VAL  89           HA       VAL  89   5.187  -6.444  -5.365
  722    HB   VAL  89           HB       VAL  89   3.810  -5.369  -7.847
  723   HG11  VAL  89          1HG1      VAL  89   6.551  -6.600  -7.505
  724   HG12  VAL  89          2HG1      VAL  89   6.205  -4.907  -7.861
  725   HG13  VAL  89          3HG1      VAL  89   5.813  -6.154  -9.044
  726   HG21  VAL  89          3HG2      VAL  89   3.895  -7.677  -8.670
  727   HG22  VAL  89          1HG2      VAL  89   2.923  -7.551  -7.204
  728   HG23  VAL  89          2HG2      VAL  89   4.560  -8.206  -7.124
  729    H    VAL  90           H        VAL  90   6.911  -4.907  -5.649
  730    HA   VAL  90           HA       VAL  90   6.122  -2.236  -4.699
  731    HB   VAL  90           HB       VAL  90   8.818  -3.612  -4.590
  732   HG11  VAL  90          1HG1      VAL  90   9.021  -1.172  -4.644
  733   HG12  VAL  90          2HG1      VAL  90   9.474  -1.819  -3.069
  734   HG13  VAL  90          3HG1      VAL  90   7.905  -1.045  -3.283
  735   HG21  VAL  90          3HG2      VAL  90   8.359  -3.858  -2.185
  736   HG22  VAL  90          1HG2      VAL  90   7.176  -4.721  -3.170
  737   HG23  VAL  90          2HG2      VAL  90   6.750  -3.179  -2.427
  738    H    GLU  91           H        GLU  91   6.328  -0.477  -5.964
  739    HA   GLU  91           HA       GLU  91   8.530  -0.372  -7.914
  740    HB2  GLU  91           2HB      GLU  91   7.189   0.599  -9.640
  741    HB3  GLU  91           1HB      GLU  91   6.396  -0.886  -9.139
  742    HG2  GLU  91           2HG      GLU  91   4.717   0.319  -7.946
  743    HG3  GLU  91           1HG      GLU  91   5.593   1.838  -8.131
  744    H    PHE  92           H        PHE  92   8.780   2.032  -8.707
  745    HA   PHE  92           HA       PHE  92   8.210   3.854  -6.456
  746    HB2  PHE  92           2HB      PHE  92  10.511   4.785  -6.657
  747    HB3  PHE  92           1HB      PHE  92  10.478   3.111  -6.112
  748    HD1  PHE  92           HD1      PHE  92  11.250   1.316  -7.560
  749    HD2  PHE  92           HD2      PHE  92  11.437   5.376  -8.814
  750    HE1  PHE  92           HE1      PHE  92  12.799   0.681  -9.369
  751    HE2  PHE  92           HE2      PHE  92  12.982   4.753 -10.623
  752    HZ   PHE  92           HZ       PHE  92  13.667   2.402 -10.902
  753    H    ALA  93           H        ALA  93   8.433   6.133  -6.957
  754    HA   ALA  93           HA       ALA  93   7.311   6.752  -9.555
  755    HB1  ALA  93           3HB      ALA  93   7.017   9.006  -8.662
  756    HB2  ALA  93           1HB      ALA  93   7.977   8.583  -7.242
  757    HB3  ALA  93           2HB      ALA  93   6.420   7.800  -7.522
  758    HA   PRO  94           HA       PRO  94  11.192   7.800 -11.496
  759    HB2  PRO  94           2HB      PRO  94  10.236   9.446 -13.474
  760    HB3  PRO  94           1HB      PRO  94  10.125   7.684 -13.528
  761    HG2  PRO  94           2HG      PRO  94   8.050   9.687 -12.702
  762    HG3  PRO  94           1HG      PRO  94   7.870   8.250 -13.730
  763    HD2  PRO  94           2HD      PRO  94   7.127   8.240 -11.143
  764    HD3  PRO  94           1HD      PRO  94   7.830   6.802 -11.912
  765    H    PHE  95           H        PHE  95  12.536   9.116 -10.353
  766    HA   PHE  95           HA       PHE  95  11.753  11.826  -9.641
  767    HB2  PHE  95           2HB      PHE  95  13.070  10.370  -8.087
  768    HB3  PHE  95           1HB      PHE  95  14.420  10.449  -9.211
  769    HD1  PHE  95           HD1      PHE  95  12.294  12.455  -6.947
  770    HD2  PHE  95           HD2      PHE  95  15.882  12.321  -9.237
  771    HE1  PHE  95           HE1      PHE  95  13.065  14.519  -5.854
  772    HE2  PHE  95           HE2      PHE  95  16.659  14.385  -8.149
  773    HZ   PHE  95           HZ       PHE  95  15.250  15.485  -6.455
  774    H    GLN  96           H        GLN  96  12.030  13.507 -10.961
  775    HA   GLN  96           HA       GLN  96  13.619  13.134 -13.392
  776    HB2  GLN  96           2HB      GLN  96  11.150  13.882 -13.336
  777    HB3  GLN  96           1HB      GLN  96  11.763  15.440 -12.806
  778    HG2  GLN  96           2HG      GLN  96  11.427  15.583 -15.144
  779    HG3  GLN  96           1HG      GLN  96  13.169  15.501 -14.883
  780   HE21  GLN  96          1HE2      GLN  96  14.286  13.670 -15.557
  781   HE22  GLN  96          2HE2      GLN  96  13.578  12.477 -16.583
  782    H    LYS  97           H        LYS  97  15.616  13.994 -13.535
  783    HA   LYS  97           HA       LYS  97  16.590  15.990 -11.713
  784    HB2  LYS  97           2HB      LYS  97  17.796  14.828 -14.233
  785    HB3  LYS  97           1HB      LYS  97  18.629  15.969 -13.190
  786    HG2  LYS  97           2HG      LYS  97  17.717  13.189 -12.452
  787    HG3  LYS  97           1HG      LYS  97  19.378  13.728 -12.721
  788    HD2  LYS  97           2HD      LYS  97  19.032  15.360 -10.814
  789    HD3  LYS  97           1HD      LYS  97  17.518  14.513 -10.474
  790    HE2  LYS  97           2HE      LYS  97  20.306  13.347 -10.428
  791    HE3  LYS  97           1HE      LYS  97  19.265  13.657  -9.040
  792    HZ1  LYS  97           3HZ      LYS  97  18.904  11.620 -11.159
  793    HZ2  LYS  97           1HZ      LYS  97  17.672  12.034 -10.079
  794    HZ3  LYS  97           2HZ      LYS  97  19.111  11.375  -9.501
  Start of MODEL   16
    1    H1   MET   1           1H       MET   1  37.744  17.129   4.045
    2    H2   MET   1           2H       MET   1  36.561  16.385   3.095
    3    H3   MET   1           3H       MET   1  36.252  16.722   4.724
    4    HA   MET   1           HA       MET   1  36.335  19.067   4.328
    5    HB2  MET   1           2HB      MET   1  36.932  18.241   1.478
    6    HB3  MET   1           1HB      MET   1  36.468  19.873   1.940
    7    HG2  MET   1           2HG      MET   1  38.458  20.045   3.350
    8    HG3  MET   1           1HG      MET   1  38.920  18.403   2.895
    9    HE1  MET   1           3HE      MET   1  40.799  21.008   2.612
   10    HE2  MET   1           1HE      MET   1  41.529  20.710   1.033
   11    HE3  MET   1           2HE      MET   1  41.333  19.383   2.178
   12    H    GLY   2           H        GLY   2  34.280  19.602   4.678
   13    HA2  GLY   2           2HA      GLY   2  32.073  20.054   4.289
   14    HA3  GLY   2           1HA      GLY   2  32.483  19.952   2.593
   15    H    HIS   3           H        HIS   3  32.671  17.143   4.740
   16    HA   HIS   3           HA       HIS   3  30.664  15.821   3.100
   17    HB2  HIS   3           2HB      HIS   3  32.226  14.740   5.461
   18    HB3  HIS   3           1HB      HIS   3  31.227  13.793   4.363
   19    HD1  HIS   3           HD1      HIS   3  32.134  14.594   1.648
   20    HD2  HIS   3           HD2      HIS   3  34.783  14.184   4.822
   21    HE1  HIS   3           HE1      HIS   3  34.388  14.259   0.602
   22    HE2  HIS   3           HE2      HIS   3  35.946  13.866   2.535
   23    H    HIS   4           H        HIS   4  28.767  16.919   3.622
   24    HA   HIS   4           HA       HIS   4  27.838  16.896   6.404
   25    HB2  HIS   4           2HB      HIS   4  26.418  18.066   4.003
   26    HB3  HIS   4           1HB      HIS   4  26.113  18.410   5.701
   27    HD1  HIS   4           HD1      HIS   4  27.695  19.814   2.853
   28    HD2  HIS   4           HD2      HIS   4  28.592  19.682   6.907
   29    HE1  HIS   4           HE1      HIS   4  29.290  21.711   3.253
   30    HE2  HIS   4           HE2      HIS   4  29.805  21.626   5.714
   31    H    HIS   5           H        HIS   5  26.138  15.671   7.127
   32    HA   HIS   5           HA       HIS   5  25.369  13.404   5.529
   33    HB2  HIS   5           2HB      HIS   5  24.344  14.234   8.255
   34    HB3  HIS   5           1HB      HIS   5  24.161  12.650   7.508
   35    HD1  HIS   5           HD1      HIS   5  26.335  14.550   9.695
   36    HD2  HIS   5           HD2      HIS   5  26.762  11.284   7.161
   37    HE1  HIS   5           HE1      HIS   5  28.488  13.452  10.372
   38    HE2  HIS   5           HE2      HIS   5  28.725  11.478   8.835
   39    H    HIS   6           H        HIS   6  24.226  14.318   3.784
   40    HA   HIS   6           HA       HIS   6  21.685  15.657   4.374
   41    HB2  HIS   6           2HB      HIS   6  21.589  15.976   1.869
   42    HB3  HIS   6           1HB      HIS   6  22.934  16.773   2.675
   43    HD1  HIS   6           HD1      HIS   6  25.315  15.777   2.275
   44    HD2  HIS   6           HD2      HIS   6  22.309  14.040  -0.013
   45    HE1  HIS   6           HE1      HIS   6  26.497  14.478   0.488
   46    HE2  HIS   6           HE2      HIS   6  24.672  13.310  -0.781
   47    H    HIS   7           H        HIS   7  20.165  14.201   4.950
   48    HA   HIS   7           HA       HIS   7  20.037  11.646   3.497
   49    HB2  HIS   7           2HB      HIS   7  18.553  10.925   5.409
   50    HB3  HIS   7           1HB      HIS   7  20.218  11.296   5.838
   51    HD1  HIS   7           HD1      HIS   7  16.736  12.728   6.118
   52    HD2  HIS   7           HD2      HIS   7  20.524  13.290   7.727
   53    HE1  HIS   7           HE1      HIS   7  16.421  14.311   8.037
   54    HE2  HIS   7           HE2      HIS   7  18.701  14.547   9.063
   55    H    HIS   8           H        HIS   8  18.852  11.965   1.688
   56    HA   HIS   8           HA       HIS   8  16.007  12.651   2.114
   57    HB2  HIS   8           2HB      HIS   8  17.724  13.267  -0.305
   58    HB3  HIS   8           1HB      HIS   8  15.972  13.441  -0.272
   59    HD1  HIS   8           HD1      HIS   8  19.051  15.241   0.462
   60    HD2  HIS   8           HD2      HIS   8  15.079  15.450   1.674
   61    HE1  HIS   8           HE1      HIS   8  18.780  17.509   1.506
   62    HE2  HIS   8           HE2      HIS   8  16.345  17.661   2.113
   63    H    SER   9           H        SER   9  14.786  10.896   1.909
   64    HA   SER   9           HA       SER   9  15.756   8.535   0.515
   65    HB2  SER   9           2HB      SER   9  13.673   7.488   1.461
   66    HB3  SER   9           1HB      SER   9  14.748   8.185   2.673
   67    HG   SER   9           HG       SER   9  12.204   8.979   1.879
   68    H    HIS  10           H        HIS  10  13.884   7.231  -0.639
   69    HA   HIS  10           HA       HIS  10  12.639   9.034  -2.622
   70    HB2  HIS  10           2HB      HIS  10  13.718   6.225  -2.989
   71    HB3  HIS  10           1HB      HIS  10  12.839   7.124  -4.223
   72    HD1  HIS  10           HD1      HIS  10  14.540   7.758  -5.926
   73    HD2  HIS  10           HD2      HIS  10  15.952   8.310  -2.059
   74    HE1  HIS  10           HE1      HIS  10  16.796   8.825  -6.178
   75    HE2  HIS  10           HE2      HIS  10  17.674   9.049  -3.831
   76    H    MET  11           H        MET  11  10.528   8.699  -3.213
   77    HA   MET  11           HA       MET  11   8.871   7.246  -1.385
   78    HB2  MET  11           2HB      MET  11   6.998   8.068  -2.879
   79    HB3  MET  11           1HB      MET  11   7.990   9.309  -2.133
   80    HG2  MET  11           2HG      MET  11   8.332   8.338  -4.966
   81    HG3  MET  11           1HG      MET  11   7.402   9.760  -4.502
   82    HE1  MET  11           3HE      MET  11  10.183  12.089  -3.011
   83    HE2  MET  11           1HE      MET  11   9.182  10.940  -2.124
   84    HE3  MET  11           2HE      MET  11   8.470  11.929  -3.398
   85    H    VAL  12           H        VAL  12   9.180   5.079  -1.554
   86    HA   VAL  12           HA       VAL  12   8.804   3.742  -4.136
   87    HB   VAL  12           HB       VAL  12   9.522   2.552  -1.441
   88   HG11  VAL  12          1HG1      VAL  12   9.725   1.355  -4.208
   89   HG12  VAL  12          2HG1      VAL  12   8.511   0.942  -2.997
   90   HG13  VAL  12          3HG1      VAL  12  10.213   0.586  -2.697
   91   HG21  VAL  12          3HG2      VAL  12  11.820   2.457  -2.285
   92   HG22  VAL  12          1HG2      VAL  12  11.236   4.119  -2.193
   93   HG23  VAL  12          2HG2      VAL  12  11.319   3.296  -3.752
   94    H    VAL  13           H        VAL  13   6.849   2.931  -4.701
   95    HA   VAL  13           HA       VAL  13   4.752   2.847  -2.620
   96    HB   VAL  13           HB       VAL  13   3.121   3.425  -4.314
   97   HG11  VAL  13          1HG1      VAL  13   4.276   5.258  -3.182
   98   HG12  VAL  13          2HG1      VAL  13   3.852   5.701  -4.834
   99   HG13  VAL  13          3HG1      VAL  13   5.515   5.267  -4.438
  100   HG21  VAL  13          3HG2      VAL  13   5.436   3.436  -6.264
  101   HG22  VAL  13          1HG2      VAL  13   3.796   3.989  -6.616
  102   HG23  VAL  13          2HG2      VAL  13   4.092   2.292  -6.237
  103    H    ILE  14           H        ILE  14   2.737   1.555  -3.574
  104    HA   ILE  14           HA       ILE  14   3.720  -1.151  -4.259
  105    HB   ILE  14           HB       ILE  14   2.739  -0.831  -1.964
  106   HG12  ILE  14          2HG1      ILE  14   0.992  -2.763  -2.253
  107   HG13  ILE  14          1HG1      ILE  14   1.535  -2.773  -3.929
  108   HG21  ILE  14          1HG2      ILE  14   0.172  -0.338  -3.471
  109   HG22  ILE  14          2HG2      ILE  14   1.053   0.829  -2.485
  110   HG23  ILE  14          3HG2      ILE  14   0.310  -0.580  -1.728
  111   HD11  ILE  14          3HD1      ILE  14   3.253  -3.203  -1.490
  112   HD12  ILE  14          1HD1      ILE  14   3.828  -3.186  -3.161
  113   HD13  ILE  14          2HD1      ILE  14   2.704  -4.436  -2.625
  114    H    ARG  15           H        ARG  15   2.430  -2.421  -5.743
  115    HA   ARG  15           HA       ARG  15   0.276  -1.024  -7.173
  116    HB2  ARG  15           2HB      ARG  15   1.243  -1.601  -9.367
  117    HB3  ARG  15           1HB      ARG  15   2.274  -0.506  -8.457
  118    HG2  ARG  15           2HG      ARG  15   3.719  -2.384  -7.829
  119    HG3  ARG  15           1HG      ARG  15   2.684  -3.483  -8.744
  120    HD2  ARG  15           2HD      ARG  15   4.176  -1.131  -9.919
  121    HD3  ARG  15           1HD      ARG  15   4.733  -2.802  -9.971
  122    HE   ARG  15           HE       ARG  15   2.848  -3.314 -11.393
  123   HH11  ARG  15          1HH1      ARG  15   3.395   0.048 -10.876
  124   HH12  ARG  15          2HH1      ARG  15   2.682   0.507 -12.381
  125   HH21  ARG  15          1HH2      ARG  15   1.907  -2.711 -13.304
  126   HH22  ARG  15          2HH2      ARG  15   1.823  -1.035 -13.727
  127    H    ARG  16           H        ARG  16  -0.505  -2.630  -9.052
  128    HA   ARG  16           HA       ARG  16  -1.507  -4.572  -9.664
  129    HB2  ARG  16           2HB      ARG  16   0.341  -5.803  -7.615
  130    HB3  ARG  16           1HB      ARG  16  -0.723  -6.738  -8.654
  131    HG2  ARG  16           2HG      ARG  16   1.215  -4.815  -9.875
  132    HG3  ARG  16           1HG      ARG  16   1.777  -6.383  -9.298
  133    HD2  ARG  16           2HD      ARG  16   1.246  -6.485 -11.668
  134    HD3  ARG  16           1HD      ARG  16   0.147  -7.504 -10.742
  135    HE   ARG  16           HE       ARG  16  -0.921  -4.891 -11.233
  136   HH11  ARG  16          1HH1      ARG  16  -0.422  -8.000 -12.608
  137   HH12  ARG  16          2HH1      ARG  16  -1.765  -7.867 -13.687
  138   HH21  ARG  16          1HH2      ARG  16  -2.663  -4.730 -12.617
  139   HH22  ARG  16          2HH2      ARG  16  -3.009  -6.031 -13.705
  140    H    LEU  17           H        LEU  17  -2.127  -3.017  -6.931
  141    HA   LEU  17           HA       LEU  17  -3.557  -4.798  -5.300
  142    HB2  LEU  17           2HB      LEU  17  -3.755  -1.818  -5.679
  143    HB3  LEU  17           1HB      LEU  17  -4.815  -2.668  -4.575
  144    HG   LEU  17           HG       LEU  17  -3.023  -1.719  -3.308
  145   HD11  LEU  17          1HD1      LEU  17  -2.060  -3.688  -2.248
  146   HD12  LEU  17          2HD1      LEU  17  -2.562  -4.685  -3.613
  147   HD13  LEU  17          3HD1      LEU  17  -3.775  -3.918  -2.585
  148   HD21  LEU  17          3HD2      LEU  17  -1.124  -3.169  -5.147
  149   HD22  LEU  17          1HD2      LEU  17  -0.677  -2.245  -3.711
  150   HD23  LEU  17          2HD2      LEU  17  -1.402  -1.428  -5.093
  151    HA   PRO  18           HA       PRO  18  -7.300  -5.078  -7.830
  152    HB2  PRO  18           2HB      PRO  18  -7.980  -7.571  -7.111
  153    HB3  PRO  18           1HB      PRO  18  -6.655  -7.262  -8.239
  154    HG2  PRO  18           2HG      PRO  18  -6.559  -8.130  -5.409
  155    HG3  PRO  18           1HG      PRO  18  -5.386  -8.395  -6.708
  156    HD2  PRO  18           2HD      PRO  18  -5.310  -6.395  -4.646
  157    HD3  PRO  18           1HD      PRO  18  -4.149  -6.643  -5.963
  158    HA   PRO  19           HA       PRO  19 -10.229  -3.837  -4.673
  159    HB2  PRO  19           2HB      PRO  19 -12.553  -4.376  -6.048
  160    HB3  PRO  19           1HB      PRO  19 -11.562  -2.935  -6.306
  161    HG2  PRO  19           2HG      PRO  19 -11.621  -5.494  -7.867
  162    HG3  PRO  19           1HG      PRO  19 -11.561  -3.823  -8.460
  163    HD2  PRO  19           2HD      PRO  19  -9.357  -5.353  -8.376
  164    HD3  PRO  19           1HD      PRO  19  -9.287  -3.614  -8.016
  165    H    GLY  20           H        GLY  20 -10.897  -4.934  -2.903
  166    HA2  GLY  20           2HA      GLY  20 -12.457  -7.297  -2.954
  167    HA3  GLY  20           1HA      GLY  20 -10.772  -7.722  -2.700
  168    H    LEU  21           H        LEU  21  -9.711  -6.291  -0.920
  169    HA   LEU  21           HA       LEU  21 -11.444  -6.440   1.420
  170    HB2  LEU  21           2HB      LEU  21  -9.507  -6.425   2.778
  171    HB3  LEU  21           1HB      LEU  21  -9.219  -7.544   1.463
  172    HG   LEU  21           HG       LEU  21  -8.090  -4.740   1.638
  173   HD11  LEU  21          1HD1      LEU  21  -7.229  -6.203   3.386
  174   HD12  LEU  21          2HD1      LEU  21  -5.985  -5.827   2.191
  175   HD13  LEU  21          3HD1      LEU  21  -6.778  -7.402   2.172
  176   HD21  LEU  21          3HD2      LEU  21  -7.601  -6.989  -0.317
  177   HD22  LEU  21          1HD2      LEU  21  -6.542  -5.587  -0.148
  178   HD23  LEU  21          2HD2      LEU  21  -8.214  -5.372  -0.660
  179    H    THR  22           H        THR  22 -11.032  -4.778   3.164
  180    HA   THR  22           HA       THR  22 -11.627  -2.160   2.032
  181    HB   THR  22           HB       THR  22 -11.614  -2.894   4.969
  182    HG1  THR  22           HG1      THR  22 -13.813  -3.154   3.165
  183   HG21  THR  22          3HG2      THR  22 -13.204  -0.851   3.402
  184   HG22  THR  22          1HG2      THR  22 -11.827  -0.502   4.448
  185   HG23  THR  22          2HG2      THR  22 -13.318  -1.139   5.139
  186    H    LYS  23           H        LYS  23 -10.477  -0.264   2.517
  187    HA   LYS  23           HA       LYS  23  -7.778  -0.194   2.582
  188    HB2  LYS  23           2HB      LYS  23  -7.945   2.126   3.422
  189    HB3  LYS  23           1HB      LYS  23  -9.100   1.780   2.145
  190    HG2  LYS  23           2HG      LYS  23 -10.850   1.455   3.882
  191    HG3  LYS  23           1HG      LYS  23  -9.677   1.955   5.101
  192    HD2  LYS  23           2HD      LYS  23 -10.620   3.634   2.768
  193    HD3  LYS  23           1HD      LYS  23 -11.149   3.807   4.441
  194    HE2  LYS  23           2HE      LYS  23  -8.848   4.349   5.106
  195    HE3  LYS  23           1HE      LYS  23  -8.326   4.190   3.429
  196    HZ1  LYS  23           3HZ      LYS  23  -8.688   6.497   4.024
  197    HZ2  LYS  23           1HZ      LYS  23 -10.290   6.171   4.453
  198    HZ3  LYS  23           2HZ      LYS  23  -9.801   6.023   2.843
  199    H    GLU  24           H        GLU  24  -9.824  -0.473   5.460
  200    HA   GLU  24           HA       GLU  24  -7.803  -0.047   7.394
  201    HB2  GLU  24           2HB      GLU  24 -10.394  -1.602   7.580
  202    HB3  GLU  24           1HB      GLU  24  -9.401  -1.139   8.958
  203    HG2  GLU  24           2HG      GLU  24  -9.759   1.210   8.474
  204    HG3  GLU  24           1HG      GLU  24 -10.669   0.796   7.022
  205    H    GLN  25           H        GLN  25  -8.984  -3.021   5.843
  206    HA   GLN  25           HA       GLN  25  -7.050  -4.718   7.211
  207    HB2  GLN  25           2HB      GLN  25  -8.796  -5.323   4.804
  208    HB3  GLN  25           1HB      GLN  25  -7.924  -6.498   5.776
  209    HG2  GLN  25           2HG      GLN  25  -9.360  -6.156   7.634
  210    HG3  GLN  25           1HG      GLN  25 -10.092  -4.735   6.886
  211   HE21  GLN  25          1HE2      GLN  25 -11.567  -5.015   5.216
  212   HE22  GLN  25          2HE2      GLN  25 -12.336  -6.526   4.911
  213    H    LEU  26           H        LEU  26  -7.140  -2.738   4.462
  214    HA   LEU  26           HA       LEU  26  -5.181  -4.209   2.914
  215    HB2  LEU  26           2HB      LEU  26  -6.874  -3.297   1.610
  216    HB3  LEU  26           1HB      LEU  26  -6.896  -1.790   2.490
  217    HG   LEU  26           HG       LEU  26  -4.703  -1.209   1.422
  218   HD11  LEU  26          1HD1      LEU  26  -5.242  -3.668  -0.247
  219   HD12  LEU  26          2HD1      LEU  26  -3.936  -3.477   0.925
  220   HD13  LEU  26          3HD1      LEU  26  -3.966  -2.481  -0.530
  221   HD21  LEU  26          3HD2      LEU  26  -7.002  -1.775  -0.452
  222   HD22  LEU  26          1HD2      LEU  26  -5.658  -0.680  -0.776
  223   HD23  LEU  26          2HD2      LEU  26  -6.785  -0.327   0.531
  224    H    GLU  27           H        GLU  27  -5.264  -1.379   4.989
  225    HA   GLU  27           HA       GLU  27  -2.724  -0.334   4.187
  226    HB2  GLU  27           2HB      GLU  27  -2.930   1.154   6.102
  227    HB3  GLU  27           1HB      GLU  27  -4.455   1.075   5.232
  228    HG2  GLU  27           2HG      GLU  27  -5.375  -0.418   6.908
  229    HG3  GLU  27           1HG      GLU  27  -3.828  -0.465   7.750
  230    H    GLU  28           H        GLU  28  -3.733  -2.706   6.550
  231    HA   GLU  28           HA       GLU  28  -1.741  -2.432   8.458
  232    HB2  GLU  28           2HB      GLU  28  -2.307  -4.721   9.175
  233    HB3  GLU  28           1HB      GLU  28  -3.726  -3.732   8.885
  234    HG2  GLU  28           2HG      GLU  28  -4.094  -4.823   6.757
  235    HG3  GLU  28           1HG      GLU  28  -2.619  -5.769   6.961
  236    H    GLN  29           H        GLN  29  -1.479  -4.100   5.354
  237    HA   GLN  29           HA       GLN  29   1.231  -4.983   6.108
  238    HB2  GLN  29           2HB      GLN  29   1.196  -6.247   3.930
  239    HB3  GLN  29           1HB      GLN  29   0.031  -6.785   5.130
  240    HG2  GLN  29           2HG      GLN  29  -0.827  -4.823   3.045
  241    HG3  GLN  29           1HG      GLN  29  -0.651  -6.524   2.615
  242   HE21  GLN  29          1HE2      GLN  29  -3.054  -4.864   2.751
  243   HE22  GLN  29          2HE2      GLN  29  -4.113  -5.662   3.861
  244    H    LEU  30           H        LEU  30  -0.227  -2.373   4.586
  245    HA   LEU  30           HA       LEU  30   2.007  -1.894   2.755
  246    HB2  LEU  30           2HB      LEU  30  -0.551  -0.341   3.176
  247    HB3  LEU  30           1HB      LEU  30   0.666   0.027   1.966
  248    HG   LEU  30           HG       LEU  30  -1.035  -2.473   2.078
  249   HD11  LEU  30          1HD1      LEU  30  -2.263  -0.487   1.352
  250   HD12  LEU  30          2HD1      LEU  30  -2.028  -1.615   0.019
  251   HD13  LEU  30          3HD1      LEU  30  -1.031  -0.164   0.132
  252   HD21  LEU  30          3HD2      LEU  30   1.049  -1.653   0.048
  253   HD22  LEU  30          1HD2      LEU  30   0.000  -3.069  -0.052
  254   HD23  LEU  30          2HD2      LEU  30   1.210  -2.957   1.224
  255    H    ARG  31           H        ARG  31   1.126  -1.062   5.947
  256    HA   ARG  31           HA       ARG  31   3.237   0.990   5.941
  257    HB2  ARG  31           2HB      ARG  31   1.846   2.272   7.663
  258    HB3  ARG  31           1HB      ARG  31   1.345   2.360   5.983
  259    HG2  ARG  31           2HG      ARG  31  -0.656   2.090   7.107
  260    HG3  ARG  31           1HG      ARG  31  -0.276   0.455   6.589
  261    HD2  ARG  31           2HD      ARG  31   0.361  -0.207   8.759
  262    HD3  ARG  31           1HD      ARG  31   0.450   1.462   9.326
  263    HE   ARG  31           HE       ARG  31  -2.112   1.332   8.721
  264   HH11  ARG  31          1HH1      ARG  31  -0.226  -1.095  10.288
  265   HH12  ARG  31          2HH1      ARG  31  -1.545  -1.613  11.280
  266   HH21  ARG  31          1HH2      ARG  31  -3.763   0.661   9.995
  267   HH22  ARG  31          2HH2      ARG  31  -3.519  -0.624  11.130
  268    HA   PRO  32           HA       PRO  32   3.583  -1.798   9.735
  269    HB2  PRO  32           2HB      PRO  32   5.064  -3.893   8.981
  270    HB3  PRO  32           1HB      PRO  32   3.322  -3.861   8.684
  271    HG2  PRO  32           2HG      PRO  32   5.570  -3.301   6.787
  272    HG3  PRO  32           1HG      PRO  32   4.082  -4.228   6.517
  273    HD2  PRO  32           2HD      PRO  32   4.453  -1.590   5.758
  274    HD3  PRO  32           1HD      PRO  32   2.874  -2.353   6.020
  275    H    LEU  33           H        LEU  33   5.341   0.218   8.051
  276    HA   LEU  33           HA       LEU  33   8.051  -0.460   8.763
  277    HB2  LEU  33           2HB      LEU  33   6.868   2.073   7.600
  278    HB3  LEU  33           1HB      LEU  33   8.582   1.811   7.853
  279    HG   LEU  33           HG       LEU  33   8.374  -0.191   6.283
  280   HD11  LEU  33          1HD1      LEU  33   5.746   1.140   5.627
  281   HD12  LEU  33          2HD1      LEU  33   5.958  -0.458   6.345
  282   HD13  LEU  33          3HD1      LEU  33   6.512  -0.153   4.701
  283   HD21  LEU  33          3HD2      LEU  33   9.423   1.919   5.636
  284   HD22  LEU  33          1HD2      LEU  33   7.849   2.569   5.178
  285   HD23  LEU  33          2HD2      LEU  33   8.536   1.208   4.289
  286    HA   PRO  34           HA       PRO  34   8.282   1.469  12.758
  287    HB2  PRO  34           2HB      PRO  34  10.843   2.422  12.760
  288    HB3  PRO  34           1HB      PRO  34  10.442   0.710  12.940
  289    HG2  PRO  34           2HG      PRO  34  11.304   2.205  10.482
  290    HG3  PRO  34           1HG      PRO  34  11.845   0.622  11.073
  291    HD2  PRO  34           2HD      PRO  34  10.029   0.853   9.093
  292    HD3  PRO  34           1HD      PRO  34   9.952  -0.463  10.284
  293    H    ALA  35           H        ALA  35   9.239   3.425   9.967
  294    HA   ALA  35           HA       ALA  35   7.777   5.697  10.957
  295    HB1  ALA  35           3HB      ALA  35   9.863   5.975  12.213
  296    HB2  ALA  35           1HB      ALA  35   9.644   7.273  11.041
  297    HB3  ALA  35           2HB      ALA  35  10.778   5.964  10.706
  298    H    HIS  36           H        HIS  36   6.776   6.472   9.201
  299    HA   HIS  36           HA       HIS  36   8.063   7.523   6.955
  300    HB2  HIS  36           2HB      HIS  36   7.766   5.973   5.209
  301    HB3  HIS  36           1HB      HIS  36   8.383   4.992   6.530
  302    HD1  HIS  36           HD1      HIS  36   5.913   4.304   8.096
  303    HD2  HIS  36           HD2      HIS  36   5.959   4.421   3.940
  304    HE1  HIS  36           HE1      HIS  36   3.988   2.876   7.361
  305    HE2  HIS  36           HE2      HIS  36   4.102   2.865   4.846
  306    H    ASP  37           H        ASP  37   6.509   8.207   5.223
  307    HA   ASP  37           HA       ASP  37   3.857   8.714   6.318
  308    HB2  ASP  37           2HB      ASP  37   5.154   9.638   3.740
  309    HB3  ASP  37           1HB      ASP  37   3.555  10.128   4.293
  310    H    TYR  38           H        TYR  38   1.960   7.887   5.533
  311    HA   TYR  38           HA       TYR  38   2.119   5.993   3.276
  312    HB2  TYR  38           2HB      TYR  38   0.277   4.689   4.526
  313    HB3  TYR  38           1HB      TYR  38   1.929   4.534   5.106
  314    HD1  TYR  38           HD2      TYR  38   2.628   5.695   7.184
  315    HD2  TYR  38           HD1      TYR  38  -1.440   5.665   5.914
  316    HE1  TYR  38           HE2      TYR  38   1.925   6.378   9.434
  317    HE2  TYR  38           HE1      TYR  38  -2.151   6.352   8.168
  318    HH   TYR  38           HH       TYR  38  -1.206   6.201  10.540
  319    H    PHE  39           H        PHE  39   0.777   6.453   1.667
  320    HA   PHE  39           HA       PHE  39  -0.920   8.766   1.904
  321    HB2  PHE  39           2HB      PHE  39   0.169   7.112  -0.301
  322    HB3  PHE  39           1HB      PHE  39  -1.361   7.916  -0.631
  323    HD1  PHE  39           HD2      PHE  39   2.208   8.417   0.098
  324    HD2  PHE  39           HD1      PHE  39  -1.506  10.296  -0.805
  325    HE1  PHE  39           HE2      PHE  39   3.391  10.520  -0.393
  326    HE2  PHE  39           HE1      PHE  39  -0.339  12.389  -1.296
  327    HZ   PHE  39           HZ       PHE  39   2.120  12.514  -1.091
  328    H    GLU  40           H        GLU  40  -2.996   8.587   0.427
  329    HA   GLU  40           HA       GLU  40  -4.949   7.301   1.935
  330    HB2  GLU  40           2HB      GLU  40  -6.440   7.793  -0.070
  331    HB3  GLU  40           1HB      GLU  40  -5.622   9.164   0.669
  332    HG2  GLU  40           2HG      GLU  40  -3.967   9.184  -1.087
  333    HG3  GLU  40           1HG      GLU  40  -4.658   7.731  -1.804
  334    H    PHE  41           H        PHE  41  -5.764   5.331   1.989
  335    HA   PHE  41           HA       PHE  41  -4.999   3.376  -0.070
  336    HB2  PHE  41           2HB      PHE  41  -6.344   2.889   2.606
  337    HB3  PHE  41           1HB      PHE  41  -5.662   1.669   1.536
  338    HD1  PHE  41           HD1      PHE  41  -3.195   1.558   1.210
  339    HD2  PHE  41           HD2      PHE  41  -4.984   4.084   4.138
  340    HE1  PHE  41           HE1      PHE  41  -1.027   1.758   2.355
  341    HE2  PHE  41           HE2      PHE  41  -2.819   4.288   5.289
  342    HZ   PHE  41           HZ       PHE  41  -0.837   3.125   4.396
  343    H    PHE  42           H        PHE  42  -6.463   2.687  -1.556
  344    HA   PHE  42           HA       PHE  42  -9.000   3.924  -1.746
  345    HB2  PHE  42           2HB      PHE  42  -9.347   2.599  -3.735
  346    HB3  PHE  42           1HB      PHE  42  -7.681   3.157  -3.708
  347    HD1  PHE  42           HD2      PHE  42  -5.855   1.559  -3.100
  348    HD2  PHE  42           HD1      PHE  42  -9.869   0.281  -3.767
  349    HE1  PHE  42           HE2      PHE  42  -5.071  -0.752  -3.399
  350    HE2  PHE  42           HE1      PHE  42  -9.085  -2.032  -4.067
  351    HZ   PHE  42           HZ       PHE  42  -6.683  -2.547  -3.883
  352    H    ALA  43           H        ALA  43 -11.079   3.128  -1.491
  353    HA   ALA  43           HA       ALA  43 -11.315   0.676   0.135
  354    HB1  ALA  43           3HB      ALA  43 -11.980   2.746   1.287
  355    HB2  ALA  43           1HB      ALA  43 -13.330   1.626   1.100
  356    HB3  ALA  43           2HB      ALA  43 -13.198   3.034   0.044
  357    H    ALA  44           H        ALA  44 -11.519  -0.781  -1.576
  358    HA   ALA  44           HA       ALA  44 -14.089  -0.644  -3.022
  359    HB1  ALA  44           3HB      ALA  44 -12.208  -0.171  -4.549
  360    HB2  ALA  44           1HB      ALA  44 -13.066  -1.651  -4.972
  361    HB3  ALA  44           2HB      ALA  44 -11.510  -1.740  -4.147
  362    H    ASP  45           H        ASP  45 -15.181  -1.984  -1.647
  363    HA   ASP  45           HA       ASP  45 -14.064  -4.343  -0.519
  364    HB2  ASP  45           2HB      ASP  45 -16.991  -3.608  -0.712
  365    HB3  ASP  45           1HB      ASP  45 -16.240  -4.694   0.454
  366    H    LEU  46           H        LEU  46 -14.600  -6.502  -0.870
  367    HA   LEU  46           HA       LEU  46 -14.565  -7.367  -3.504
  368    HB2  LEU  46           2HB      LEU  46 -14.826  -9.614  -2.668
  369    HB3  LEU  46           1HB      LEU  46 -13.752  -8.710  -1.618
  370    HG   LEU  46           HG       LEU  46 -16.663  -9.299  -0.993
  371   HD11  LEU  46          1HD1      LEU  46 -14.166 -10.647   0.032
  372   HD12  LEU  46          2HD1      LEU  46 -15.352 -11.351  -1.067
  373   HD13  LEU  46          3HD1      LEU  46 -15.814 -10.952   0.587
  374   HD21  LEU  46          3HD2      LEU  46 -16.091  -8.596   1.280
  375   HD22  LEU  46          1HD2      LEU  46 -15.825  -7.288   0.125
  376   HD23  LEU  46          2HD2      LEU  46 -14.453  -8.201   0.755
  377    H    SER  47           H        SER  47 -16.047  -7.346  -5.004
  378    HA   SER  47           HA       SER  47 -18.893  -7.706  -4.293
  379    HB2  SER  47           2HB      SER  47 -17.819  -5.832  -6.427
  380    HB3  SER  47           1HB      SER  47 -19.506  -6.034  -5.959
  381    HG   SER  47           HG       SER  47 -17.503  -5.201  -4.132
  382    H    LEU  48           H        LEU  48 -20.225  -8.309  -6.330
  383    HA   LEU  48           HA       LEU  48 -19.091 -10.572  -7.605
  384    HB2  LEU  48           2HB      LEU  48 -21.538 -10.214  -7.271
  385    HB3  LEU  48           1HB      LEU  48 -21.495  -8.960  -8.495
  386    HG   LEU  48           HG       LEU  48 -20.748 -10.680 -10.155
  387   HD11  LEU  48          1HD1      LEU  48 -19.774 -12.296  -8.624
  388   HD12  LEU  48          2HD1      LEU  48 -21.040 -13.048  -9.597
  389   HD13  LEU  48          3HD1      LEU  48 -21.361 -12.611  -7.918
  390   HD21  LEU  48          3HD2      LEU  48 -23.380 -11.248  -8.785
  391   HD22  LEU  48          1HD2      LEU  48 -22.947 -11.703 -10.434
  392   HD23  LEU  48          2HD2      LEU  48 -23.092 -10.001  -9.999
  393    H    TYR  49           H        TYR  49 -17.191 -10.055  -8.644
  394    HA   TYR  49           HA       TYR  49 -15.728  -9.214 -10.162
  395    HB2  TYR  49           2HB      TYR  49 -18.184  -8.822 -11.896
  396    HB3  TYR  49           1HB      TYR  49 -16.515  -8.917 -12.454
  397    HD1  TYR  49           HD2      TYR  49 -15.295 -11.088 -12.354
  398    HD2  TYR  49           HD1      TYR  49 -19.425 -10.799 -11.361
  399    HE1  TYR  49           HE2      TYR  49 -15.512 -13.532 -12.539
  400    HE2  TYR  49           HE1      TYR  49 -19.646 -13.236 -11.539
  401    HH   TYR  49           HH       TYR  49 -18.543 -15.113 -12.606
  402    HA   PRO  50           HA       PRO  50 -16.737  -4.979  -8.608
  403    HB2  PRO  50           2HB      PRO  50 -13.801  -4.896  -8.221
  404    HB3  PRO  50           1HB      PRO  50 -15.098  -4.560  -7.071
  405    HG2  PRO  50           2HG      PRO  50 -13.644  -6.794  -6.889
  406    HG3  PRO  50           1HG      PRO  50 -15.382  -6.797  -6.530
  407    HD2  PRO  50           2HD      PRO  50 -13.957  -7.719  -9.010
  408    HD3  PRO  50           1HD      PRO  50 -15.309  -8.479  -8.140
  409    H    HIS  51           H        HIS  51 -13.841  -5.704 -10.574
  410    HA   HIS  51           HA       HIS  51 -13.009  -4.789 -12.474
  411    HB2  HIS  51           2HB      HIS  51 -15.565  -3.170 -12.585
  412    HB3  HIS  51           1HB      HIS  51 -14.377  -3.288 -13.876
  413    HD1  HIS  51           HD1      HIS  51 -13.954  -6.052 -14.509
  414    HD2  HIS  51           HD2      HIS  51 -17.646  -4.813 -13.058
  415    HE1  HIS  51           HE1      HIS  51 -15.584  -7.816 -15.226
  416    HE2  HIS  51           HE2      HIS  51 -17.829  -6.949 -14.506
  417    H    LEU  52           H        LEU  52 -13.380  -3.068  -9.670
  418    HA   LEU  52           HA       LEU  52 -12.855  -0.408 -10.383
  419    HB2  LEU  52           2HB      LEU  52 -12.284  -1.951  -7.865
  420    HB3  LEU  52           1HB      LEU  52 -11.822  -0.269  -8.026
  421    HG   LEU  52           HG       LEU  52 -13.877  -0.314  -6.842
  422   HD11  LEU  52          1HD1      LEU  52 -15.364   0.963  -8.268
  423   HD12  LEU  52          2HD1      LEU  52 -14.490   0.417  -9.701
  424   HD13  LEU  52          3HD1      LEU  52 -13.688   1.450  -8.515
  425   HD21  LEU  52          3HD2      LEU  52 -15.910  -1.382  -7.669
  426   HD22  LEU  52          1HD2      LEU  52 -14.622  -2.558  -7.421
  427   HD23  LEU  52          2HD2      LEU  52 -15.021  -2.019  -9.053
  428    H    TYR  53           H        TYR  53 -11.100   0.721 -10.932
  429    HA   TYR  53           HA       TYR  53  -8.512  -0.692 -11.152
  430    HB2  TYR  53           2HB      TYR  53  -9.066   1.938 -12.505
  431    HB3  TYR  53           1HB      TYR  53  -8.004   0.630 -13.012
  432    HD1  TYR  53           HD2      TYR  53 -11.488   1.810 -12.901
  433    HD2  TYR  53           HD1      TYR  53  -8.842  -1.186 -14.378
  434    HE1  TYR  53           HE2      TYR  53 -13.235   1.037 -14.441
  435    HE2  TYR  53           HE1      TYR  53 -10.590  -1.963 -15.927
  436    HH   TYR  53           HH       TYR  53 -12.996  -1.899 -16.183
  437    H    SER  54           H        SER  54  -7.421  -0.267  -9.225
  438    HA   SER  54           HA       SER  54  -6.749   2.484  -8.604
  439    HB2  SER  54           2HB      SER  54  -8.361   0.843  -6.626
  440    HB3  SER  54           1HB      SER  54  -7.574   2.376  -6.253
  441    HG   SER  54           HG       SER  54  -8.976   2.892  -8.364
  442    H    ARG  55           H        ARG  55  -5.351   2.619  -6.604
  443    HA   ARG  55           HA       ARG  55  -4.095   0.263  -5.583
  444    HB2  ARG  55           2HB      ARG  55  -1.847   0.601  -6.404
  445    HB3  ARG  55           1HB      ARG  55  -2.926   0.445  -7.780
  446    HG2  ARG  55           2HG      ARG  55  -1.994   3.106  -6.711
  447    HG3  ARG  55           1HG      ARG  55  -1.138   2.213  -7.966
  448    HD2  ARG  55           2HD      ARG  55  -3.099   2.320  -9.405
  449    HD3  ARG  55           1HD      ARG  55  -4.007   3.141  -8.135
  450    HE   ARG  55           HE       ARG  55  -2.008   4.836  -8.434
  451   HH11  ARG  55          1HH1      ARG  55  -3.787   3.188 -10.881
  452   HH12  ARG  55          2HH1      ARG  55  -3.633   4.488 -12.011
  453   HH21  ARG  55          1HH2      ARG  55  -1.822   6.485  -9.872
  454   HH22  ARG  55          2HH2      ARG  55  -2.524   6.335 -11.449
  455    H    ALA  56           H        ALA  56  -2.259   0.872  -4.062
  456    HA   ALA  56           HA       ALA  56  -2.915   3.435  -2.757
  457    HB1  ALA  56           3HB      ALA  56  -1.588   0.999  -1.553
  458    HB2  ALA  56           1HB      ALA  56  -3.304   1.394  -1.425
  459    HB3  ALA  56           2HB      ALA  56  -2.098   2.454  -0.693
  460    H    TYR  57           H        TYR  57  -1.199   4.722  -1.861
  461    HA   TYR  57           HA       TYR  57   1.413   4.276  -3.166
  462    HB2  TYR  57           2HB      TYR  57  -0.059   6.856  -2.616
  463    HB3  TYR  57           1HB      TYR  57   1.663   6.816  -2.981
  464    HD1  TYR  57           HD1      TYR  57  -1.678   5.895  -4.353
  465    HD2  TYR  57           HD2      TYR  57   2.414   6.701  -5.212
  466    HE1  TYR  57           HE1      TYR  57  -2.179   5.864  -6.759
  467    HE2  TYR  57           HE2      TYR  57   1.922   6.672  -7.619
  468    HH   TYR  57           HH       TYR  57   0.293   5.825  -9.159
  469    H    ILE  58           H        ILE  58   3.250   4.435  -1.986
  470    HA   ILE  58           HA       ILE  58   3.003   5.019   0.899
  471    HB   ILE  58           HB       ILE  58   4.849   2.961  -0.348
  472   HG12  ILE  58          2HG1      ILE  58   2.309   2.482   1.248
  473   HG13  ILE  58          1HG1      ILE  58   2.438   2.307  -0.499
  474   HG21  ILE  58          1HG2      ILE  58   5.192   2.244   1.995
  475   HG22  ILE  58          2HG2      ILE  58   4.211   3.609   2.532
  476   HG23  ILE  58          3HG2      ILE  58   5.739   3.895   1.696
  477   HD11  ILE  58          3HD1      ILE  58   4.073   0.516  -0.197
  478   HD12  ILE  58          1HD1      ILE  58   2.548   0.156   0.612
  479   HD13  ILE  58          2HD1      ILE  58   3.939   0.692   1.555
  480    H    ASN  59           H        ASN  59   4.669   6.223   1.837
  481    HA   ASN  59           HA       ASN  59   6.812   7.138   0.020
  482    HB2  ASN  59           2HB      ASN  59   5.136   8.918   0.451
  483    HB3  ASN  59           1HB      ASN  59   5.460   8.780   2.177
  484   HD21  ASN  59          1HD2      ASN  59   6.193  10.892   2.349
  485   HD22  ASN  59          2HD2      ASN  59   7.694  11.408   1.679
  486    H    PHE  60           H        PHE  60   8.647   6.223   0.668
  487    HA   PHE  60           HA       PHE  60   9.178   5.480   3.396
  488    HB2  PHE  60           2HB      PHE  60  10.783   5.374   0.847
  489    HB3  PHE  60           1HB      PHE  60  11.520   5.003   2.402
  490    HD1  PHE  60           HD2      PHE  60   8.461   4.086   0.442
  491    HD2  PHE  60           HD1      PHE  60  11.590   2.801   3.034
  492    HE1  PHE  60           HE2      PHE  60   7.638   1.770   0.287
  493    HE2  PHE  60           HE1      PHE  60  10.770   0.492   2.885
  494    HZ   PHE  60           HZ       PHE  60   8.794  -0.028   1.508
  495    H    ARG  61           H        ARG  61  10.614   6.390   4.824
  496    HA   ARG  61           HA       ARG  61  11.635   9.085   4.148
  497    HB2  ARG  61           2HB      ARG  61  10.591   8.038   6.791
  498    HB3  ARG  61           1HB      ARG  61  11.369   9.603   6.585
  499    HG2  ARG  61           2HG      ARG  61   8.853   8.760   5.147
  500    HG3  ARG  61           1HG      ARG  61   8.883   9.691   6.645
  501    HD2  ARG  61           2HD      ARG  61  10.183  10.553   4.057
  502    HD3  ARG  61           1HD      ARG  61   8.600  11.095   4.612
  503    HE   ARG  61           HE       ARG  61  11.195  11.870   5.689
  504   HH11  ARG  61          1HH1      ARG  61   7.766  11.989   5.952
  505   HH12  ARG  61          2HH1      ARG  61   7.782  13.351   7.016
  506   HH21  ARG  61          1HH2      ARG  61  11.207  13.624   7.067
  507   HH22  ARG  61          2HH2      ARG  61   9.704  14.269   7.631
  508    H    ASN  62           H        ASN  62  12.800   6.195   4.219
  509    HA   ASN  62           HA       ASN  62  15.399   6.988   5.228
  510    HB2  ASN  62           2HB      ASN  62  14.135   6.083   7.226
  511    HB3  ASN  62           1HB      ASN  62  14.078   4.530   6.401
  512   HD21  ASN  62          1HD2      ASN  62  15.306   3.457   7.907
  513   HD22  ASN  62          2HD2      ASN  62  16.990   3.769   8.144
  514    HA   PRO  63           HA       PRO  63  16.310   4.470   1.568
  515    HB2  PRO  63           2HB      PRO  63  19.053   4.458   1.954
  516    HB3  PRO  63           1HB      PRO  63  18.160   5.733   1.119
  517    HG2  PRO  63           2HG      PRO  63  19.121   5.633   3.954
  518    HG3  PRO  63           1HG      PRO  63  19.144   6.991   2.811
  519    HD2  PRO  63           2HD      PRO  63  17.301   6.834   4.752
  520    HD3  PRO  63           1HD      PRO  63  16.884   7.463   3.143
  521    H    ASP  64           H        ASP  64  17.699   3.820   4.779
  522    HA   ASP  64           HA       ASP  64  18.494   1.153   4.333
  523    HB2  ASP  64           2HB      ASP  64  17.554   2.408   6.930
  524    HB3  ASP  64           1HB      ASP  64  18.520   0.941   6.771
  525    H    ASP  65           H        ASP  65  15.373   2.550   5.184
  526    HA   ASP  65           HA       ASP  65  14.054   0.062   5.694
  527    HB2  ASP  65           2HB      ASP  65  12.945   2.803   5.024
  528    HB3  ASP  65           1HB      ASP  65  11.956   1.421   5.481
  529    H    ILE  66           H        ILE  66  14.616   2.033   2.842
  530    HA   ILE  66           HA       ILE  66  12.693   0.961   1.115
  531    HB   ILE  66           HB       ILE  66  15.441   2.041   0.454
  532   HG12  ILE  66          2HG1      ILE  66  12.690   3.326   0.398
  533   HG13  ILE  66          1HG1      ILE  66  13.964   3.659   1.564
  534   HG21  ILE  66          1HG2      ILE  66  14.594   2.337  -1.844
  535   HG22  ILE  66          2HG2      ILE  66  13.119   1.475  -1.400
  536   HG23  ILE  66          3HG2      ILE  66  14.670   0.638  -1.376
  537   HD11  ILE  66          3HD1      ILE  66  13.790   5.409  -0.117
  538   HD12  ILE  66          1HD1      ILE  66  14.099   4.230  -1.390
  539   HD13  ILE  66          2HD1      ILE  66  15.351   4.593  -0.204
  540    H    LEU  67           H        LEU  67  16.171   0.061   1.169
  541    HA   LEU  67           HA       LEU  67  15.884  -2.186  -0.490
  542    HB2  LEU  67           2HB      LEU  67  18.111  -2.886   0.410
  543    HB3  LEU  67           1HB      LEU  67  18.046  -1.259  -0.233
  544    HG   LEU  67           HG       LEU  67  17.739  -0.531   2.257
  545   HD11  LEU  67          1HD1      LEU  67  18.822  -2.010   3.878
  546   HD12  LEU  67          2HD1      LEU  67  18.959  -3.264   2.647
  547   HD13  LEU  67          3HD1      LEU  67  17.368  -2.742   3.202
  548   HD21  LEU  67          3HD2      LEU  67  19.704  -0.037   0.877
  549   HD22  LEU  67          1HD2      LEU  67  20.387  -1.612   1.285
  550   HD23  LEU  67          2HD2      LEU  67  20.154  -0.399   2.543
  551    H    LEU  68           H        LEU  68  15.256  -1.810   2.891
  552    HA   LEU  68           HA       LEU  68  15.279  -4.585   3.587
  553    HB2  LEU  68           2HB      LEU  68  15.623  -3.000   5.330
  554    HB3  LEU  68           1HB      LEU  68  14.163  -2.121   4.916
  555    HG   LEU  68           HG       LEU  68  12.796  -4.019   5.699
  556   HD11  LEU  68          1HD1      LEU  68  15.434  -5.227   6.533
  557   HD12  LEU  68          2HD1      LEU  68  14.351  -5.841   5.282
  558   HD13  LEU  68          3HD1      LEU  68  13.837  -5.837   6.969
  559   HD21  LEU  68          3HD2      LEU  68  13.299  -2.205   7.236
  560   HD22  LEU  68          1HD2      LEU  68  14.796  -3.004   7.721
  561   HD23  LEU  68          2HD2      LEU  68  13.239  -3.742   8.096
  562    H    PHE  69           H        PHE  69  12.495  -2.332   3.523
  563    HA   PHE  69           HA       PHE  69  10.631  -4.465   3.665
  564    HB2  PHE  69           2HB      PHE  69  10.377  -1.497   3.291
  565    HB3  PHE  69           1HB      PHE  69   8.961  -2.541   3.177
  566    HD1  PHE  69           HD2      PHE  69   8.258  -3.887   5.114
  567    HD2  PHE  69           HD1      PHE  69  11.371  -0.993   5.428
  568    HE1  PHE  69           HE2      PHE  69   8.037  -3.927   7.553
  569    HE2  PHE  69           HE1      PHE  69  11.154  -1.031   7.880
  570    HZ   PHE  69           HZ       PHE  69   9.484  -2.499   8.947
  571    H    ARG  70           H        ARG  70  11.756  -2.484   0.939
  572    HA   ARG  70           HA       ARG  70   9.823  -3.177  -0.939
  573    HB2  ARG  70           2HB      ARG  70  11.533  -1.469  -1.356
  574    HB3  ARG  70           1HB      ARG  70  12.784  -2.701  -1.401
  575    HG2  ARG  70           2HG      ARG  70  10.500  -2.853  -3.334
  576    HG3  ARG  70           1HG      ARG  70  11.807  -1.703  -3.617
  577    HD2  ARG  70           2HD      ARG  70  13.429  -3.462  -3.712
  578    HD3  ARG  70           1HD      ARG  70  12.258  -4.655  -3.153
  579    HE   ARG  70           HE       ARG  70  11.433  -3.410  -5.585
  580   HH11  ARG  70          1HH1      ARG  70  13.660  -5.738  -4.366
  581   HH12  ARG  70          2HH1      ARG  70  13.525  -6.755  -5.757
  582   HH21  ARG  70          1HH2      ARG  70  11.321  -4.677  -7.390
  583   HH22  ARG  70          2HH2      ARG  70  12.235  -6.144  -7.472
  584    H    ASP  71           H        ASP  71  12.848  -4.901  -0.162
  585    HA   ASP  71           HA       ASP  71  12.512  -6.898  -2.147
  586    HB2  ASP  71           2HB      ASP  71  14.683  -6.238  -1.078
  587    HB3  ASP  71           1HB      ASP  71  14.170  -7.088   0.378
  588    H    ARG  72           H        ARG  72  11.677  -6.829   1.311
  589    HA   ARG  72           HA       ARG  72  10.853  -9.610   1.304
  590    HB2  ARG  72           2HB      ARG  72  10.319  -9.249   3.675
  591    HB3  ARG  72           1HB      ARG  72  11.949  -8.719   3.282
  592    HG2  ARG  72           2HG      ARG  72  11.164  -6.394   3.207
  593    HG3  ARG  72           1HG      ARG  72   9.541  -6.934   3.634
  594    HD2  ARG  72           2HD      ARG  72  12.009  -7.338   5.333
  595    HD3  ARG  72           1HD      ARG  72  10.817  -6.062   5.572
  596    HE   ARG  72           HE       ARG  72   9.350  -8.351   5.633
  597   HH11  ARG  72          1HH1      ARG  72  12.140  -7.259   7.354
  598   HH12  ARG  72          2HH1      ARG  72  11.731  -8.138   8.781
  599   HH21  ARG  72          1HH2      ARG  72   8.843  -9.467   7.482
  600   HH22  ARG  72          2HH2      ARG  72   9.878  -9.353   8.864
  601    H    PHE  73           H        PHE  73   9.343  -6.893   0.199
  602    HA   PHE  73           HA       PHE  73   6.689  -8.085   0.702
  603    HB2  PHE  73           2HB      PHE  73   7.543  -5.222   0.769
  604    HB3  PHE  73           1HB      PHE  73   5.917  -5.595   0.205
  605    HD1  PHE  73           HD1      PHE  73   4.334  -6.776   1.697
  606    HD2  PHE  73           HD2      PHE  73   8.094  -5.328   3.105
  607    HE1  PHE  73           HE1      PHE  73   3.528  -6.936   4.015
  608    HE2  PHE  73           HE2      PHE  73   7.289  -5.494   5.421
  609    HZ   PHE  73           HZ       PHE  73   5.008  -6.300   5.881
  610    H    ASP  74           H        ASP  74   8.937  -7.134  -1.697
  611    HA   ASP  74           HA       ASP  74   7.150  -6.622  -3.832
  612    HB2  ASP  74           2HB      ASP  74   9.491  -5.947  -3.942
  613    HB3  ASP  74           1HB      ASP  74  10.004  -7.632  -3.890
  614    H    GLY  75           H        GLY  75   5.655  -8.024  -4.491
  615    HA2  GLY  75           2HA      GLY  75   4.947  -9.904  -5.711
  616    HA3  GLY  75           1HA      GLY  75   6.468 -10.701  -5.339
  617    H    TYR  76           H        TYR  76   4.642  -9.209  -2.794
  618    HA   TYR  76           HA       TYR  76   4.343 -11.783  -1.483
  619    HB2  TYR  76           2HB      TYR  76   5.109 -10.309   0.074
  620    HB3  TYR  76           1HB      TYR  76   4.363  -8.925  -0.704
  621    HD1  TYR  76           HD2      TYR  76   3.373 -11.967   1.272
  622    HD2  TYR  76           HD1      TYR  76   2.643  -7.869   0.376
  623    HE1  TYR  76           HE2      TYR  76   1.660 -11.891   3.034
  624    HE2  TYR  76           HE1      TYR  76   0.938  -7.781   2.129
  625    HH   TYR  76           HH       TYR  76  -0.519  -9.280   3.371
  626    H    ILE  77           H        ILE  77   2.590 -12.991  -1.831
  627    HA   ILE  77           HA       ILE  77   0.070 -11.855  -2.704
  628    HB   ILE  77           HB       ILE  77   0.843 -14.714  -2.067
  629   HG12  ILE  77          2HG1      ILE  77   1.940 -13.672  -4.078
  630   HG13  ILE  77          1HG1      ILE  77   0.931 -15.066  -4.452
  631   HG21  ILE  77          1HG2      ILE  77  -1.542 -14.415  -1.707
  632   HG22  ILE  77          2HG2      ILE  77  -1.260 -15.363  -3.167
  633   HG23  ILE  77          3HG2      ILE  77  -1.711 -13.663  -3.294
  634   HD11  ILE  77          3HD1      ILE  77  -0.837 -13.592  -5.225
  635   HD12  ILE  77          1HD1      ILE  77   0.670 -13.278  -6.083
  636   HD13  ILE  77          2HD1      ILE  77   0.139 -12.185  -4.806
  637    H    PHE  78           H        PHE  78  -1.438 -11.111  -1.341
  638    HA   PHE  78           HA       PHE  78  -1.556 -12.201   1.397
  639    HB2  PHE  78           2HB      PHE  78  -1.220  -9.781   1.309
  640    HB3  PHE  78           1HB      PHE  78  -2.651  -9.595   0.299
  641    HD1  PHE  78           HD1      PHE  78  -1.698 -11.078   3.605
  642    HD2  PHE  78           HD2      PHE  78  -4.606  -8.932   1.348
  643    HE1  PHE  78           HE1      PHE  78  -3.079 -10.833   5.624
  644    HE2  PHE  78           HE2      PHE  78  -5.991  -8.687   3.366
  645    HZ   PHE  78           HZ       PHE  78  -5.228  -9.634   5.503
  646    H    LEU  79           H        LEU  79  -3.362 -13.213   2.144
  647    HA   LEU  79           HA       LEU  79  -5.684 -13.418   0.318
  648    HB2  LEU  79           2HB      LEU  79  -4.676 -15.411   2.359
  649    HB3  LEU  79           1HB      LEU  79  -6.116 -15.614   1.377
  650    HG   LEU  79           HG       LEU  79  -3.307 -15.400   0.268
  651   HD11  LEU  79          1HD1      LEU  79  -3.596 -17.446   1.582
  652   HD12  LEU  79          2HD1      LEU  79  -3.463 -17.799  -0.141
  653   HD13  LEU  79          3HD1      LEU  79  -5.040 -17.845   0.650
  654   HD21  LEU  79          3HD2      LEU  79  -4.319 -16.158  -1.821
  655   HD22  LEU  79          1HD2      LEU  79  -5.036 -14.638  -1.285
  656   HD23  LEU  79          2HD2      LEU  79  -5.911 -16.153  -1.063
  657    H    ASP  80           H        ASP  80  -7.666 -12.831   1.075
  658    HA   ASP  80           HA       ASP  80  -7.880 -11.812   3.797
  659    HB2  ASP  80           2HB      ASP  80  -9.946 -10.823   3.096
  660    HB3  ASP  80           1HB      ASP  80  -8.807 -10.599   1.774
  661    H    SER  81           H        SER  81 -10.651 -12.279   4.206
  662    HA   SER  81           HA       SER  81 -10.701 -14.807   5.435
  663    HB2  SER  81           2HB      SER  81 -12.984 -12.994   4.621
  664    HB3  SER  81           1HB      SER  81 -13.165 -14.413   5.651
  665    HG   SER  81           HG       SER  81 -11.957 -11.946   6.189
  666    H    LYS  82           H        LYS  82 -11.960 -13.760   2.276
  667    HA   LYS  82           HA       LYS  82 -13.119 -16.313   1.648
  668    HB2  LYS  82           2HB      LYS  82 -12.413 -14.029  -0.212
  669    HB3  LYS  82           1HB      LYS  82 -13.464 -15.387  -0.592
  670    HG2  LYS  82           2HG      LYS  82 -13.995 -13.309   1.522
  671    HG3  LYS  82           1HG      LYS  82 -14.716 -13.341  -0.088
  672    HD2  LYS  82           2HD      LYS  82 -15.799 -15.467   0.418
  673    HD3  LYS  82           1HD      LYS  82 -15.029 -15.506   2.008
  674    HE2  LYS  82           2HE      LYS  82 -16.963 -13.388   1.059
  675    HE3  LYS  82           1HE      LYS  82 -17.378 -14.747   2.099
  676    HZ1  LYS  82           3HZ      LYS  82 -15.414 -12.624   2.765
  677    HZ2  LYS  82           1HZ      LYS  82 -15.876 -13.904   3.771
  678    HZ3  LYS  82           2HZ      LYS  82 -16.996 -12.708   3.353
  679    H    GLY  83           H        GLY  83 -10.085 -14.677   0.839
  680    HA2  GLY  83           2HA      GLY  83  -8.066 -15.998   0.565
  681    HA3  GLY  83           1HA      GLY  83  -9.041 -17.258  -0.173
  682    H    LEU  84           H        LEU  84  -9.438 -13.870  -0.961
  683    HA   LEU  84           HA       LEU  84  -8.897 -14.328  -3.741
  684    HB2  LEU  84           2HB      LEU  84  -9.325 -11.729  -2.249
  685    HB3  LEU  84           1HB      LEU  84  -9.343 -11.919  -3.994
  686    HG   LEU  84           HG       LEU  84 -11.329 -13.152  -2.071
  687   HD11  LEU  84          1HD1      LEU  84 -12.934 -11.586  -3.038
  688   HD12  LEU  84          2HD1      LEU  84 -11.656 -10.865  -4.017
  689   HD13  LEU  84          3HD1      LEU  84 -11.600 -10.736  -2.258
  690   HD21  LEU  84          3HD2      LEU  84 -11.246 -13.197  -5.093
  691   HD22  LEU  84          1HD2      LEU  84 -12.570 -13.796  -4.092
  692   HD23  LEU  84          2HD2      LEU  84 -10.990 -14.573  -4.020
  693    H    GLU  85           H        GLU  85  -6.886 -14.563  -4.471
  694    HA   GLU  85           HA       GLU  85  -4.540 -13.843  -3.134
  695    HB2  GLU  85           2HB      GLU  85  -5.018 -14.460  -6.058
  696    HB3  GLU  85           1HB      GLU  85  -3.420 -14.322  -5.332
  697    HG2  GLU  85           2HG      GLU  85  -3.811 -16.217  -3.929
  698    HG3  GLU  85           1HG      GLU  85  -5.511 -16.280  -4.393
  699    H    TYR  86           H        TYR  86  -4.340 -11.713  -2.550
  700    HA   TYR  86           HA       TYR  86  -4.399  -9.625  -4.597
  701    HB2  TYR  86           2HB      TYR  86  -3.660  -9.343  -1.672
  702    HB3  TYR  86           1HB      TYR  86  -4.104  -8.056  -2.786
  703    HD1  TYR  86           HD1      TYR  86  -6.558  -8.696  -3.980
  704    HD2  TYR  86           HD2      TYR  86  -5.247  -9.741  -0.067
  705    HE1  TYR  86           HE1      TYR  86  -8.900  -8.863  -3.248
  706    HE2  TYR  86           HE2      TYR  86  -7.579  -9.916   0.673
  707    HH   TYR  86           HH       TYR  86 -10.136 -10.193  -1.308
  708    HA   PRO  87           HA       PRO  87   0.072 -10.407  -4.914
  709    HB2  PRO  87           2HB      PRO  87   0.433  -9.445  -7.398
  710    HB3  PRO  87           1HB      PRO  87  -0.334 -11.012  -7.102
  711    HG2  PRO  87           2HG      PRO  87  -1.589  -8.388  -7.799
  712    HG3  PRO  87           1HG      PRO  87  -2.024 -10.020  -8.336
  713    HD2  PRO  87           2HD      PRO  87  -3.304  -8.602  -6.309
  714    HD3  PRO  87           1HD      PRO  87  -3.381 -10.359  -6.531
  715    H    ALA  88           H        ALA  88   0.877  -8.964  -3.403
  716    HA   ALA  88           HA       ALA  88   0.899  -6.118  -3.928
  717    HB1  ALA  88           3HB      ALA  88   2.274  -7.659  -1.721
  718    HB2  ALA  88           1HB      ALA  88   0.639  -6.998  -1.636
  719    HB3  ALA  88           2HB      ALA  88   2.023  -5.914  -1.788
  720    H    VAL  89           H        VAL  89   2.149  -5.687  -5.707
  721    HA   VAL  89           HA       VAL  89   4.978  -6.528  -5.657
  722    HB   VAL  89           HB       VAL  89   3.350  -5.347  -7.926
  723   HG11  VAL  89          1HG1      VAL  89   6.197  -6.363  -7.925
  724   HG12  VAL  89          2HG1      VAL  89   5.699  -4.677  -8.068
  725   HG13  VAL  89          3HG1      VAL  89   5.292  -5.827  -9.341
  726   HG21  VAL  89          3HG2      VAL  89   2.715  -7.650  -7.394
  727   HG22  VAL  89          1HG2      VAL  89   4.401  -8.155  -7.519
  728   HG23  VAL  89          2HG2      VAL  89   3.547  -7.568  -8.948
  729    H    VAL  90           H        VAL  90   6.624  -5.009  -5.548
  730    HA   VAL  90           HA       VAL  90   5.732  -2.311  -4.758
  731    HB   VAL  90           HB       VAL  90   8.402  -3.638  -4.220
  732   HG11  VAL  90          1HG1      VAL  90   7.168  -1.119  -3.097
  733   HG12  VAL  90          2HG1      VAL  90   8.544  -1.214  -4.196
  734   HG13  VAL  90          3HG1      VAL  90   8.683  -1.845  -2.556
  735   HG21  VAL  90          3HG2      VAL  90   6.617  -4.850  -3.094
  736   HG22  VAL  90          1HG2      VAL  90   5.990  -3.345  -2.420
  737   HG23  VAL  90          2HG2      VAL  90   7.573  -3.945  -1.921
  738    H    GLU  91           H        GLU  91   6.541  -0.456  -5.694
  739    HA   GLU  91           HA       GLU  91   8.654  -0.649  -7.723
  740    HB2  GLU  91           2HB      GLU  91   7.405   0.504  -9.415
  741    HB3  GLU  91           1HB      GLU  91   6.425  -0.857  -8.887
  742    HG2  GLU  91           2HG      GLU  91   5.059   0.608  -7.527
  743    HG3  GLU  91           1HG      GLU  91   6.080   1.984  -7.935
  744    H    PHE  92           H        PHE  92   9.224   1.665  -8.513
  745    HA   PHE  92           HA       PHE  92   9.240   3.467  -6.189
  746    HB2  PHE  92           2HB      PHE  92  11.114   4.592  -7.224
  747    HB3  PHE  92           1HB      PHE  92  11.428   2.862  -7.228
  748    HD1  PHE  92           HD1      PHE  92  10.887   1.585  -9.397
  749    HD2  PHE  92           HD2      PHE  92  11.289   5.820  -9.205
  750    HE1  PHE  92           HE1      PHE  92  11.299   1.653 -11.822
  751    HE2  PHE  92           HE2      PHE  92  11.698   5.894 -11.630
  752    HZ   PHE  92           HZ       PHE  92  11.701   3.805 -12.941
  753    H    ALA  93           H        ALA  93   8.437   5.553  -6.284
  754    HA   ALA  93           HA       ALA  93   6.600   6.128  -8.476
  755    HB1  ALA  93           3HB      ALA  93   5.811   6.428  -6.189
  756    HB2  ALA  93           1HB      ALA  93   5.802   7.962  -7.057
  757    HB3  ALA  93           2HB      ALA  93   7.078   7.616  -5.891
  758    HA   PRO  94           HA       PRO  94   9.239   8.835 -10.797
  759    HB2  PRO  94           2HB      PRO  94   6.812  10.569 -11.009
  760    HB3  PRO  94           1HB      PRO  94   7.873   9.953 -12.283
  761    HG2  PRO  94           2HG      PRO  94   5.482   8.862 -11.890
  762    HG3  PRO  94           1HG      PRO  94   6.885   7.839 -12.259
  763    HD2  PRO  94           2HD      PRO  94   5.521   8.316  -9.634
  764    HD3  PRO  94           1HD      PRO  94   6.216   6.818 -10.289
  765    H    PHE  95           H        PHE  95  10.666   9.693  -9.334
  766    HA   PHE  95           HA       PHE  95   9.967  11.606  -7.322
  767    HB2  PHE  95           2HB      PHE  95  11.799  10.043  -6.978
  768    HB3  PHE  95           1HB      PHE  95  12.651  10.675  -8.380
  769    HD1  PHE  95           HD1      PHE  95  11.555  11.469  -4.935
  770    HD2  PHE  95           HD2      PHE  95  14.055  12.575  -8.201
  771    HE1  PHE  95           HE1      PHE  95  12.746  13.060  -3.482
  772    HE2  PHE  95           HE2      PHE  95  15.247  14.166  -6.756
  773    HZ   PHE  95           HZ       PHE  95  14.592  14.410  -4.393
  774    H    GLN  96           H        GLN  96  10.911  11.847 -10.628
  775    HA   GLN  96           HA       GLN  96  11.113  14.784 -10.393
  776    HB2  GLN  96           2HB      GLN  96  13.371  13.905 -10.554
  777    HB3  GLN  96           1HB      GLN  96  12.936  12.937 -11.951
  778    HG2  GLN  96           2HG      GLN  96  14.235  14.876 -12.608
  779    HG3  GLN  96           1HG      GLN  96  12.605  14.970 -13.271
  780   HE21  GLN  96          1HE2      GLN  96  11.302  16.657 -12.680
  781   HE22  GLN  96          2HE2      GLN  96  11.808  17.945 -11.648
  782    H    LYS  97           H        LYS  97   9.841  15.869 -11.824
  783    HA   LYS  97           HA       LYS  97   8.531  14.571 -14.026
  784    HB2  LYS  97           2HB      LYS  97   8.548  17.261 -12.842
  785    HB3  LYS  97           1HB      LYS  97   8.428  17.293 -14.592
  786    HG2  LYS  97           2HG      LYS  97   6.221  17.303 -13.863
  787    HG3  LYS  97           1HG      LYS  97   6.511  15.630 -14.335
  788    HD2  LYS  97           2HD      LYS  97   6.913  15.070 -11.950
  789    HD3  LYS  97           1HD      LYS  97   6.518  16.736 -11.519
  790    HE2  LYS  97           2HE      LYS  97   4.289  16.380 -12.655
  791    HE3  LYS  97           1HE      LYS  97   4.702  14.669 -12.763
  792    HZ1  LYS  97           3HZ      LYS  97   3.361  15.024 -10.842
  793    HZ2  LYS  97           1HZ      LYS  97   4.360  16.274 -10.291
  794    HZ3  LYS  97           2HZ      LYS  97   4.930  14.684 -10.312
  Start of MODEL   17
    1    H1   MET   1           1H       MET   1  -5.039  12.800   4.918
    2    H2   MET   1           2H       MET   1  -3.616  13.126   4.066
    3    H3   MET   1           3H       MET   1  -4.796  14.326   4.232
    4    HA   MET   1           HA       MET   1  -4.442  14.426   6.594
    5    HB2  MET   1           2HB      MET   1  -2.334  12.322   6.043
    6    HB3  MET   1           1HB      MET   1  -2.507  13.178   7.569
    7    HG2  MET   1           2HG      MET   1  -4.553  11.357   6.315
    8    HG3  MET   1           1HG      MET   1  -3.513  10.972   7.686
    9    HE1  MET   1           3HE      MET   1  -5.570  10.270   9.199
   10    HE2  MET   1           1HE      MET   1  -6.640  10.561   7.825
   11    HE3  MET   1           2HE      MET   1  -7.014  11.261   9.401
   12    H    GLY   2           H        GLY   2  -3.393  16.274   7.064
   13    HA2  GLY   2           2HA      GLY   2  -1.622  17.458   5.151
   14    HA3  GLY   2           1HA      GLY   2  -2.088  18.139   6.700
   15    H    HIS   3           H        HIS   3   0.087  15.770   5.191
   16    HA   HIS   3           HA       HIS   3   1.967  16.106   7.437
   17    HB2  HIS   3           2HB      HIS   3   1.873  14.046   5.222
   18    HB3  HIS   3           1HB      HIS   3   3.180  14.165   6.397
   19    HD1  HIS   3           HD1      HIS   3   1.658  11.577   6.298
   20    HD2  HIS   3           HD2      HIS   3   0.539  14.750   8.737
   21    HE1  HIS   3           HE1      HIS   3   0.306  10.557   8.144
   22    HE2  HIS   3           HE2      HIS   3  -0.175  12.461   9.715
   23    H    HIS   4           H        HIS   4   4.103  16.749   7.102
   24    HA   HIS   4           HA       HIS   4   4.455  18.532   4.836
   25    HB2  HIS   4           2HB      HIS   4   6.343  18.003   7.146
   26    HB3  HIS   4           1HB      HIS   4   6.401  19.360   6.025
   27    HD1  HIS   4           HD1      HIS   4   4.875  18.234   9.167
   28    HD2  HIS   4           HD2      HIS   4   4.229  21.247   6.381
   29    HE1  HIS   4           HE1      HIS   4   3.329  19.861  10.284
   30    HE2  HIS   4           HE2      HIS   4   3.071  21.743   8.644
   31    H    HIS   5           H        HIS   5   6.320  18.501   3.445
   32    HA   HIS   5           HA       HIS   5   6.838  15.840   2.505
   33    HB2  HIS   5           2HB      HIS   5   7.766  18.542   1.521
   34    HB3  HIS   5           1HB      HIS   5   8.153  17.026   0.713
   35    HD1  HIS   5           HD1      HIS   5   6.427  16.090  -0.853
   36    HD2  HIS   5           HD2      HIS   5   4.924  19.160   1.509
   37    HE1  HIS   5           HE1      HIS   5   4.134  16.564  -1.747
   38    HE2  HIS   5           HE2      HIS   5   3.188  18.311  -0.211
   39    H    HIS   6           H        HIS   6   9.178  18.460   3.253
   40    HA   HIS   6           HA       HIS   6  11.361  18.405   3.880
   41    HB2  HIS   6           2HB      HIS   6  10.620  17.603   5.999
   42    HB3  HIS   6           1HB      HIS   6  10.308  15.991   5.370
   43    HD1  HIS   6           HD1      HIS   6  13.110  18.221   6.512
   44    HD2  HIS   6           HD2      HIS   6  12.507  14.278   5.344
   45    HE1  HIS   6           HE1      HIS   6  15.231  17.012   7.092
   46    HE2  HIS   6           HE2      HIS   6  14.764  14.599   6.567
   47    H    HIS   7           H        HIS   7  12.780  18.094   2.238
   48    HA   HIS   7           HA       HIS   7  12.863  16.126   0.352
   49    HB2  HIS   7           2HB      HIS   7  15.215  17.581   1.577
   50    HB3  HIS   7           1HB      HIS   7  15.335  16.585   0.132
   51    HD1  HIS   7           HD1      HIS   7  14.852  19.986   1.126
   52    HD2  HIS   7           HD2      HIS   7  13.443  17.605  -1.976
   53    HE1  HIS   7           HE1      HIS   7  14.039  21.583  -0.630
   54    HE2  HIS   7           HE2      HIS   7  13.159  20.125  -2.478
   55    H    HIS   8           H        HIS   8  12.695  14.014   0.711
   56    HA   HIS   8           HA       HIS   8  14.543  12.722   2.612
   57    HB2  HIS   8           2HB      HIS   8  12.694  11.132   3.180
   58    HB3  HIS   8           1HB      HIS   8  12.389  12.786   3.692
   59    HD1  HIS   8           HD1      HIS   8  10.302  13.907   2.819
   60    HD2  HIS   8           HD2      HIS   8  11.080  10.282   0.937
   61    HE1  HIS   8           HE1      HIS   8   8.243  13.385   1.486
   62    HE2  HIS   8           HE2      HIS   8   8.661  11.102   0.528
   63    H    SER   9           H        SER   9  13.821  10.090   2.171
   64    HA   SER   9           HA       SER   9  15.314   9.421  -0.104
   65    HB2  SER   9           2HB      SER   9  14.462   7.091   0.312
   66    HB3  SER   9           1HB      SER   9  15.169   7.873   1.725
   67    HG   SER   9           HG       SER   9  12.388   7.668   1.138
   68    H    HIS  10           H        HIS  10  14.601   8.001  -1.891
   69    HA   HIS  10           HA       HIS  10  12.668   9.247  -3.508
   70    HB2  HIS  10           2HB      HIS  10  14.660   7.912  -4.265
   71    HB3  HIS  10           1HB      HIS  10  13.797   6.452  -3.804
   72    HD1  HIS  10           HD1      HIS  10  14.297   8.743  -6.580
   73    HD2  HIS  10           HD2      HIS  10  11.379   6.028  -5.407
   74    HE1  HIS  10           HE1      HIS  10  12.932   8.295  -8.631
   75    HE2  HIS  10           HE2      HIS  10  11.282   6.542  -7.936
   76    H    MET  11           H        MET  11  10.506   9.222  -3.103
   77    HA   MET  11           HA       MET  11   9.190   7.324  -1.500
   78    HB2  MET  11           2HB      MET  11   7.094   8.372  -2.261
   79    HB3  MET  11           1HB      MET  11   8.295   9.558  -1.775
   80    HG2  MET  11           2HG      MET  11   8.841   9.937  -4.152
   81    HG3  MET  11           1HG      MET  11   7.566   8.805  -4.600
   82    HE1  MET  11           3HE      MET  11   4.371  10.662  -3.242
   83    HE2  MET  11           1HE      MET  11   5.365   9.524  -2.332
   84    HE3  MET  11           2HE      MET  11   4.983   9.205  -4.024
   85    H    VAL  12           H        VAL  12   7.388   5.884  -2.121
   86    HA   VAL  12           HA       VAL  12   8.027   4.426  -4.609
   87    HB   VAL  12           HB       VAL  12   7.748   3.250  -1.826
   88   HG11  VAL  12          1HG1      VAL  12   8.266   1.843  -4.446
   89   HG12  VAL  12          2HG1      VAL  12   6.799   1.729  -3.475
   90   HG13  VAL  12          3HG1      VAL  12   8.321   1.094  -2.852
   91   HG21  VAL  12          3HG2      VAL  12  10.156   3.398  -3.650
   92   HG22  VAL  12          1HG2      VAL  12  10.100   2.618  -2.069
   93   HG23  VAL  12          2HG2      VAL  12   9.901   4.367  -2.197
   94    H    VAL  13           H        VAL  13   6.359   2.876  -5.291
   95    HA   VAL  13           HA       VAL  13   3.672   3.343  -4.157
   96    HB   VAL  13           HB       VAL  13   2.671   3.252  -6.358
   97   HG11  VAL  13          1HG1      VAL  13   3.395   5.446  -5.578
   98   HG12  VAL  13          2HG1      VAL  13   3.523   5.335  -7.332
   99   HG13  VAL  13          3HG1      VAL  13   4.972   5.213  -6.332
  100   HG21  VAL  13          3HG2      VAL  13   3.995   3.147  -8.417
  101   HG22  VAL  13          1HG2      VAL  13   4.222   1.697  -7.437
  102   HG23  VAL  13          2HG2      VAL  13   5.469   2.946  -7.468
  103    H    ILE  14           H        ILE  14   2.108   1.518  -4.973
  104    HA   ILE  14           HA       ILE  14   3.552  -1.041  -5.209
  105    HB   ILE  14           HB       ILE  14   2.816  -0.787  -2.867
  106   HG12  ILE  14          2HG1      ILE  14   1.247  -2.897  -4.380
  107   HG13  ILE  14          1HG1      ILE  14   2.946  -3.021  -3.939
  108   HG21  ILE  14          1HG2      ILE  14   0.010  -0.703  -3.991
  109   HG22  ILE  14          2HG2      ILE  14   0.863   0.644  -3.236
  110   HG23  ILE  14          3HG2      ILE  14   0.446  -0.781  -2.284
  111   HD11  ILE  14          3HD1      ILE  14   2.338  -2.961  -1.579
  112   HD12  ILE  14          1HD1      ILE  14   1.543  -4.286  -2.425
  113   HD13  ILE  14          2HD1      ILE  14   0.635  -2.830  -2.021
  114    H    ARG  15           H        ARG  15   2.722  -2.489  -6.658
  115    HA   ARG  15           HA       ARG  15   0.412  -1.540  -8.238
  116    HB2  ARG  15           2HB      ARG  15   2.651  -1.399  -9.336
  117    HB3  ARG  15           1HB      ARG  15   2.789  -3.146  -9.204
  118    HG2  ARG  15           2HG      ARG  15   0.845  -3.421 -10.654
  119    HG3  ARG  15           1HG      ARG  15   0.667  -1.669 -10.759
  120    HD2  ARG  15           2HD      ARG  15   3.016  -3.295 -11.739
  121    HD3  ARG  15           1HD      ARG  15   1.776  -2.548 -12.743
  122    HE   ARG  15           HE       ARG  15   3.861  -1.136 -11.232
  123   HH11  ARG  15          1HH1      ARG  15   1.350  -1.094 -13.599
  124   HH12  ARG  15          2HH1      ARG  15   1.829   0.443 -14.227
  125   HH21  ARG  15          1HH2      ARG  15   4.467   0.822 -12.057
  126   HH22  ARG  15          2HH2      ARG  15   3.567   1.523 -13.360
  127    H    ARG  16           H        ARG  16  -0.664  -3.278  -9.551
  128    HA   ARG  16           HA       ARG  16  -1.731  -5.234  -9.877
  129    HB2  ARG  16           2HB      ARG  16   0.264  -6.366  -7.912
  130    HB3  ARG  16           1HB      ARG  16  -0.938  -7.331  -8.757
  131    HG2  ARG  16           2HG      ARG  16   0.065  -6.530 -10.914
  132    HG3  ARG  16           1HG      ARG  16   1.358  -5.797  -9.962
  133    HD2  ARG  16           2HD      ARG  16   1.862  -8.027  -9.002
  134    HD3  ARG  16           1HD      ARG  16   0.635  -8.729 -10.057
  135    HE   ARG  16           HE       ARG  16   2.669  -7.231 -11.442
  136   HH11  ARG  16          1HH1      ARG  16   1.703 -10.312 -10.261
  137   HH12  ARG  16          2HH1      ARG  16   2.832 -11.173 -11.245
  138   HH21  ARG  16          1HH2      ARG  16   4.126  -8.345 -12.721
  139   HH22  ARG  16          2HH2      ARG  16   4.190 -10.074 -12.622
  140    H    LEU  17           H        LEU  17  -2.133  -3.357  -7.370
  141    HA   LEU  17           HA       LEU  17  -3.786  -4.963  -5.662
  142    HB2  LEU  17           2HB      LEU  17  -3.353  -2.011  -5.987
  143    HB3  LEU  17           1HB      LEU  17  -4.682  -2.594  -5.007
  144    HG   LEU  17           HG       LEU  17  -2.736  -2.026  -3.639
  145   HD11  LEU  17          1HD1      LEU  17  -2.605  -4.079  -2.342
  146   HD12  LEU  17          2HD1      LEU  17  -3.260  -5.000  -3.697
  147   HD13  LEU  17          3HD1      LEU  17  -4.256  -3.789  -2.889
  148   HD21  LEU  17          3HD2      LEU  17  -0.968  -2.477  -5.250
  149   HD22  LEU  17          1HD2      LEU  17  -1.310  -4.206  -5.169
  150   HD23  LEU  17          2HD2      LEU  17  -0.686  -3.360  -3.752
  151    HA   PRO  18           HA       PRO  18  -7.367  -4.583  -8.428
  152    HB2  PRO  18           2HB      PRO  18  -8.347  -7.027  -7.999
  153    HB3  PRO  18           1HB      PRO  18  -6.858  -6.813  -8.924
  154    HG2  PRO  18           2HG      PRO  18  -7.234  -7.813  -6.154
  155    HG3  PRO  18           1HG      PRO  18  -5.960  -8.193  -7.326
  156    HD2  PRO  18           2HD      PRO  18  -5.872  -6.285  -5.173
  157    HD3  PRO  18           1HD      PRO  18  -4.605  -6.646  -6.362
  158    HA   PRO  19           HA       PRO  19 -10.871  -3.747  -5.641
  159    HB2  PRO  19           2HB      PRO  19 -12.364  -5.966  -6.986
  160    HB3  PRO  19           1HB      PRO  19 -12.862  -4.298  -6.677
  161    HG2  PRO  19           2HG      PRO  19 -12.132  -5.069  -9.123
  162    HG3  PRO  19           1HG      PRO  19 -11.687  -3.467  -8.502
  163    HD2  PRO  19           2HD      PRO  19  -9.998  -5.916  -8.818
  164    HD3  PRO  19           1HD      PRO  19  -9.559  -4.207  -9.023
  165    H    GLY  20           H        GLY  20 -10.066  -4.465  -3.678
  166    HA2  GLY  20           2HA      GLY  20 -10.839  -7.184  -2.857
  167    HA3  GLY  20           1HA      GLY  20  -9.165  -6.690  -2.661
  168    H    LEU  21           H        LEU  21  -9.401  -7.077  -0.387
  169    HA   LEU  21           HA       LEU  21 -11.334  -6.090   1.302
  170    HB2  LEU  21           2HB      LEU  21  -9.818  -6.383   3.131
  171    HB3  LEU  21           1HB      LEU  21  -9.566  -7.679   1.980
  172    HG   LEU  21           HG       LEU  21  -7.771  -5.255   2.274
  173   HD11  LEU  21          1HD1      LEU  21  -7.671  -6.666   4.250
  174   HD12  LEU  21          2HD1      LEU  21  -6.181  -6.796   3.316
  175   HD13  LEU  21          3HD1      LEU  21  -7.381  -8.087   3.245
  176   HD21  LEU  21          3HD2      LEU  21  -6.203  -6.509   0.873
  177   HD22  LEU  21          1HD2      LEU  21  -7.710  -6.188   0.018
  178   HD23  LEU  21          2HD2      LEU  21  -7.396  -7.794   0.677
  179    H    THR  22           H        THR  22 -11.602  -4.257   2.593
  180    HA   THR  22           HA       THR  22 -10.994  -1.813   1.256
  181    HB   THR  22           HB       THR  22 -12.143  -2.155   4.045
  182    HG1  THR  22           HG1      THR  22 -13.321  -2.330   1.469
  183   HG21  THR  22          3HG2      THR  22 -13.233   0.012   3.569
  184   HG22  THR  22          1HG2      THR  22 -12.361   0.100   2.038
  185   HG23  THR  22          2HG2      THR  22 -11.473   0.140   3.563
  186    H    LYS  23           H        LYS  23  -9.819   0.021   2.101
  187    HA   LYS  23           HA       LYS  23  -7.254  -0.351   2.906
  188    HB2  LYS  23           2HB      LYS  23  -7.163   1.981   3.536
  189    HB3  LYS  23           1HB      LYS  23  -8.206   1.809   2.133
  190    HG2  LYS  23           2HG      LYS  23 -10.176   1.905   3.645
  191    HG3  LYS  23           1HG      LYS  23  -9.079   2.216   4.991
  192    HD2  LYS  23           2HD      LYS  23  -9.437   3.952   2.538
  193    HD3  LYS  23           1HD      LYS  23 -10.043   4.303   4.157
  194    HE2  LYS  23           2HE      LYS  23  -7.125   4.041   3.396
  195    HE3  LYS  23           1HE      LYS  23  -7.988   5.558   3.638
  196    HZ1  LYS  23           3HZ      LYS  23  -6.710   4.928   5.585
  197    HZ2  LYS  23           1HZ      LYS  23  -7.560   3.473   5.708
  198    HZ3  LYS  23           2HZ      LYS  23  -8.361   4.944   5.937
  199    H    GLU  24           H        GLU  24 -10.053  -0.194   5.018
  200    HA   GLU  24           HA       GLU  24  -9.043   0.153   7.521
  201    HB2  GLU  24           2HB      GLU  24 -11.129  -1.886   6.714
  202    HB3  GLU  24           1HB      GLU  24 -10.895  -1.251   8.338
  203    HG2  GLU  24           2HG      GLU  24 -11.534   0.960   7.625
  204    HG3  GLU  24           1HG      GLU  24 -11.622   0.430   5.945
  205    H    GLN  25           H        GLN  25  -8.829  -2.844   5.616
  206    HA   GLN  25           HA       GLN  25  -6.918  -3.889   7.630
  207    HB2  GLN  25           2HB      GLN  25  -8.614  -5.595   5.798
  208    HB3  GLN  25           1HB      GLN  25  -7.599  -6.135   7.127
  209    HG2  GLN  25           2HG      GLN  25  -9.115  -4.911   8.687
  210    HG3  GLN  25           1HG      GLN  25 -10.172  -4.586   7.309
  211   HE21  GLN  25          1HE2      GLN  25 -11.224  -6.324   6.310
  212   HE22  GLN  25          2HE2      GLN  25 -11.446  -7.833   7.116
  213    H    LEU  26           H        LEU  26  -7.199  -2.660   4.597
  214    HA   LEU  26           HA       LEU  26  -5.245  -4.373   3.289
  215    HB2  LEU  26           2HB      LEU  26  -6.934  -3.690   1.838
  216    HB3  LEU  26           1HB      LEU  26  -6.948  -2.054   2.455
  217    HG   LEU  26           HG       LEU  26  -4.735  -1.675   1.343
  218   HD11  LEU  26          1HD1      LEU  26  -5.268  -4.374   0.094
  219   HD12  LEU  26          2HD1      LEU  26  -3.969  -3.986   1.222
  220   HD13  LEU  26          3HD1      LEU  26  -3.995  -3.243  -0.376
  221   HD21  LEU  26          3HD2      LEU  26  -6.981  -2.537  -0.479
  222   HD22  LEU  26          1HD2      LEU  26  -5.654  -1.455  -0.900
  223   HD23  LEU  26          2HD2      LEU  26  -6.838  -0.968   0.313
  224    H    GLU  27           H        GLU  27  -5.361  -1.171   4.779
  225    HA   GLU  27           HA       GLU  27  -2.849  -0.320   3.711
  226    HB2  GLU  27           2HB      GLU  27  -3.073   1.604   5.162
  227    HB3  GLU  27           1HB      GLU  27  -4.604   1.265   4.371
  228    HG2  GLU  27           2HG      GLU  27  -5.299   0.083   6.499
  229    HG3  GLU  27           1HG      GLU  27  -3.853   0.766   7.241
  230    H    GLU  28           H        GLU  28  -3.799  -2.020   6.627
  231    HA   GLU  28           HA       GLU  28  -1.632  -1.381   8.267
  232    HB2  GLU  28           2HB      GLU  28  -2.208  -3.454   9.531
  233    HB3  GLU  28           1HB      GLU  28  -3.573  -2.395   9.221
  234    HG2  GLU  28           2HG      GLU  28  -4.334  -3.845   7.438
  235    HG3  GLU  28           1HG      GLU  28  -2.921  -4.880   7.646
  236    H    GLN  29           H        GLN  29  -1.778  -3.744   5.664
  237    HA   GLN  29           HA       GLN  29   0.879  -4.751   6.398
  238    HB2  GLN  29           2HB      GLN  29   0.597  -6.413   4.609
  239    HB3  GLN  29           1HB      GLN  29  -0.714  -6.477   5.771
  240    HG2  GLN  29           2HG      GLN  29  -1.044  -4.910   3.242
  241    HG3  GLN  29           1HG      GLN  29  -1.207  -6.665   3.222
  242   HE21  GLN  29          1HE2      GLN  29  -3.398  -6.596   2.724
  243   HE22  GLN  29          2HE2      GLN  29  -4.588  -6.096   3.871
  244    H    LEU  30           H        LEU  30  -0.430  -2.310   4.492
  245    HA   LEU  30           HA       LEU  30   1.801  -2.315   2.578
  246    HB2  LEU  30           2HB      LEU  30  -0.582  -0.467   2.755
  247    HB3  LEU  30           1HB      LEU  30   0.605  -0.499   1.464
  248    HG   LEU  30           HG       LEU  30  -1.454  -2.606   2.115
  249   HD11  LEU  30          1HD1      LEU  30  -2.287  -0.710   0.842
  250   HD12  LEU  30          2HD1      LEU  30  -2.226  -2.156  -0.165
  251   HD13  LEU  30          3HD1      LEU  30  -0.990  -0.911  -0.338
  252   HD21  LEU  30          3HD2      LEU  30  -0.541  -3.910   0.257
  253   HD22  LEU  30          1HD2      LEU  30   0.633  -3.730   1.560
  254   HD23  LEU  30          2HD2      LEU  30   0.785  -2.758   0.097
  255    H    ARG  31           H        ARG  31   1.103  -1.046   5.617
  256    HA   ARG  31           HA       ARG  31   3.352   0.841   5.348
  257    HB2  ARG  31           2HB      ARG  31   2.173   2.329   7.043
  258    HB3  ARG  31           1HB      ARG  31   1.505   2.310   5.419
  259    HG2  ARG  31           2HG      ARG  31  -0.490   1.809   6.248
  260    HG3  ARG  31           1HG      ARG  31   0.148   0.296   6.881
  261    HD2  ARG  31           2HD      ARG  31   0.276   2.940   8.343
  262    HD3  ARG  31           1HD      ARG  31  -0.991   1.737   8.576
  263    HE   ARG  31           HE       ARG  31   1.849   1.371   9.255
  264   HH11  ARG  31          1HH1      ARG  31  -1.474   0.573   9.709
  265   HH12  ARG  31          2HH1      ARG  31  -1.138  -0.564  10.970
  266   HH21  ARG  31          1HH2      ARG  31   2.266  -0.085  10.860
  267   HH22  ARG  31          2HH2      ARG  31   0.967  -0.932  11.620
  268    HA   PRO  32           HA       PRO  32   3.564  -1.935   9.238
  269    HB2  PRO  32           2HB      PRO  32   5.044  -4.028   8.492
  270    HB3  PRO  32           1HB      PRO  32   3.318  -3.962   8.108
  271    HG2  PRO  32           2HG      PRO  32   5.669  -3.323   6.354
  272    HG3  PRO  32           1HG      PRO  32   4.231  -4.291   5.977
  273    HD2  PRO  32           2HD      PRO  32   4.527  -1.654   5.265
  274    HD3  PRO  32           1HD      PRO  32   2.954  -2.434   5.524
  275    H    LEU  33           H        LEU  33   5.207   0.290   8.108
  276    HA   LEU  33           HA       LEU  33   7.972  -0.397   8.532
  277    HB2  LEU  33           2HB      LEU  33   6.569   2.228   8.008
  278    HB3  LEU  33           1HB      LEU  33   8.298   2.109   8.269
  279    HG   LEU  33           HG       LEU  33   8.444   0.603   6.276
  280   HD11  LEU  33          1HD1      LEU  33   6.579   0.582   4.682
  281   HD12  LEU  33          2HD1      LEU  33   5.563   1.404   5.870
  282   HD13  LEU  33          3HD1      LEU  33   6.168  -0.221   6.196
  283   HD21  LEU  33          3HD2      LEU  33   7.299   3.357   5.805
  284   HD22  LEU  33          1HD2      LEU  33   8.204   2.405   4.628
  285   HD23  LEU  33          2HD2      LEU  33   8.992   2.962   6.101
  286    HA   PRO  34           HA       PRO  34   8.467   0.120  12.889
  287    HB2  PRO  34           2HB      PRO  34  10.737   1.812  12.818
  288    HB3  PRO  34           1HB      PRO  34  10.736   0.049  12.889
  289    HG2  PRO  34           2HG      PRO  34  11.028   1.851  10.526
  290    HG3  PRO  34           1HG      PRO  34  11.802   0.286  10.845
  291    HD2  PRO  34           2HD      PRO  34   9.804   0.480   9.101
  292    HD3  PRO  34           1HD      PRO  34   9.913  -0.918  10.195
  293    H    ALA  35           H        ALA  35   9.143   3.191  11.170
  294    HA   ALA  35           HA       ALA  35   6.930   4.534  12.366
  295    HB1  ALA  35           3HB      ALA  35   9.659   5.366  13.360
  296    HB2  ALA  35           1HB      ALA  35   8.415   4.559  14.313
  297    HB3  ALA  35           2HB      ALA  35   8.135   6.187  13.698
  298    H    HIS  36           H        HIS  36   6.521   5.012  10.151
  299    HA   HIS  36           HA       HIS  36   7.938   7.371   9.186
  300    HB2  HIS  36           2HB      HIS  36   7.639   4.931   7.409
  301    HB3  HIS  36           1HB      HIS  36   8.333   6.482   6.944
  302    HD1  HIS  36           HD1      HIS  36  10.624   7.122   8.356
  303    HD2  HIS  36           HD2      HIS  36   9.436   3.141   8.361
  304    HE1  HIS  36           HE1      HIS  36  12.639   5.818   9.072
  305    HE2  HIS  36           HE2      HIS  36  11.951   3.411   8.855
  306    H    ASP  37           H        ASP  37   6.743   7.420   6.604
  307    HA   ASP  37           HA       ASP  37   4.173   8.454   7.446
  308    HB2  ASP  37           2HB      ASP  37   5.800   9.726   6.009
  309    HB3  ASP  37           1HB      ASP  37   5.450   8.598   4.709
  310    H    TYR  38           H        TYR  38   2.236   8.170   6.136
  311    HA   TYR  38           HA       TYR  38   2.068   5.740   4.507
  312    HB2  TYR  38           2HB      TYR  38  -0.059   5.091   5.642
  313    HB3  TYR  38           1HB      TYR  38   1.341   4.988   6.701
  314    HD1  TYR  38           HD2      TYR  38   1.720   6.817   8.411
  315    HD2  TYR  38           HD1      TYR  38  -1.903   6.490   6.187
  316    HE1  TYR  38           HE2      TYR  38   0.588   8.264  10.048
  317    HE2  TYR  38           HE1      TYR  38  -3.039   7.936   7.817
  318    HH   TYR  38           HH       TYR  38  -2.793   8.624  10.161
  319    H    PHE  39           H        PHE  39   0.823   6.040   2.703
  320    HA   PHE  39           HA       PHE  39  -0.222   8.728   2.286
  321    HB2  PHE  39           2HB      PHE  39   1.237   7.189   0.669
  322    HB3  PHE  39           1HB      PHE  39  -0.348   6.618   0.165
  323    HD1  PHE  39           HD2      PHE  39   1.784   9.624   0.477
  324    HD2  PHE  39           HD1      PHE  39  -1.697   7.920  -1.299
  325    HE1  PHE  39           HE2      PHE  39   1.588  11.576  -1.009
  326    HE2  PHE  39           HE1      PHE  39  -1.891   9.871  -2.790
  327    HZ   PHE  39           HZ       PHE  39  -0.248  11.700  -2.645
  328    H    GLU  40           H        GLU  40  -2.340   8.776   0.833
  329    HA   GLU  40           HA       GLU  40  -4.442   7.609   2.372
  330    HB2  GLU  40           2HB      GLU  40  -5.951   8.630   0.653
  331    HB3  GLU  40           1HB      GLU  40  -4.839   9.762   1.406
  332    HG2  GLU  40           2HG      GLU  40  -3.392   9.664  -0.568
  333    HG3  GLU  40           1HG      GLU  40  -4.498   8.519  -1.325
  334    H    PHE  41           H        PHE  41  -4.627   5.438   2.302
  335    HA   PHE  41           HA       PHE  41  -4.357   3.915  -0.122
  336    HB2  PHE  41           2HB      PHE  41  -5.440   3.083   2.587
  337    HB3  PHE  41           1HB      PHE  41  -5.020   1.989   1.271
  338    HD1  PHE  41           HD2      PHE  41  -3.699   4.243   3.849
  339    HD2  PHE  41           HD1      PHE  41  -2.716   1.470   0.769
  340    HE1  PHE  41           HE2      PHE  41  -1.386   4.149   4.679
  341    HE2  PHE  41           HE1      PHE  41  -0.398   1.380   1.593
  342    HZ   PHE  41           HZ       PHE  41   0.269   2.719   3.551
  343    H    PHE  42           H        PHE  42  -5.939   3.097  -1.440
  344    HA   PHE  42           HA       PHE  42  -8.366   4.517  -1.600
  345    HB2  PHE  42           2HB      PHE  42  -8.899   3.099  -3.495
  346    HB3  PHE  42           1HB      PHE  42  -7.209   3.575  -3.560
  347    HD1  PHE  42           HD2      PHE  42  -5.438   1.893  -2.907
  348    HD2  PHE  42           HD1      PHE  42  -9.528   0.816  -3.448
  349    HE1  PHE  42           HE2      PHE  42  -4.784  -0.462  -3.155
  350    HE2  PHE  42           HE1      PHE  42  -8.873  -1.539  -3.699
  351    HZ   PHE  42           HZ       PHE  42  -6.501  -2.185  -3.557
  352    H    ALA  43           H        ALA  43 -10.525   3.812  -1.433
  353    HA   ALA  43           HA       ALA  43 -10.950   1.591   0.473
  354    HB1  ALA  43           3HB      ALA  43 -12.666   4.025  -0.051
  355    HB2  ALA  43           1HB      ALA  43 -11.624   3.764   1.349
  356    HB3  ALA  43           2HB      ALA  43 -13.035   2.736   1.096
  357    H    ALA  44           H        ALA  44 -11.769  -0.194  -0.431
  358    HA   ALA  44           HA       ALA  44 -13.814   0.005  -2.514
  359    HB1  ALA  44           3HB      ALA  44 -11.663  -0.119  -3.710
  360    HB2  ALA  44           1HB      ALA  44 -12.660  -1.544  -3.994
  361    HB3  ALA  44           2HB      ALA  44 -11.295  -1.631  -2.879
  362    H    ASP  45           H        ASP  45 -15.052  -1.925  -2.792
  363    HA   ASP  45           HA       ASP  45 -15.302  -3.596  -0.476
  364    HB2  ASP  45           2HB      ASP  45 -17.224  -2.879  -1.946
  365    HB3  ASP  45           1HB      ASP  45 -16.612  -3.970  -3.187
  366    H    LEU  46           H        LEU  46 -15.071  -5.898  -0.447
  367    HA   LEU  46           HA       LEU  46 -12.671  -6.721  -1.839
  368    HB2  LEU  46           2HB      LEU  46 -12.601  -8.612  -0.316
  369    HB3  LEU  46           1HB      LEU  46 -12.763  -7.096   0.545
  370    HG   LEU  46           HG       LEU  46 -15.056  -9.020   0.060
  371   HD11  LEU  46          1HD1      LEU  46 -13.350  -8.631   2.523
  372   HD12  LEU  46          2HD1      LEU  46 -13.346 -10.048   1.471
  373   HD13  LEU  46          3HD1      LEU  46 -14.785  -9.650   2.408
  374   HD21  LEU  46          3HD2      LEU  46 -16.181  -7.728   1.824
  375   HD22  LEU  46          1HD2      LEU  46 -15.789  -6.714   0.438
  376   HD23  LEU  46          2HD2      LEU  46 -14.806  -6.628   1.899
  377    H    SER  47           H        SER  47 -15.561  -6.677  -3.009
  378    HA   SER  47           HA       SER  47 -14.958  -8.496  -5.045
  379    HB2  SER  47           2HB      SER  47 -16.757 -10.194  -4.749
  380    HB3  SER  47           1HB      SER  47 -15.528 -10.280  -3.486
  381    HG   SER  47           HG       SER  47 -17.033  -8.907  -2.231
  382    H    LEU  48           H        LEU  48 -18.277  -8.326  -3.950
  383    HA   LEU  48           HA       LEU  48 -20.137  -7.612  -5.070
  384    HB2  LEU  48           2HB      LEU  48 -19.417  -5.857  -3.429
  385    HB3  LEU  48           1HB      LEU  48 -18.722  -4.968  -4.771
  386    HG   LEU  48           HG       LEU  48 -20.951  -4.747  -5.790
  387   HD11  LEU  48          1HD1      LEU  48 -21.953  -6.160  -3.315
  388   HD12  LEU  48          2HD1      LEU  48 -21.966  -6.805  -4.957
  389   HD13  LEU  48          3HD1      LEU  48 -22.958  -5.405  -4.554
  390   HD21  LEU  48          3HD2      LEU  48 -20.161  -3.003  -4.282
  391   HD22  LEU  48          1HD2      LEU  48 -20.849  -3.863  -2.905
  392   HD23  LEU  48          2HD2      LEU  48 -21.908  -3.198  -4.150
  393    H    TYR  49           H        TYR  49 -18.247  -4.983  -6.508
  394    HA   TYR  49           HA       TYR  49 -18.598  -6.186  -9.171
  395    HB2  TYR  49           2HB      TYR  49 -19.468  -3.403  -8.355
  396    HB3  TYR  49           1HB      TYR  49 -19.266  -3.893 -10.035
  397    HD1  TYR  49           HD2      TYR  49 -20.629  -5.939 -10.831
  398    HD2  TYR  49           HD1      TYR  49 -21.521  -3.790  -7.263
  399    HE1  TYR  49           HE2      TYR  49 -22.896  -6.882 -10.838
  400    HE2  TYR  49           HE1      TYR  49 -23.793  -4.733  -7.261
  401    HH   TYR  49           HH       TYR  49 -24.704  -7.322  -9.354
  402    HA   PRO  50           HA       PRO  50 -14.354  -5.056  -9.457
  403    HB2  PRO  50           2HB      PRO  50 -13.886  -5.656 -12.038
  404    HB3  PRO  50           1HB      PRO  50 -14.260  -6.901 -10.840
  405    HG2  PRO  50           2HG      PRO  50 -16.070  -5.610 -12.857
  406    HG3  PRO  50           1HG      PRO  50 -15.918  -7.325 -12.426
  407    HD2  PRO  50           2HD      PRO  50 -17.885  -5.697 -11.445
  408    HD3  PRO  50           1HD      PRO  50 -17.253  -7.104 -10.567
  409    H    HIS  51           H        HIS  51 -16.552  -2.890 -10.313
  410    HA   HIS  51           HA       HIS  51 -15.211  -1.269 -12.242
  411    HB2  HIS  51           2HB      HIS  51 -17.588  -0.969 -11.882
  412    HB3  HIS  51           1HB      HIS  51 -17.331  -0.596 -10.181
  413    HD1  HIS  51           HD1      HIS  51 -16.803   0.892 -13.619
  414    HD2  HIS  51           HD2      HIS  51 -16.789   2.054  -9.629
  415    HE1  HIS  51           HE1      HIS  51 -16.629   3.392 -13.649
  416    HE2  HIS  51           HE2      HIS  51 -16.394   4.042 -11.235
  417    H    LEU  52           H        LEU  52 -14.614  -1.894  -8.969
  418    HA   LEU  52           HA       LEU  52 -13.605   0.651  -8.155
  419    HB2  LEU  52           2HB      LEU  52 -13.111  -2.069  -6.934
  420    HB3  LEU  52           1HB      LEU  52 -12.905  -0.514  -6.142
  421    HG   LEU  52           HG       LEU  52 -15.579  -1.496  -7.159
  422   HD11  LEU  52          1HD1      LEU  52 -14.724  -3.054  -5.470
  423   HD12  LEU  52          2HD1      LEU  52 -16.109  -2.134  -4.877
  424   HD13  LEU  52          3HD1      LEU  52 -14.478  -1.706  -4.357
  425   HD21  LEU  52          3HD2      LEU  52 -14.837   0.676  -5.189
  426   HD22  LEU  52          1HD2      LEU  52 -16.473   0.220  -5.668
  427   HD23  LEU  52          2HD2      LEU  52 -15.375   0.929  -6.851
  428    H    TYR  53           H        TYR  53 -12.101   1.135  -9.877
  429    HA   TYR  53           HA       TYR  53  -9.587  -0.402  -9.807
  430    HB2  TYR  53           2HB      TYR  53 -10.610   1.590 -11.851
  431    HB3  TYR  53           1HB      TYR  53  -9.036   0.805 -11.925
  432    HD1  TYR  53           HD1      TYR  53  -9.197  -1.878 -11.687
  433    HD2  TYR  53           HD2      TYR  53 -12.291   0.661 -13.152
  434    HE1  TYR  53           HE1      TYR  53 -10.182  -3.782 -12.887
  435    HE2  TYR  53           HE2      TYR  53 -13.287  -1.239 -14.356
  436    HH   TYR  53           HH       TYR  53 -12.430  -4.453 -13.756
  437    H    SER  54           H        SER  54  -8.558   0.412  -8.026
  438    HA   SER  54           HA       SER  54  -7.294   3.002  -8.327
  439    HB2  SER  54           2HB      SER  54  -9.036   2.442  -5.900
  440    HB3  SER  54           1HB      SER  54  -7.934   3.808  -6.060
  441    HG   SER  54           HG       SER  54  -9.380   3.955  -8.187
  442    H    ARG  55           H        ARG  55  -5.320   3.122  -7.209
  443    HA   ARG  55           HA       ARG  55  -4.628   0.810  -5.519
  444    HB2  ARG  55           2HB      ARG  55  -2.963   1.887  -7.803
  445    HB3  ARG  55           1HB      ARG  55  -2.391   0.713  -6.622
  446    HG2  ARG  55           2HG      ARG  55  -4.193  -0.828  -7.325
  447    HG3  ARG  55           1HG      ARG  55  -4.677   0.334  -8.556
  448    HD2  ARG  55           2HD      ARG  55  -2.478   0.137  -9.615
  449    HD3  ARG  55           1HD      ARG  55  -1.987  -1.023  -8.377
  450    HE   ARG  55           HE       ARG  55  -4.257  -2.100  -9.441
  451   HH11  ARG  55          1HH1      ARG  55  -1.306  -0.973 -10.809
  452   HH12  ARG  55          2HH1      ARG  55  -1.321  -2.139 -12.085
  453   HH21  ARG  55          1HH2      ARG  55  -4.283  -3.571 -11.086
  454   HH22  ARG  55          2HH2      ARG  55  -2.984  -3.608 -12.232
  455    H    ALA  56           H        ALA  56  -2.654   1.124  -4.215
  456    HA   ALA  56           HA       ALA  56  -2.829   3.786  -3.007
  457    HB1  ALA  56           3HB      ALA  56  -1.731   1.218  -1.868
  458    HB2  ALA  56           1HB      ALA  56  -3.362   1.843  -1.620
  459    HB3  ALA  56           2HB      ALA  56  -1.974   2.730  -0.991
  460    H    TYR  57           H        TYR  57  -0.915   4.704  -1.974
  461    HA   TYR  57           HA       TYR  57   1.606   4.189  -3.433
  462    HB2  TYR  57           2HB      TYR  57   0.570   6.876  -2.467
  463    HB3  TYR  57           1HB      TYR  57   2.061   6.595  -3.359
  464    HD1  TYR  57           HD1      TYR  57  -1.650   6.302  -3.651
  465    HD2  TYR  57           HD2      TYR  57   2.056   6.667  -5.717
  466    HE1  TYR  57           HE1      TYR  57  -2.866   6.612  -5.766
  467    HE2  TYR  57           HE2      TYR  57   0.850   6.970  -7.837
  468    HH   TYR  57           HH       TYR  57  -1.288   6.511  -8.820
  469    H    ILE  58           H        ILE  58   3.585   4.653  -2.192
  470    HA   ILE  58           HA       ILE  58   3.160   4.714   0.735
  471    HB   ILE  58           HB       ILE  58   5.237   2.995  -0.644
  472   HG12  ILE  58          2HG1      ILE  58   2.636   2.164   0.689
  473   HG13  ILE  58          1HG1      ILE  58   2.940   2.145  -1.044
  474   HG21  ILE  58          1HG2      ILE  58   5.891   3.786   1.577
  475   HG22  ILE  58          2HG2      ILE  58   5.571   2.051   1.598
  476   HG23  ILE  58          3HG2      ILE  58   4.378   3.173   2.251
  477   HD11  ILE  58          3HD1      ILE  58   4.357   0.476   1.025
  478   HD12  ILE  58          1HD1      ILE  58   4.688   0.463  -0.709
  479   HD13  ILE  58          2HD1      ILE  58   3.122  -0.078  -0.105
  480    H    ASN  59           H        ASN  59   4.056   6.514   1.523
  481    HA   ASN  59           HA       ASN  59   6.256   7.801   0.109
  482    HB2  ASN  59           2HB      ASN  59   4.337   9.161   0.761
  483    HB3  ASN  59           1HB      ASN  59   4.580   8.729   2.451
  484   HD21  ASN  59          1HD2      ASN  59   4.820  10.838   3.077
  485   HD22  ASN  59          2HD2      ASN  59   6.227  11.771   2.704
  486    H    PHE  60           H        PHE  60   8.023   6.481   0.609
  487    HA   PHE  60           HA       PHE  60   8.821   5.879   3.286
  488    HB2  PHE  60           2HB      PHE  60  10.191   5.711   0.610
  489    HB3  PHE  60           1HB      PHE  60  11.091   5.432   2.096
  490    HD1  PHE  60           HD2      PHE  60   8.400   4.152  -0.069
  491    HD2  PHE  60           HD1      PHE  60  10.789   3.451   3.383
  492    HE1  PHE  60           HE2      PHE  60   7.668   1.803  -0.042
  493    HE2  PHE  60           HE1      PHE  60  10.064   1.106   3.417
  494    HZ   PHE  60           HZ       PHE  60   8.503   0.274   1.703
  495    H    ARG  61           H        ARG  61   9.597   7.283   4.722
  496    HA   ARG  61           HA       ARG  61  10.843   9.774   3.856
  497    HB2  ARG  61           2HB      ARG  61  10.210   8.755   6.639
  498    HB3  ARG  61           1HB      ARG  61  10.856  10.348   6.270
  499    HG2  ARG  61           2HG      ARG  61   8.793  10.819   4.950
  500    HG3  ARG  61           1HG      ARG  61   8.150   9.263   5.487
  501    HD2  ARG  61           2HD      ARG  61   8.417  10.028   7.843
  502    HD3  ARG  61           1HD      ARG  61   8.926  11.602   7.238
  503    HE   ARG  61           HE       ARG  61   6.422  10.967   6.139
  504   HH11  ARG  61          1HH1      ARG  61   7.852  11.916   9.118
  505   HH12  ARG  61          2HH1      ARG  61   6.377  12.540   9.762
  506   HH21  ARG  61          1HH2      ARG  61   4.517  11.751   6.975
  507   HH22  ARG  61          2HH2      ARG  61   4.510  12.453   8.556
  508    H    ASN  62           H        ASN  62  12.011   6.739   4.179
  509    HA   ASN  62           HA       ASN  62  14.705   7.634   4.809
  510    HB2  ASN  62           2HB      ASN  62  13.712   7.067   7.008
  511    HB3  ASN  62           1HB      ASN  62  13.381   5.440   6.429
  512   HD21  ASN  62          1HD2      ASN  62  14.989   3.961   6.441
  513   HD22  ASN  62          2HD2      ASN  62  16.598   4.277   6.997
  514    HA   PRO  63           HA       PRO  63  15.475   4.837   1.463
  515    HB2  PRO  63           2HB      PRO  63  18.191   4.665   1.642
  516    HB3  PRO  63           1HB      PRO  63  17.347   6.093   1.032
  517    HG2  PRO  63           2HG      PRO  63  18.444   5.578   3.780
  518    HG3  PRO  63           1HG      PRO  63  18.598   7.029   2.769
  519    HD2  PRO  63           2HD      PRO  63  16.801   6.886   4.765
  520    HD3  PRO  63           1HD      PRO  63  16.444   7.749   3.254
  521    H    ASP  64           H        ASP  64  16.895   4.005   4.629
  522    HA   ASP  64           HA       ASP  64  17.759   1.412   4.034
  523    HB2  ASP  64           2HB      ASP  64  16.647   2.415   6.668
  524    HB3  ASP  64           1HB      ASP  64  17.638   0.975   6.450
  525    H    ASP  65           H        ASP  65  14.582   2.519   5.169
  526    HA   ASP  65           HA       ASP  65  13.350   0.019   5.437
  527    HB2  ASP  65           2HB      ASP  65  12.097   2.676   4.699
  528    HB3  ASP  65           1HB      ASP  65  11.229   1.262   5.301
  529    H    ILE  66           H        ILE  66  13.839   2.048   2.598
  530    HA   ILE  66           HA       ILE  66  12.021   0.849   0.843
  531    HB   ILE  66           HB       ILE  66  14.732   2.019   0.159
  532   HG12  ILE  66          2HG1      ILE  66  11.982   3.303   0.243
  533   HG13  ILE  66          1HG1      ILE  66  13.291   3.602   1.380
  534   HG21  ILE  66          1HG2      ILE  66  13.789   2.367  -2.087
  535   HG22  ILE  66          2HG2      ILE  66  12.319   1.525  -1.597
  536   HG23  ILE  66          3HG2      ILE  66  13.852   0.657  -1.664
  537   HD11  ILE  66          3HD1      ILE  66  13.114   5.409  -0.207
  538   HD12  ILE  66          1HD1      ILE  66  13.290   4.283  -1.553
  539   HD13  ILE  66          2HD1      ILE  66  14.634   4.547  -0.442
  540    H    LEU  67           H        LEU  67  15.553   0.183   0.943
  541    HA   LEU  67           HA       LEU  67  15.366  -2.123  -0.670
  542    HB2  LEU  67           2HB      LEU  67  17.683  -2.624   0.116
  543    HB3  LEU  67           1HB      LEU  67  17.457  -1.033  -0.584
  544    HG   LEU  67           HG       LEU  67  17.232  -0.235   1.898
  545   HD11  LEU  67          1HD1      LEU  67  17.136  -2.418   2.955
  546   HD12  LEU  67          2HD1      LEU  67  18.575  -1.545   3.483
  547   HD13  LEU  67          3HD1      LEU  67  18.715  -2.836   2.287
  548   HD21  LEU  67          3HD2      LEU  67  19.041   0.414   0.400
  549   HD22  LEU  67          1HD2      LEU  67  19.891  -1.092   0.747
  550   HD23  LEU  67          2HD2      LEU  67  19.654   0.103   2.023
  551    H    LEU  68           H        LEU  68  15.061  -1.699   2.785
  552    HA   LEU  68           HA       LEU  68  15.316  -4.412   3.563
  553    HB2  LEU  68           2HB      LEU  68  15.499  -2.754   5.246
  554    HB3  LEU  68           1HB      LEU  68  13.976  -2.012   4.798
  555    HG   LEU  68           HG       LEU  68  12.759  -3.966   5.681
  556   HD11  LEU  68          1HD1      LEU  68  15.486  -4.930   6.567
  557   HD12  LEU  68          2HD1      LEU  68  14.471  -5.676   5.332
  558   HD13  LEU  68          3HD1      LEU  68  13.939  -5.653   7.013
  559   HD21  LEU  68          3HD2      LEU  68  13.158  -2.035   7.121
  560   HD22  LEU  68          1HD2      LEU  68  14.691  -2.730   7.653
  561   HD23  LEU  68          2HD2      LEU  68  13.171  -3.530   8.056
  562    H    PHE  69           H        PHE  69  12.362  -2.449   3.170
  563    HA   PHE  69           HA       PHE  69  10.660  -4.712   3.513
  564    HB2  PHE  69           2HB      PHE  69  10.229  -1.808   2.945
  565    HB3  PHE  69           1HB      PHE  69   8.883  -2.930   2.769
  566    HD1  PHE  69           HD2      PHE  69   8.030  -4.154   4.709
  567    HD2  PHE  69           HD1      PHE  69  11.092  -1.217   5.130
  568    HE1  PHE  69           HE2      PHE  69   7.622  -4.079   7.128
  569    HE2  PHE  69           HE1      PHE  69  10.686  -1.147   7.550
  570    HZ   PHE  69           HZ       PHE  69   8.951  -2.574   8.555
  571    H    ARG  70           H        ARG  70  11.833  -2.982   0.638
  572    HA   ARG  70           HA       ARG  70  10.005  -4.033  -1.211
  573    HB2  ARG  70           2HB      ARG  70  11.608  -3.511  -2.952
  574    HB3  ARG  70           1HB      ARG  70  11.615  -2.228  -1.757
  575    HG2  ARG  70           2HG      ARG  70  13.862  -2.459  -2.087
  576    HG3  ARG  70           1HG      ARG  70  13.642  -3.601  -0.766
  577    HD2  ARG  70           2HD      ARG  70  13.440  -5.420  -2.491
  578    HD3  ARG  70           1HD      ARG  70  13.890  -4.225  -3.709
  579    HE   ARG  70           HE       ARG  70  15.731  -4.498  -1.487
  580   HH11  ARG  70          1HH1      ARG  70  14.918  -5.537  -4.671
  581   HH12  ARG  70          2HH1      ARG  70  16.535  -6.029  -5.040
  582   HH21  ARG  70          1HH2      ARG  70  17.780  -5.179  -1.943
  583   HH22  ARG  70          2HH2      ARG  70  18.144  -5.845  -3.499
  584    H    ASP  71           H        ASP  71  12.869  -5.475   0.218
  585    HA   ASP  71           HA       ASP  71  13.122  -7.668  -1.554
  586    HB2  ASP  71           2HB      ASP  71  14.951  -6.912  -0.091
  587    HB3  ASP  71           1HB      ASP  71  14.018  -7.387   1.327
  588    H    ARG  72           H        ARG  72  11.445  -7.322   1.567
  589    HA   ARG  72           HA       ARG  72  10.530 -10.073   1.539
  590    HB2  ARG  72           2HB      ARG  72   9.273  -9.390   3.614
  591    HB3  ARG  72           1HB      ARG  72  11.016  -9.177   3.694
  592    HG2  ARG  72           2HG      ARG  72  10.812  -6.809   3.385
  593    HG3  ARG  72           1HG      ARG  72   9.085  -6.953   3.058
  594    HD2  ARG  72           2HD      ARG  72  10.391  -7.708   5.674
  595    HD3  ARG  72           1HD      ARG  72   9.624  -6.150   5.361
  596    HE   ARG  72           HE       ARG  72   7.813  -8.222   4.768
  597   HH11  ARG  72          1HH1      ARG  72   9.330  -6.746   7.494
  598   HH12  ARG  72          2HH1      ARG  72   8.008  -7.104   8.550
  599   HH21  ARG  72          1HH2      ARG  72   6.132  -8.673   6.137
  600   HH22  ARG  72          2HH2      ARG  72   6.219  -8.178   7.791
  601    H    PHE  73           H        PHE  73   9.273  -7.012   0.472
  602    HA   PHE  73           HA       PHE  73   6.562  -8.125   0.206
  603    HB2  PHE  73           2HB      PHE  73   7.649  -5.337   0.288
  604    HB3  PHE  73           1HB      PHE  73   6.108  -5.641  -0.504
  605    HD1  PHE  73           HD1      PHE  73   4.210  -6.550   0.791
  606    HD2  PHE  73           HD2      PHE  73   7.845  -5.377   2.675
  607    HE1  PHE  73           HE1      PHE  73   3.066  -6.514   2.967
  608    HE2  PHE  73           HE2      PHE  73   6.703  -5.344   4.852
  609    HZ   PHE  73           HZ       PHE  73   4.313  -5.914   5.000
  610    H    ASP  74           H        ASP  74   9.224  -8.086  -1.668
  611    HA   ASP  74           HA       ASP  74   8.210  -7.282  -4.185
  612    HB2  ASP  74           2HB      ASP  74  10.637  -7.635  -3.670
  613    HB3  ASP  74           1HB      ASP  74  10.344  -9.371  -3.660
  614    H    GLY  75           H        GLY  75   6.109  -8.138  -4.414
  615    HA2  GLY  75           2HA      GLY  75   4.680  -9.658  -5.451
  616    HA3  GLY  75           1HA      GLY  75   5.995 -10.823  -5.505
  617    H    TYR  76           H        TYR  76   4.626  -9.126  -2.705
  618    HA   TYR  76           HA       TYR  76   4.545 -11.554  -1.175
  619    HB2  TYR  76           2HB      TYR  76   5.145  -9.753   0.132
  620    HB3  TYR  76           1HB      TYR  76   4.069  -8.645  -0.703
  621    HD1  TYR  76           HD2      TYR  76   3.924 -11.589   1.630
  622    HD2  TYR  76           HD1      TYR  76   2.189  -7.913   0.377
  623    HE1  TYR  76           HE2      TYR  76   2.346 -11.698   3.510
  624    HE2  TYR  76           HE1      TYR  76   0.618  -8.011   2.238
  625    HH   TYR  76           HH       TYR  76  -0.366  -9.620   3.757
  626    H    ILE  77           H        ILE  77   2.970 -13.001  -1.333
  627    HA   ILE  77           HA       ILE  77   0.373 -12.257  -2.435
  628    HB   ILE  77           HB       ILE  77   1.515 -14.972  -1.728
  629   HG12  ILE  77          2HG1      ILE  77   2.605 -13.853  -3.651
  630   HG13  ILE  77          1HG1      ILE  77   1.717 -15.288  -4.146
  631   HG21  ILE  77          1HG2      ILE  77  -0.913 -15.005  -1.516
  632   HG22  ILE  77          2HG2      ILE  77  -0.412 -15.915  -2.940
  633   HG23  ILE  77          3HG2      ILE  77  -1.083 -14.295  -3.123
  634   HD11  ILE  77          3HD1      ILE  77   1.433 -13.448  -5.713
  635   HD12  ILE  77          1HD1      ILE  77   0.754 -12.448  -4.429
  636   HD13  ILE  77          2HD1      ILE  77  -0.099 -13.896  -4.965
  637    H    PHE  78           H        PHE  78  -0.943 -11.351  -0.966
  638    HA   PHE  78           HA       PHE  78  -1.194 -12.523   1.710
  639    HB2  PHE  78           2HB      PHE  78  -0.991 -10.106   1.620
  640    HB3  PHE  78           1HB      PHE  78  -2.353  -9.994   0.510
  641    HD1  PHE  78           HD1      PHE  78  -1.452 -11.061   3.963
  642    HD2  PHE  78           HD2      PHE  78  -4.519  -9.688   1.342
  643    HE1  PHE  78           HE1      PHE  78  -2.971 -10.805   5.876
  644    HE2  PHE  78           HE2      PHE  78  -6.042  -9.432   3.257
  645    HZ   PHE  78           HZ       PHE  78  -5.270  -9.991   5.526
  646    H    LEU  79           H        LEU  79  -2.859 -13.780   2.320
  647    HA   LEU  79           HA       LEU  79  -5.131 -14.094   0.461
  648    HB2  LEU  79           2HB      LEU  79  -3.880 -16.058   2.383
  649    HB3  LEU  79           1HB      LEU  79  -5.398 -16.354   1.554
  650    HG   LEU  79           HG       LEU  79  -2.775 -15.853   0.137
  651   HD11  LEU  79          1HD1      LEU  79  -2.770 -18.258  -0.331
  652   HD12  LEU  79          2HD1      LEU  79  -4.177 -18.463   0.713
  653   HD13  LEU  79          3HD1      LEU  79  -2.642 -17.922   1.396
  654   HD21  LEU  79          3HD2      LEU  79  -3.973 -16.717  -1.825
  655   HD22  LEU  79          1HD2      LEU  79  -4.723 -15.254  -1.188
  656   HD23  LEU  79          2HD2      LEU  79  -5.451 -16.827  -0.868
  657    H    ASP  80           H        ASP  80  -6.786 -12.932   1.162
  658    HA   ASP  80           HA       ASP  80  -7.317 -12.489   3.979
  659    HB2  ASP  80           2HB      ASP  80  -7.622 -10.676   2.345
  660    HB3  ASP  80           1HB      ASP  80  -8.815 -11.637   1.479
  661    H    SER  81           H        SER  81  -9.850 -12.671   4.538
  662    HA   SER  81           HA       SER  81 -10.594 -15.321   4.772
  663    HB2  SER  81           2HB      SER  81 -12.438 -12.912   4.697
  664    HB3  SER  81           1HB      SER  81 -12.840 -14.493   5.369
  665    HG   SER  81           HG       SER  81 -11.916 -12.611   6.750
  666    H    LYS  82           H        LYS  82 -11.244 -13.120   2.104
  667    HA   LYS  82           HA       LYS  82 -13.112 -14.778   0.732
  668    HB2  LYS  82           2HB      LYS  82 -11.353 -12.486  -0.111
  669    HB3  LYS  82           1HB      LYS  82 -12.320 -13.362  -1.289
  670    HG2  LYS  82           2HG      LYS  82 -13.462 -12.036   1.165
  671    HG3  LYS  82           1HG      LYS  82 -13.371 -11.276  -0.425
  672    HD2  LYS  82           2HD      LYS  82 -14.750 -13.068  -1.368
  673    HD3  LYS  82           1HD      LYS  82 -14.841 -13.841   0.214
  674    HE2  LYS  82           2HE      LYS  82 -15.841 -11.057  -0.382
  675    HE3  LYS  82           1HE      LYS  82 -16.853 -12.498  -0.398
  676    HZ1  LYS  82           3HZ      LYS  82 -15.370 -11.453   1.958
  677    HZ2  LYS  82           1HZ      LYS  82 -16.330 -12.848   1.936
  678    HZ3  LYS  82           2HZ      LYS  82 -17.038 -11.332   1.692
  679    H    GLY  83           H        GLY  83  -9.720 -15.019   1.122
  680    HA2  GLY  83           2HA      GLY  83  -8.274 -16.685   0.437
  681    HA3  GLY  83           1HA      GLY  83  -9.604 -17.430  -0.429
  682    H    LEU  84           H        LEU  84  -9.262 -14.203  -1.327
  683    HA   LEU  84           HA       LEU  84  -8.284 -14.897  -3.941
  684    HB2  LEU  84           2HB      LEU  84  -8.896 -12.194  -2.729
  685    HB3  LEU  84           1HB      LEU  84  -8.573 -12.491  -4.429
  686    HG   LEU  84           HG       LEU  84 -10.945 -13.553  -2.873
  687   HD11  LEU  84          1HD1      LEU  84 -11.084 -11.149  -3.285
  688   HD12  LEU  84          2HD1      LEU  84 -12.264 -12.032  -4.252
  689   HD13  LEU  84          3HD1      LEU  84 -10.791 -11.420  -5.004
  690   HD21  LEU  84          3HD2      LEU  84 -10.238 -13.830  -5.798
  691   HD22  LEU  84          1HD2      LEU  84 -11.766 -14.314  -5.062
  692   HD23  LEU  84          2HD2      LEU  84 -10.271 -15.126  -4.600
  693    H    GLU  85           H        GLU  85  -6.227 -14.813  -4.656
  694    HA   GLU  85           HA       GLU  85  -4.057 -14.130  -2.954
  695    HB2  GLU  85           2HB      GLU  85  -4.139 -14.611  -5.942
  696    HB3  GLU  85           1HB      GLU  85  -2.658 -14.436  -5.010
  697    HG2  GLU  85           2HG      GLU  85  -3.138 -16.442  -3.770
  698    HG3  GLU  85           1HG      GLU  85  -4.722 -16.581  -4.535
  699    H    TYR  86           H        TYR  86  -3.808 -12.044  -2.329
  700    HA   TYR  86           HA       TYR  86  -3.940  -9.897  -4.316
  701    HB2  TYR  86           2HB      TYR  86  -3.359  -9.761  -1.341
  702    HB3  TYR  86           1HB      TYR  86  -3.614  -8.380  -2.406
  703    HD1  TYR  86           HD1      TYR  86  -5.904  -8.152  -3.540
  704    HD2  TYR  86           HD2      TYR  86  -5.184 -10.809  -0.288
  705    HE1  TYR  86           HE1      TYR  86  -8.319  -8.252  -3.086
  706    HE2  TYR  86           HE2      TYR  86  -7.593 -10.914   0.166
  707    HH   TYR  86           HH       TYR  86  -9.601  -9.639  -0.222
  708    HA   PRO  87           HA       PRO  87   0.532 -10.595  -4.616
  709    HB2  PRO  87           2HB      PRO  87   0.598  -9.532  -7.237
  710    HB3  PRO  87           1HB      PRO  87   0.511 -11.236  -6.788
  711    HG2  PRO  87           2HG      PRO  87  -1.499  -9.740  -8.073
  712    HG3  PRO  87           1HG      PRO  87  -1.673 -11.355  -7.369
  713    HD2  PRO  87           2HD      PRO  87  -2.457  -8.702  -6.258
  714    HD3  PRO  87           1HD      PRO  87  -3.200 -10.299  -6.016
  715    H    ALA  88           H        ALA  88   0.984  -8.946  -3.078
  716    HA   ALA  88           HA       ALA  88   1.014  -6.177  -3.805
  717    HB1  ALA  88           3HB      ALA  88   2.343  -7.595  -1.493
  718    HB2  ALA  88           1HB      ALA  88   0.727  -6.885  -1.487
  719    HB3  ALA  88           2HB      ALA  88   2.145  -5.850  -1.658
  720    H    VAL  89           H        VAL  89   2.306  -5.798  -5.592
  721    HA   VAL  89           HA       VAL  89   5.167  -6.491  -5.338
  722    HB   VAL  89           HB       VAL  89   3.665  -5.655  -7.834
  723   HG11  VAL  89          1HG1      VAL  89   6.521  -6.568  -7.432
  724   HG12  VAL  89          2HG1      VAL  89   5.987  -4.965  -7.941
  725   HG13  VAL  89          3HG1      VAL  89   5.743  -6.354  -9.002
  726   HG21  VAL  89          3HG2      VAL  89   2.996  -7.879  -7.068
  727   HG22  VAL  89          1HG2      VAL  89   4.689  -8.370  -6.985
  728   HG23  VAL  89          2HG2      VAL  89   3.955  -7.990  -8.544
  729    H    VAL  90           H        VAL  90   6.109  -4.896  -4.245
  730    HA   VAL  90           HA       VAL  90   5.339  -2.129  -4.520
  731    HB   VAL  90           HB       VAL  90   5.946  -3.015  -2.330
  732   HG11  VAL  90          1HG1      VAL  90   8.268  -3.627  -1.790
  733   HG12  VAL  90          2HG1      VAL  90   8.701  -3.461  -3.491
  734   HG13  VAL  90          3HG1      VAL  90   7.558  -4.708  -2.989
  735   HG21  VAL  90          3HG2      VAL  90   7.927  -0.956  -3.318
  736   HG22  VAL  90          1HG2      VAL  90   7.546  -1.282  -1.626
  737   HG23  VAL  90          2HG2      VAL  90   6.305  -0.643  -2.701
  738    H    GLU  91           H        GLU  91   6.257  -0.608  -5.789
  739    HA   GLU  91           HA       GLU  91   9.008  -0.933  -6.752
  740    HB2  GLU  91           2HB      GLU  91   8.359  -0.353  -9.072
  741    HB3  GLU  91           1HB      GLU  91   7.691  -1.895  -8.557
  742    HG2  GLU  91           2HG      GLU  91   5.519  -0.882  -8.207
  743    HG3  GLU  91           1HG      GLU  91   6.170   0.709  -8.598
  744    H    PHE  92           H        PHE  92  10.066   1.042  -7.174
  745    HA   PHE  92           HA       PHE  92   9.128   3.228  -5.640
  746    HB2  PHE  92           2HB      PHE  92  11.143   4.400  -6.391
  747    HB3  PHE  92           1HB      PHE  92  11.507   2.758  -5.885
  748    HD1  PHE  92           HD1      PHE  92  11.944   1.011  -7.611
  749    HD2  PHE  92           HD2      PHE  92  11.612   5.139  -8.597
  750    HE1  PHE  92           HE1      PHE  92  13.081   0.588  -9.750
  751    HE2  PHE  92           HE2      PHE  92  12.743   4.722 -10.740
  752    HZ   PHE  92           HZ       PHE  92  13.480   2.444 -11.318
  753    H    ALA  93           H        ALA  93   8.809   5.448  -6.330
  754    HA   ALA  93           HA       ALA  93   6.945   5.647  -8.496
  755    HB1  ALA  93           3HB      ALA  93   6.731   7.986  -7.835
  756    HB2  ALA  93           1HB      ALA  93   8.151   7.835  -6.797
  757    HB3  ALA  93           2HB      ALA  93   6.684   6.930  -6.422
  758    HA   PRO  94           HA       PRO  94   9.735   6.658 -11.785
  759    HB2  PRO  94           2HB      PRO  94   7.571   8.184 -13.068
  760    HB3  PRO  94           1HB      PRO  94   8.346   6.685 -13.588
  761    HG2  PRO  94           2HG      PRO  94   5.814   6.728 -12.668
  762    HG3  PRO  94           1HG      PRO  94   6.902   5.359 -12.370
  763    HD2  PRO  94           2HD      PRO  94   6.153   7.615 -10.530
  764    HD3  PRO  94           1HD      PRO  94   6.286   5.875 -10.184
  765    H    PHE  95           H        PHE  95  11.304   8.118 -11.296
  766    HA   PHE  95           HA       PHE  95  10.643  10.935 -10.883
  767    HB2  PHE  95           2HB      PHE  95  12.315   9.899  -9.409
  768    HB3  PHE  95           1HB      PHE  95  13.307   9.482 -10.802
  769    HD1  PHE  95           HD1      PHE  95  11.957  12.345  -8.857
  770    HD2  PHE  95           HD2      PHE  95  14.863  11.024 -11.683
  771    HE1  PHE  95           HE1      PHE  95  13.125  14.502  -8.662
  772    HE2  PHE  95           HE2      PHE  95  16.031  13.181 -11.489
  773    HZ   PHE  95           HZ       PHE  95  15.164  14.921  -9.977
  774    H    GLN  96           H        GLN  96  11.429  12.625 -12.210
  775    HA   GLN  96           HA       GLN  96  12.819  11.943 -14.686
  776    HB2  GLN  96           2HB      GLN  96  10.204  11.859 -14.932
  777    HB3  GLN  96           1HB      GLN  96  10.330  13.609 -14.930
  778    HG2  GLN  96           2HG      GLN  96  11.708  11.758 -16.872
  779    HG3  GLN  96           1HG      GLN  96  10.230  12.661 -17.193
  780   HE21  GLN  96          1HE2      GLN  96  10.361  14.913 -17.437
  781   HE22  GLN  96          2HE2      GLN  96  11.860  15.688 -17.803
  782    H    LYS  97           H        LYS  97  10.958  14.826 -13.694
  783    HA   LYS  97           HA       LYS  97  13.142  16.330 -12.742
  784    HB2  LYS  97           2HB      LYS  97  13.862  16.177 -15.119
  785    HB3  LYS  97           1HB      LYS  97  12.381  16.984 -15.607
  786    HG2  LYS  97           2HG      LYS  97  14.048  18.405 -13.610
  787    HG3  LYS  97           1HG      LYS  97  14.728  18.250 -15.228
  788    HD2  LYS  97           2HD      LYS  97  12.005  19.402 -14.591
  789    HD3  LYS  97           1HD      LYS  97  13.458  20.354 -14.918
  790    HE2  LYS  97           2HE      LYS  97  12.090  18.442 -16.824
  791    HE3  LYS  97           1HE      LYS  97  12.071  20.203 -16.914
  792    HZ1  LYS  97           3HZ      LYS  97  13.675  19.278 -18.446
  793    HZ2  LYS  97           1HZ      LYS  97  14.471  18.476 -17.191
  794    HZ3  LYS  97           2HZ      LYS  97  14.474  20.167 -17.253
  Start of MODEL   18
    1    H1   MET   1           1H       MET   1  13.023  23.946  21.603
    2    H2   MET   1           2H       MET   1  11.407  23.580  21.258
    3    H3   MET   1           3H       MET   1  11.805  25.066  21.951
    4    HA   MET   1           HA       MET   1  11.316  25.332  19.618
    5    HB2  MET   1           2HB      MET   1  14.265  25.668  20.237
    6    HB3  MET   1           1HB      MET   1  13.384  26.497  18.962
    7    HG2  MET   1           2HG      MET   1  12.947  26.796  21.928
    8    HG3  MET   1           1HG      MET   1  13.708  27.964  20.849
    9    HE1  MET   1           3HE      MET   1  10.335  29.740  21.750
   10    HE2  MET   1           1HE      MET   1  12.092  29.892  21.696
   11    HE3  MET   1           2HE      MET   1  11.337  28.753  22.813
   12    H    GLY   2           H        GLY   2  12.093  25.011  17.373
   13    HA2  GLY   2           2HA      GLY   2  13.932  23.516  16.241
   14    HA3  GLY   2           1HA      GLY   2  12.996  22.237  16.989
   15    H    HIS   3           H        HIS   3  13.582  23.101  14.124
   16    HA   HIS   3           HA       HIS   3  10.801  22.723  13.203
   17    HB2  HIS   3           2HB      HIS   3  12.914  24.516  11.987
   18    HB3  HIS   3           1HB      HIS   3  11.504  23.967  11.084
   19    HD1  HIS   3           HD1      HIS   3  12.591  26.475  13.546
   20    HD2  HIS   3           HD2      HIS   3   8.999  24.939  12.125
   21    HE1  HIS   3           HE1      HIS   3  10.825  28.088  14.296
   22    HE2  HIS   3           HE2      HIS   3   8.653  27.018  13.621
   23    H    HIS   4           H        HIS   4  10.759  20.628  12.707
   24    HA   HIS   4           HA       HIS   4  12.911  19.015  12.009
   25    HB2  HIS   4           2HB      HIS   4  11.172  17.371  11.241
   26    HB3  HIS   4           1HB      HIS   4  10.909  18.019  12.855
   27    HD1  HIS   4           HD1      HIS   4   8.783  19.370  13.250
   28    HD2  HIS   4           HD2      HIS   4   9.291  18.234   9.290
   29    HE1  HIS   4           HE1      HIS   4   6.604  19.881  12.123
   30    HE2  HIS   4           HE2      HIS   4   7.004  19.361   9.698
   31    H    HIS   5           H        HIS   5  14.135  18.906  10.260
   32    HA   HIS   5           HA       HIS   5  12.892  19.262   7.616
   33    HB2  HIS   5           2HB      HIS   5  15.110  20.252   6.852
   34    HB3  HIS   5           1HB      HIS   5  14.110  21.274   7.877
   35    HD1  HIS   5           HD1      HIS   5  14.951  21.671  10.329
   36    HD2  HIS   5           HD2      HIS   5  17.607  19.602   7.894
   37    HE1  HIS   5           HE1      HIS   5  17.160  21.758  11.517
   38    HE2  HIS   5           HE2      HIS   5  18.779  20.654   9.942
   39    H    HIS   6           H        HIS   6  12.777  17.204   6.967
   40    HA   HIS   6           HA       HIS   6  14.868  15.314   7.665
   41    HB2  HIS   6           2HB      HIS   6  12.230  14.902   6.236
   42    HB3  HIS   6           1HB      HIS   6  13.319  13.618   6.754
   43    HD1  HIS   6           HD1      HIS   6  10.487  15.580   7.885
   44    HD2  HIS   6           HD2      HIS   6  13.653  13.586   9.699
   45    HE1  HIS   6           HE1      HIS   6   9.820  15.303  10.288
   46    HE2  HIS   6           HE2      HIS   6  11.825  14.268  11.400
   47    H    HIS   7           H        HIS   7  16.118  14.152   6.249
   48    HA   HIS   7           HA       HIS   7  17.041  15.424   3.926
   49    HB2  HIS   7           2HB      HIS   7  18.306  13.324   3.513
   50    HB3  HIS   7           1HB      HIS   7  18.462  13.901   5.168
   51    HD1  HIS   7           HD1      HIS   7  16.696  11.218   3.158
   52    HD2  HIS   7           HD2      HIS   7  17.667  12.121   7.099
   53    HE1  HIS   7           HE1      HIS   7  16.052   9.196   4.493
   54    HE2  HIS   7           HE2      HIS   7  16.782   9.707   6.839
   55    H    HIS   8           H        HIS   8  17.298  14.011   1.796
   56    HA   HIS   8           HA       HIS   8  14.779  14.094   0.535
   57    HB2  HIS   8           2HB      HIS   8  17.346  12.804  -0.417
   58    HB3  HIS   8           1HB      HIS   8  15.948  13.154  -1.432
   59    HD1  HIS   8           HD1      HIS   8  19.084  14.578  -0.377
   60    HD2  HIS   8           HD2      HIS   8  15.361  16.079  -1.453
   61    HE1  HIS   8           HE1      HIS   8  19.460  16.998  -0.908
   62    HE2  HIS   8           HE2      HIS   8  17.247  17.815  -1.765
   63    H    SER   9           H        SER   9  13.249  12.626   0.165
   64    HA   SER   9           HA       SER   9  13.731   9.823   0.978
   65    HB2  SER   9           2HB      SER   9  11.125  11.380   1.014
   66    HB3  SER   9           1HB      SER   9  11.338   9.711   1.542
   67    HG   SER   9           HG       SER   9  12.852  11.812   2.676
   68    H    HIS  10           H        HIS  10  11.600   8.540  -0.128
   69    HA   HIS  10           HA       HIS  10  11.514   9.282  -2.969
   70    HB2  HIS  10           2HB      HIS  10  12.371   6.564  -1.943
   71    HB3  HIS  10           1HB      HIS  10  11.960   6.905  -3.620
   72    HD1  HIS  10           HD1      HIS  10  14.736   6.982  -1.255
   73    HD2  HIS  10           HD2      HIS  10  13.801   8.795  -4.873
   74    HE1  HIS  10           HE1      HIS  10  16.905   7.874  -2.139
   75    HE2  HIS  10           HE2      HIS  10  16.297   9.079  -4.257
   76    H    MET  11           H        MET  11   9.499   9.211  -3.708
   77    HA   MET  11           HA       MET  11   7.329   7.997  -2.331
   78    HB2  MET  11           2HB      MET  11   6.928   9.891  -3.788
   79    HB3  MET  11           1HB      MET  11   7.574   9.020  -5.174
   80    HG2  MET  11           2HG      MET  11   5.135   9.130  -5.223
   81    HG3  MET  11           1HG      MET  11   5.710   7.469  -5.103
   82    HE1  MET  11           3HE      MET  11   3.883   9.843  -1.587
   83    HE2  MET  11           1HE      MET  11   3.967  10.455  -3.241
   84    HE3  MET  11           2HE      MET  11   5.445  10.231  -2.306
   85    H    VAL  12           H        VAL  12   6.387   6.007  -2.568
   86    HA   VAL  12           HA       VAL  12   7.504   4.171  -4.594
   87    HB   VAL  12           HB       VAL  12   7.088   3.590  -1.647
   88   HG11  VAL  12          1HG1      VAL  12   7.849   1.316  -2.122
   89   HG12  VAL  12          2HG1      VAL  12   7.893   1.684  -3.846
   90   HG13  VAL  12          3HG1      VAL  12   6.355   1.681  -2.984
   91   HG21  VAL  12          3HG2      VAL  12   9.581   3.535  -3.358
   92   HG22  VAL  12          1HG2      VAL  12   9.493   3.106  -1.648
   93   HG23  VAL  12          2HG2      VAL  12   9.176   4.764  -2.160
   94    H    VAL  13           H        VAL  13   6.055   2.653  -5.444
   95    HA   VAL  13           HA       VAL  13   3.224   3.056  -4.686
   96    HB   VAL  13           HB       VAL  13   2.590   2.651  -7.006
   97   HG11  VAL  13          1HG1      VAL  13   3.036   4.955  -6.322
   98   HG12  VAL  13          2HG1      VAL  13   3.467   4.709  -8.013
   99   HG13  VAL  13          3HG1      VAL  13   4.730   4.778  -6.781
  100   HG21  VAL  13          3HG2      VAL  13   4.310   2.542  -8.787
  101   HG22  VAL  13          1HG2      VAL  13   4.351   1.145  -7.710
  102   HG23  VAL  13          2HG2      VAL  13   5.556   2.422  -7.544
  103    H    ILE  14           H        ILE  14   1.830   1.296  -4.679
  104    HA   ILE  14           HA       ILE  14   3.105  -1.370  -4.713
  105    HB   ILE  14           HB       ILE  14   2.034  -0.628  -2.568
  106   HG12  ILE  14          2HG1      ILE  14   0.676  -2.747  -2.241
  107   HG13  ILE  14          1HG1      ILE  14   0.919  -3.077  -3.954
  108   HG21  ILE  14          1HG2      ILE  14  -0.548  -0.819  -4.120
  109   HG22  ILE  14          2HG2      ILE  14   0.176   0.650  -3.466
  110   HG23  ILE  14          3HG2      ILE  14  -0.404  -0.606  -2.374
  111   HD11  ILE  14          3HD1      ILE  14   2.492  -4.302  -2.568
  112   HD12  ILE  14          1HD1      ILE  14   3.087  -2.789  -1.886
  113   HD13  ILE  14          2HD1      ILE  14   3.330  -3.143  -3.598
  114    H    ARG  15           H        ARG  15   2.481  -2.830  -6.245
  115    HA   ARG  15           HA       ARG  15   0.307  -1.997  -8.072
  116    HB2  ARG  15           2HB      ARG  15   2.909  -3.387  -8.754
  117    HB3  ARG  15           1HB      ARG  15   1.647  -2.967  -9.904
  118    HG2  ARG  15           2HG      ARG  15   2.004  -0.608  -9.501
  119    HG3  ARG  15           1HG      ARG  15   3.173  -0.969  -8.233
  120    HD2  ARG  15           2HD      ARG  15   4.341  -0.350 -10.251
  121    HD3  ARG  15           1HD      ARG  15   4.625  -2.057  -9.907
  122    HE   ARG  15           HE       ARG  15   2.444  -1.643 -11.719
  123   HH11  ARG  15          1HH1      ARG  15   5.876  -1.924 -11.474
  124   HH12  ARG  15          2HH1      ARG  15   6.069  -2.324 -13.143
  125   HH21  ARG  15          1HH2      ARG  15   2.720  -2.191 -13.861
  126   HH22  ARG  15          2HH2      ARG  15   4.307  -2.522 -14.462
  127    H    ARG  16           H        ARG  16  -0.638  -3.728  -9.403
  128    HA   ARG  16           HA       ARG  16  -1.642  -5.725  -9.780
  129    HB2  ARG  16           2HB      ARG  16   0.376  -6.827  -7.822
  130    HB3  ARG  16           1HB      ARG  16  -0.741  -7.808  -8.760
  131    HG2  ARG  16           2HG      ARG  16   0.300  -6.982 -10.831
  132    HG3  ARG  16           1HG      ARG  16   1.449  -6.049  -9.868
  133    HD2  ARG  16           2HD      ARG  16   2.210  -8.158  -8.808
  134    HD3  ARG  16           1HD      ARG  16   1.122  -9.052  -9.868
  135    HE   ARG  16           HE       ARG  16   2.694  -7.565 -11.548
  136   HH11  ARG  16          1HH1      ARG  16   3.305  -9.913  -9.090
  137   HH12  ARG  16          2HH1      ARG  16   4.737 -10.499  -9.861
  138   HH21  ARG  16          1HH2      ARG  16   4.525  -8.351 -12.520
  139   HH22  ARG  16          2HH2      ARG  16   5.406  -9.643 -11.775
  140    H    LEU  17           H        LEU  17  -2.542  -3.876  -7.717
  141    HA   LEU  17           HA       LEU  17  -3.776  -5.648  -5.731
  142    HB2  LEU  17           2HB      LEU  17  -3.364  -2.692  -5.911
  143    HB3  LEU  17           1HB      LEU  17  -4.701  -3.287  -4.950
  144    HG   LEU  17           HG       LEU  17  -2.719  -2.828  -3.578
  145   HD11  LEU  17          1HD1      LEU  17  -2.640  -4.945  -2.375
  146   HD12  LEU  17          2HD1      LEU  17  -3.375  -5.771  -3.749
  147   HD13  LEU  17          3HD1      LEU  17  -4.291  -4.552  -2.861
  148   HD21  LEU  17          3HD2      LEU  17  -0.983  -3.277  -5.222
  149   HD22  LEU  17          1HD2      LEU  17  -1.399  -4.991  -5.222
  150   HD23  LEU  17          2HD2      LEU  17  -0.727  -4.245  -3.772
  151    HA   PRO  18           HA       PRO  18  -7.594  -5.314  -8.199
  152    HB2  PRO  18           2HB      PRO  18  -8.667  -7.656  -7.408
  153    HB3  PRO  18           1HB      PRO  18  -7.405  -7.590  -8.646
  154    HG2  PRO  18           2HG      PRO  18  -7.170  -8.257  -5.733
  155    HG3  PRO  18           1HG      PRO  18  -6.406  -9.047  -7.127
  156    HD2  PRO  18           2HD      PRO  18  -5.139  -7.204  -5.522
  157    HD3  PRO  18           1HD      PRO  18  -4.703  -7.507  -7.216
  158    HA   PRO  19           HA       PRO  19  -9.913  -3.455  -4.860
  159    HB2  PRO  19           2HB      PRO  19 -12.333  -4.206  -6.419
  160    HB3  PRO  19           1HB      PRO  19 -11.808  -2.618  -5.848
  161    HG2  PRO  19           2HG      PRO  19 -11.610  -3.275  -8.430
  162    HG3  PRO  19           1HG      PRO  19 -10.349  -2.312  -7.633
  163    HD2  PRO  19           2HD      PRO  19 -10.348  -5.225  -8.350
  164    HD3  PRO  19           1HD      PRO  19  -9.033  -4.034  -8.460
  165    H    GLY  20           H        GLY  20 -10.290  -4.399  -2.938
  166    HA2  GLY  20           2HA      GLY  20 -12.275  -6.527  -2.725
  167    HA3  GLY  20           1HA      GLY  20 -10.644  -6.954  -2.231
  168    H    LEU  21           H        LEU  21 -10.138  -6.632  -0.148
  169    HA   LEU  21           HA       LEU  21 -11.989  -5.618   1.709
  170    HB2  LEU  21           2HB      LEU  21 -10.318  -5.898   3.395
  171    HB3  LEU  21           1HB      LEU  21 -10.208  -7.240   2.278
  172    HG   LEU  21           HG       LEU  21  -8.333  -4.868   2.335
  173   HD11  LEU  21          1HD1      LEU  21  -8.088  -6.268   4.317
  174   HD12  LEU  21          2HD1      LEU  21  -6.691  -6.431   3.254
  175   HD13  LEU  21          3HD1      LEU  21  -7.918  -7.699   3.298
  176   HD21  LEU  21          3HD2      LEU  21  -6.936  -6.220   0.821
  177   HD22  LEU  21          1HD2      LEU  21  -8.492  -5.805   0.101
  178   HD23  LEU  21          2HD2      LEU  21  -8.218  -7.428   0.737
  179    H    THR  22           H        THR  22 -11.708  -3.793   3.205
  180    HA   THR  22           HA       THR  22 -11.232  -1.364   1.699
  181    HB   THR  22           HB       THR  22 -12.153  -1.723   4.571
  182    HG1  THR  22           HG1      THR  22 -13.582  -2.526   2.861
  183   HG21  THR  22          3HG2      THR  22 -11.190   0.508   4.194
  184   HG22  THR  22          1HG2      THR  22 -12.937   0.593   4.425
  185   HG23  THR  22          2HG2      THR  22 -12.254   0.730   2.805
  186    H    LYS  23           H        LYS  23  -9.832   0.363   2.382
  187    HA   LYS  23           HA       LYS  23  -7.227  -0.214   2.869
  188    HB2  LYS  23           2HB      LYS  23  -6.904   2.114   3.593
  189    HB3  LYS  23           1HB      LYS  23  -7.936   2.001   2.174
  190    HG2  LYS  23           2HG      LYS  23  -9.870   2.536   3.393
  191    HG3  LYS  23           1HG      LYS  23  -9.087   2.211   4.942
  192    HD2  LYS  23           2HD      LYS  23  -8.343   4.470   3.070
  193    HD3  LYS  23           1HD      LYS  23  -9.380   4.635   4.490
  194    HE2  LYS  23           2HE      LYS  23  -7.515   3.836   5.904
  195    HE3  LYS  23           1HE      LYS  23  -6.487   3.757   4.475
  196    HZ1  LYS  23           3HZ      LYS  23  -6.110   5.781   5.715
  197    HZ2  LYS  23           1HZ      LYS  23  -7.739   6.216   5.580
  198    HZ3  LYS  23           2HZ      LYS  23  -6.767   6.146   4.200
  199    H    GLU  24           H        GLU  24  -9.723   0.065   5.311
  200    HA   GLU  24           HA       GLU  24  -8.365   0.480   7.651
  201    HB2  GLU  24           2HB      GLU  24 -10.558  -1.573   7.298
  202    HB3  GLU  24           1HB      GLU  24 -10.154  -0.702   8.772
  203    HG2  GLU  24           2HG      GLU  24 -10.854   1.395   7.746
  204    HG3  GLU  24           1HG      GLU  24 -11.217   0.549   6.243
  205    H    GLN  25           H        GLN  25  -8.856  -2.688   6.083
  206    HA   GLN  25           HA       GLN  25  -6.792  -3.863   7.847
  207    HB2  GLN  25           2HB      GLN  25  -8.780  -5.290   6.055
  208    HB3  GLN  25           1HB      GLN  25  -7.747  -6.020   7.280
  209    HG2  GLN  25           2HG      GLN  25  -8.966  -4.839   9.032
  210    HG3  GLN  25           1HG      GLN  25  -9.976  -4.059   7.813
  211   HE21  GLN  25          1HE2      GLN  25 -11.554  -5.265   6.761
  212   HE22  GLN  25          2HE2      GLN  25 -12.071  -6.809   7.335
  213    H    LEU  26           H        LEU  26  -7.230  -2.675   4.732
  214    HA   LEU  26           HA       LEU  26  -5.449  -4.478   3.349
  215    HB2  LEU  26           2HB      LEU  26  -7.155  -3.578   2.022
  216    HB3  LEU  26           1HB      LEU  26  -6.915  -1.959   2.631
  217    HG   LEU  26           HG       LEU  26  -4.731  -1.891   1.380
  218   HD11  LEU  26          1HD1      LEU  26  -4.311  -4.280   1.190
  219   HD12  LEU  26          2HD1      LEU  26  -4.374  -3.537  -0.406
  220   HD13  LEU  26          3HD1      LEU  26  -5.749  -4.474   0.184
  221   HD21  LEU  26          3HD2      LEU  26  -7.203  -2.385  -0.285
  222   HD22  LEU  26          1HD2      LEU  26  -5.761  -1.507  -0.797
  223   HD23  LEU  26          2HD2      LEU  26  -6.772  -0.865   0.497
  224    H    GLU  27           H        GLU  27  -5.178  -1.333   4.920
  225    HA   GLU  27           HA       GLU  27  -2.671  -0.619   3.758
  226    HB2  GLU  27           2HB      GLU  27  -2.634   1.211   5.348
  227    HB3  GLU  27           1HB      GLU  27  -4.255   1.049   4.688
  228    HG2  GLU  27           2HG      GLU  27  -5.010  -0.056   6.705
  229    HG3  GLU  27           1HG      GLU  27  -3.376  -0.029   7.362
  230    H    GLU  28           H        GLU  28  -3.563  -2.409   6.651
  231    HA   GLU  28           HA       GLU  28  -1.388  -1.920   8.269
  232    HB2  GLU  28           2HB      GLU  28  -1.935  -3.990   9.445
  233    HB3  GLU  28           1HB      GLU  28  -3.377  -3.071   9.052
  234    HG2  GLU  28           2HG      GLU  28  -3.966  -4.576   7.312
  235    HG3  GLU  28           1HG      GLU  28  -2.403  -5.387   7.396
  236    H    GLN  29           H        GLN  29  -1.615  -4.545   5.832
  237    HA   GLN  29           HA       GLN  29   1.104  -5.375   6.396
  238    HB2  GLN  29           2HB      GLN  29   0.781  -6.960   4.487
  239    HB3  GLN  29           1HB      GLN  29  -0.379  -7.141   5.792
  240    HG2  GLN  29           2HG      GLN  29  -1.127  -5.436   3.459
  241    HG3  GLN  29           1HG      GLN  29  -1.117  -7.188   3.263
  242   HE21  GLN  29          1HE2      GLN  29  -3.351  -5.284   3.251
  243   HE22  GLN  29          2HE2      GLN  29  -4.437  -5.850   4.470
  244    H    LEU  30           H        LEU  30  -0.267  -2.958   4.468
  245    HA   LEU  30           HA       LEU  30   1.894  -2.953   2.509
  246    HB2  LEU  30           2HB      LEU  30  -0.451  -1.078   2.868
  247    HB3  LEU  30           1HB      LEU  30   0.718  -0.986   1.562
  248    HG   LEU  30           HG       LEU  30  -1.227  -3.252   2.061
  249   HD11  LEU  30          1HD1      LEU  30  -2.292  -1.248   1.163
  250   HD12  LEU  30          2HD1      LEU  30  -2.248  -2.534  -0.041
  251   HD13  LEU  30          3HD1      LEU  30  -1.109  -1.192  -0.146
  252   HD21  LEU  30          3HD2      LEU  30   0.831  -2.912  -0.129
  253   HD22  LEU  30          1HD2      LEU  30  -0.405  -4.172  -0.066
  254   HD23  LEU  30          2HD2      LEU  30   0.860  -4.117   1.160
  255    H    ARG  31           H        ARG  31   1.178  -1.486   5.559
  256    HA   ARG  31           HA       ARG  31   3.598   0.163   5.246
  257    HB2  ARG  31           2HB      ARG  31   2.482   1.935   6.667
  258    HB3  ARG  31           1HB      ARG  31   1.885   1.766   5.028
  259    HG2  ARG  31           2HG      ARG  31  -0.040   2.060   6.289
  260    HG3  ARG  31           1HG      ARG  31   0.031   0.320   6.046
  261    HD2  ARG  31           2HD      ARG  31   0.857  -0.024   8.278
  262    HD3  ARG  31           1HD      ARG  31   1.039   1.713   8.528
  263    HE   ARG  31           HE       ARG  31  -1.568   1.567   8.055
  264   HH11  ARG  31          1HH1      ARG  31   0.404  -0.399  10.095
  265   HH12  ARG  31          2HH1      ARG  31  -0.889  -0.742  11.186
  266   HH21  ARG  31          1HH2      ARG  31  -3.198   1.127   9.463
  267   HH22  ARG  31          2HH2      ARG  31  -2.913   0.098  10.824
  268    HA   PRO  32           HA       PRO  32   3.408  -2.183   9.392
  269    HB2  PRO  32           2HB      PRO  32   4.779  -4.433   8.940
  270    HB3  PRO  32           1HB      PRO  32   3.081  -4.292   8.464
  271    HG2  PRO  32           2HG      PRO  32   5.547  -4.014   6.778
  272    HG3  PRO  32           1HG      PRO  32   4.045  -4.889   6.421
  273    HD2  PRO  32           2HD      PRO  32   4.622  -2.359   5.490
  274    HD3  PRO  32           1HD      PRO  32   2.976  -2.988   5.703
  275    H    LEU  33           H        LEU  33   5.202  -0.118   8.381
  276    HA   LEU  33           HA       LEU  33   7.897  -1.009   9.057
  277    HB2  LEU  33           2HB      LEU  33   6.849   1.608   7.979
  278    HB3  LEU  33           1HB      LEU  33   8.532   1.331   8.374
  279    HG   LEU  33           HG       LEU  33   8.496  -0.555   6.671
  280   HD11  LEU  33          1HD1      LEU  33   6.774  -0.434   4.928
  281   HD12  LEU  33          2HD1      LEU  33   5.891   0.752   5.891
  282   HD13  LEU  33          3HD1      LEU  33   6.104  -0.893   6.493
  283   HD21  LEU  33          3HD2      LEU  33   8.775   0.973   4.784
  284   HD22  LEU  33          1HD2      LEU  33   9.551   1.595   6.240
  285   HD23  LEU  33          2HD2      LEU  33   8.008   2.264   5.708
  286    HA   PRO  34           HA       PRO  34   8.039   0.659  13.162
  287    HB2  PRO  34           2HB      PRO  34  10.597   1.609  13.294
  288    HB3  PRO  34           1HB      PRO  34  10.196  -0.112  13.334
  289    HG2  PRO  34           2HG      PRO  34  11.116   1.568  11.021
  290    HG3  PRO  34           1HG      PRO  34  11.637  -0.060  11.492
  291    HD2  PRO  34           2HD      PRO  34   9.869   0.358   9.499
  292    HD3  PRO  34           1HD      PRO  34   9.774  -1.065  10.558
  293    H    ALA  35           H        ALA  35  10.043   2.980  11.295
  294    HA   ALA  35           HA       ALA  35   8.232   5.153  12.146
  295    HB1  ALA  35           3HB      ALA  35  10.179   6.605  12.514
  296    HB2  ALA  35           1HB      ALA  35  11.256   5.258  12.142
  297    HB3  ALA  35           2HB      ALA  35  10.220   5.190  13.567
  298    H    HIS  36           H        HIS  36   7.368   6.072  10.395
  299    HA   HIS  36           HA       HIS  36   8.843   6.791   8.047
  300    HB2  HIS  36           2HB      HIS  36   7.845   5.214   6.483
  301    HB3  HIS  36           1HB      HIS  36   8.670   4.309   7.750
  302    HD1  HIS  36           HD1      HIS  36   5.605   4.310   5.944
  303    HD2  HIS  36           HD2      HIS  36   6.628   3.595   9.911
  304    HE1  HIS  36           HE1      HIS  36   3.686   3.020   6.918
  305    HE2  HIS  36           HE2      HIS  36   4.242   2.769   9.359
  306    H    ASP  37           H        ASP  37   6.932   6.894   6.142
  307    HA   ASP  37           HA       ASP  37   4.461   7.965   7.341
  308    HB2  ASP  37           2HB      ASP  37   5.979   9.796   6.537
  309    HB3  ASP  37           1HB      ASP  37   5.905   9.103   4.923
  310    H    TYR  38           H        TYR  38   2.640   7.956   5.645
  311    HA   TYR  38           HA       TYR  38   2.981   6.024   3.489
  312    HB2  TYR  38           2HB      TYR  38   0.914   4.757   4.248
  313    HB3  TYR  38           1HB      TYR  38   2.371   4.490   5.195
  314    HD1  TYR  38           HD2      TYR  38   2.535   5.296   7.493
  315    HD2  TYR  38           HD1      TYR  38  -1.007   5.936   5.210
  316    HE1  TYR  38           HE2      TYR  38   1.314   5.858   9.550
  317    HE2  TYR  38           HE1      TYR  38  -2.231   6.497   7.265
  318    HH   TYR  38           HH       TYR  38  -2.096   6.130   9.648
  319    H    PHE  39           H        PHE  39   1.322   6.099   1.893
  320    HA   PHE  39           HA       PHE  39   0.053   8.752   1.834
  321    HB2  PHE  39           2HB      PHE  39   1.734   7.575   0.039
  322    HB3  PHE  39           1HB      PHE  39   0.177   7.127  -0.643
  323    HD1  PHE  39           HD2      PHE  39   2.137  10.051   0.546
  324    HD2  PHE  39           HD1      PHE  39  -0.999   8.658  -1.980
  325    HE1  PHE  39           HE2      PHE  39   1.988  12.276  -0.496
  326    HE2  PHE  39           HE1      PHE  39  -1.146  10.879  -3.025
  327    HZ   PHE  39           HZ       PHE  39   0.346  12.693  -2.282
  328    H    GLU  40           H        GLU  40  -1.730   7.974  -0.410
  329    HA   GLU  40           HA       GLU  40  -3.960   7.250   1.220
  330    HB2  GLU  40           2HB      GLU  40  -5.311   7.543  -0.781
  331    HB3  GLU  40           1HB      GLU  40  -4.188   8.879  -0.588
  332    HG2  GLU  40           2HG      GLU  40  -2.745   7.969  -2.309
  333    HG3  GLU  40           1HG      GLU  40  -3.774   6.544  -2.451
  334    H    PHE  41           H        PHE  41  -5.173   5.430   1.286
  335    HA   PHE  41           HA       PHE  41  -4.380   3.137  -0.406
  336    HB2  PHE  41           2HB      PHE  41  -5.394   3.070   2.457
  337    HB3  PHE  41           1HB      PHE  41  -5.090   1.653   1.461
  338    HD1  PHE  41           HD1      PHE  41  -2.771   1.045   0.838
  339    HD2  PHE  41           HD2      PHE  41  -3.611   4.242   3.532
  340    HE1  PHE  41           HE1      PHE  41  -0.431   1.022   1.598
  341    HE2  PHE  41           HE2      PHE  41  -1.273   4.213   4.293
  342    HZ   PHE  41           HZ       PHE  41   0.321   2.607   3.326
  343    H    PHE  42           H        PHE  42  -5.987   2.304  -1.637
  344    HA   PHE  42           HA       PHE  42  -8.429   3.741  -1.821
  345    HB2  PHE  42           2HB      PHE  42  -8.984   2.282  -3.675
  346    HB3  PHE  42           1HB      PHE  42  -7.302   2.774  -3.792
  347    HD1  PHE  42           HD2      PHE  42  -5.491   1.108  -3.196
  348    HD2  PHE  42           HD1      PHE  42  -9.600   0.006  -3.541
  349    HE1  PHE  42           HE2      PHE  42  -4.841  -1.251  -3.416
  350    HE2  PHE  42           HE1      PHE  42  -8.945  -2.354  -3.760
  351    HZ   PHE  42           HZ       PHE  42  -6.564  -2.984  -3.700
  352    H    ALA  43           H        ALA  43 -10.453   3.310  -1.124
  353    HA   ALA  43           HA       ALA  43 -10.862   0.964   0.595
  354    HB1  ALA  43           3HB      ALA  43 -11.409   3.184   1.513
  355    HB2  ALA  43           1HB      ALA  43 -12.822   2.131   1.442
  356    HB3  ALA  43           2HB      ALA  43 -12.611   3.405   0.242
  357    H    ALA  44           H        ALA  44 -11.755  -0.800  -0.316
  358    HA   ALA  44           HA       ALA  44 -13.801  -0.432  -2.418
  359    HB1  ALA  44           3HB      ALA  44 -11.695  -1.123  -3.447
  360    HB2  ALA  44           1HB      ALA  44 -12.915  -2.387  -3.591
  361    HB3  ALA  44           2HB      ALA  44 -11.629  -2.535  -2.392
  362    H    ASP  45           H        ASP  45 -14.863  -2.744  -2.824
  363    HA   ASP  45           HA       ASP  45 -15.471  -3.977  -0.214
  364    HB2  ASP  45           2HB      ASP  45 -17.321  -2.514  -0.975
  365    HB3  ASP  45           1HB      ASP  45 -17.427  -3.442  -2.469
  366    H    LEU  46           H        LEU  46 -15.656  -6.210  -0.185
  367    HA   LEU  46           HA       LEU  46 -14.433  -7.546  -2.472
  368    HB2  LEU  46           2HB      LEU  46 -14.311  -9.502  -0.838
  369    HB3  LEU  46           1HB      LEU  46 -13.339  -8.086  -0.494
  370    HG   LEU  46           HG       LEU  46 -15.164  -7.363   1.123
  371   HD11  LEU  46          1HD1      LEU  46 -16.093 -10.207   0.734
  372   HD12  LEU  46          2HD1      LEU  46 -16.984  -8.742   0.322
  373   HD13  LEU  46          3HD1      LEU  46 -16.631  -9.109   2.008
  374   HD21  LEU  46          3HD2      LEU  46 -14.379  -8.855   2.904
  375   HD22  LEU  46          1HD2      LEU  46 -13.055  -8.286   1.888
  376   HD23  LEU  46          2HD2      LEU  46 -13.673  -9.927   1.693
  377    H    SER  47           H        SER  47 -17.482  -6.811  -2.026
  378    HA   SER  47           HA       SER  47 -18.484  -9.407  -3.037
  379    HB2  SER  47           2HB      SER  47 -20.075  -7.461  -1.335
  380    HB3  SER  47           1HB      SER  47 -20.609  -9.042  -1.906
  381    HG   SER  47           HG       SER  47 -19.419 -10.010  -0.418
  382    H    LEU  48           H        LEU  48 -20.794  -8.979  -4.082
  383    HA   LEU  48           HA       LEU  48 -22.104  -7.995  -5.666
  384    HB2  LEU  48           2HB      LEU  48 -22.095  -6.116  -4.051
  385    HB3  LEU  48           1HB      LEU  48 -20.683  -5.450  -4.846
  386    HG   LEU  48           HG       LEU  48 -22.022  -5.109  -6.903
  387   HD11  LEU  48          1HD1      LEU  48 -23.660  -6.885  -6.593
  388   HD12  LEU  48          2HD1      LEU  48 -24.453  -5.328  -6.818
  389   HD13  LEU  48          3HD1      LEU  48 -24.341  -6.033  -5.205
  390   HD21  LEU  48          3HD2      LEU  48 -23.203  -3.856  -4.420
  391   HD22  LEU  48          1HD2      LEU  48 -23.353  -3.235  -6.064
  392   HD23  LEU  48          2HD2      LEU  48 -21.772  -3.293  -5.285
  393    H    TYR  49           H        TYR  49 -18.986  -8.545  -6.076
  394    HA   TYR  49           HA       TYR  49 -17.548  -8.699  -7.818
  395    HB2  TYR  49           2HB      TYR  49 -19.575  -9.341  -9.127
  396    HB3  TYR  49           1HB      TYR  49 -19.800  -7.650  -9.553
  397    HD1  TYR  49           HD2      TYR  49 -17.629 -10.602 -10.011
  398    HD2  TYR  49           HD1      TYR  49 -18.477  -6.623 -11.280
  399    HE1  TYR  49           HE2      TYR  49 -16.159 -10.915 -11.955
  400    HE2  TYR  49           HE1      TYR  49 -17.010  -6.928 -13.229
  401    HH   TYR  49           HH       TYR  49 -14.998  -8.428 -13.811
  402    HA   PRO  50           HA       PRO  50 -16.473  -4.250  -7.338
  403    HB2  PRO  50           2HB      PRO  50 -13.849  -4.693  -6.786
  404    HB3  PRO  50           1HB      PRO  50 -15.121  -4.801  -5.565
  405    HG2  PRO  50           2HG      PRO  50 -13.791  -7.001  -7.112
  406    HG3  PRO  50           1HG      PRO  50 -14.171  -6.926  -5.381
  407    HD2  PRO  50           2HD      PRO  50 -15.715  -8.282  -7.143
  408    HD3  PRO  50           1HD      PRO  50 -16.394  -7.466  -5.718
  409    H    HIS  51           H        HIS  51 -16.008  -2.997  -9.029
  410    HA   HIS  51           HA       HIS  51 -14.084  -3.902 -11.066
  411    HB2  HIS  51           2HB      HIS  51 -15.672  -3.023 -12.836
  412    HB3  HIS  51           1HB      HIS  51 -16.175  -4.507 -12.036
  413    HD1  HIS  51           HD1      HIS  51 -16.919  -0.787 -11.989
  414    HD2  HIS  51           HD2      HIS  51 -18.642  -4.394 -10.856
  415    HE1  HIS  51           HE1      HIS  51 -19.243  -0.216 -11.241
  416    HE2  HIS  51           HE2      HIS  51 -20.185  -2.375 -10.370
  417    H    LEU  52           H        LEU  52 -13.959  -1.863  -8.913
  418    HA   LEU  52           HA       LEU  52 -13.744   0.611 -10.484
  419    HB2  LEU  52           2HB      LEU  52 -13.542   1.805  -8.363
  420    HB3  LEU  52           1HB      LEU  52 -15.014   0.860  -8.434
  421    HG   LEU  52           HG       LEU  52 -12.549  -0.097  -6.960
  422   HD11  LEU  52          1HD1      LEU  52 -13.596   0.715  -4.903
  423   HD12  LEU  52          2HD1      LEU  52 -14.889   1.459  -5.847
  424   HD13  LEU  52          3HD1      LEU  52 -13.231   2.044  -6.000
  425   HD21  LEU  52          3HD2      LEU  52 -14.186  -1.829  -7.501
  426   HD22  LEU  52          1HD2      LEU  52 -15.466  -0.868  -6.761
  427   HD23  LEU  52          2HD2      LEU  52 -14.157  -1.512  -5.767
  428    H    TYR  53           H        TYR  53 -11.834   0.759 -11.491
  429    HA   TYR  53           HA       TYR  53  -9.455  -0.512 -10.613
  430    HB2  TYR  53           2HB      TYR  53  -8.352   0.751 -12.453
  431    HB3  TYR  53           1HB      TYR  53  -9.796  -0.107 -12.970
  432    HD1  TYR  53           HD1      TYR  53 -11.963   1.245 -13.216
  433    HD2  TYR  53           HD2      TYR  53  -8.130   3.073 -12.859
  434    HE1  TYR  53           HE1      TYR  53 -12.866   3.312 -14.185
  435    HE2  TYR  53           HE2      TYR  53  -9.028   5.149 -13.828
  436    HH   TYR  53           HH       TYR  53 -10.957   5.780 -15.361
  437    H    SER  54           H        SER  54  -8.295   0.061  -8.892
  438    HA   SER  54           HA       SER  54  -7.347   2.782  -8.588
  439    HB2  SER  54           2HB      SER  54  -9.205   1.544  -6.552
  440    HB3  SER  54           1HB      SER  54  -8.081   2.832  -6.127
  441    HG   SER  54           HG       SER  54  -9.794   3.174  -8.332
  442    H    ARG  55           H        ARG  55  -5.547   2.985  -7.210
  443    HA   ARG  55           HA       ARG  55  -4.447   0.479  -6.095
  444    HB2  ARG  55           2HB      ARG  55  -2.203   1.155  -6.857
  445    HB3  ARG  55           1HB      ARG  55  -3.306   0.937  -8.211
  446    HG2  ARG  55           2HG      ARG  55  -3.634   3.387  -8.294
  447    HG3  ARG  55           1HG      ARG  55  -2.447   3.565  -7.002
  448    HD2  ARG  55           2HD      ARG  55  -0.748   2.505  -8.450
  449    HD3  ARG  55           1HD      ARG  55  -1.942   2.392  -9.744
  450    HE   ARG  55           HE       ARG  55  -1.657   5.059  -8.777
  451   HH11  ARG  55          1HH1      ARG  55  -0.213   2.737 -10.889
  452   HH12  ARG  55          2HH1      ARG  55   0.532   3.957 -11.866
  453   HH21  ARG  55          1HH2      ARG  55  -0.694   6.576 -10.014
  454   HH22  ARG  55          2HH2      ARG  55   0.256   6.105 -11.383
  455    H    ALA  56           H        ALA  56  -2.239   1.285  -4.837
  456    HA   ALA  56           HA       ALA  56  -3.023   3.556  -3.118
  457    HB1  ALA  56           3HB      ALA  56  -2.311   2.336  -1.140
  458    HB2  ALA  56           1HB      ALA  56  -1.884   0.936  -2.127
  459    HB3  ALA  56           2HB      ALA  56  -3.569   1.439  -1.988
  460    H    TYR  57           H        TYR  57  -1.203   4.483  -1.864
  461    HA   TYR  57           HA       TYR  57   1.402   4.147  -3.226
  462    HB2  TYR  57           2HB      TYR  57   0.124   6.760  -2.380
  463    HB3  TYR  57           1HB      TYR  57   1.748   6.593  -3.033
  464    HD1  TYR  57           HD1      TYR  57  -1.836   6.544  -3.812
  465    HD2  TYR  57           HD2      TYR  57   2.091   6.180  -5.410
  466    HE1  TYR  57           HE1      TYR  57  -2.738   6.838  -6.078
  467    HE2  TYR  57           HE2      TYR  57   1.201   6.467  -7.685
  468    HH   TYR  57           HH       TYR  57  -1.968   7.575  -8.282
  469    H    ILE  58           H        ILE  58   3.276   4.607  -1.968
  470    HA   ILE  58           HA       ILE  58   2.873   4.915   0.942
  471    HB   ILE  58           HB       ILE  58   4.871   2.978  -0.258
  472   HG12  ILE  58          2HG1      ILE  58   2.228   2.317   1.084
  473   HG13  ILE  58          1HG1      ILE  58   2.510   2.246  -0.652
  474   HG21  ILE  58          1HG2      ILE  58   5.094   2.180   2.056
  475   HG22  ILE  58          2HG2      ILE  58   3.933   3.398   2.589
  476   HG23  ILE  58          3HG2      ILE  58   5.489   3.895   1.925
  477   HD11  ILE  58          3HD1      ILE  58   4.168   0.503  -0.325
  478   HD12  ILE  58          1HD1      ILE  58   2.617   0.046   0.379
  479   HD13  ILE  58          2HD1      ILE  58   3.931   0.591   1.421
  480    H    ASN  59           H        ASN  59   4.075   6.572   1.708
  481    HA   ASN  59           HA       ASN  59   6.323   7.534   0.065
  482    HB2  ASN  59           2HB      ASN  59   4.419   9.103   0.503
  483    HB3  ASN  59           1HB      ASN  59   4.822   9.048   2.217
  484   HD21  ASN  59          1HD2      ASN  59   6.880   9.869   2.868
  485   HD22  ASN  59          2HD2      ASN  59   7.677  11.071   1.920
  486    H    PHE  60           H        PHE  60   8.105   6.440   0.814
  487    HA   PHE  60           HA       PHE  60   8.614   5.946   3.583
  488    HB2  PHE  60           2HB      PHE  60  10.351   5.759   1.121
  489    HB3  PHE  60           1HB      PHE  60  10.946   5.360   2.729
  490    HD1  PHE  60           HD2      PHE  60   8.110   4.534   0.440
  491    HD2  PHE  60           HD1      PHE  60  10.817   3.159   3.422
  492    HE1  PHE  60           HE2      PHE  60   7.237   2.250   0.180
  493    HE2  PHE  60           HE1      PHE  60   9.948   0.876   3.164
  494    HZ   PHE  60           HZ       PHE  60   8.156   0.416   1.539
  495    H    ARG  61           H        ARG  61  10.604   6.724   4.723
  496    HA   ARG  61           HA       ARG  61  11.248   9.537   4.070
  497    HB2  ARG  61           2HB      ARG  61  10.568   8.425   6.805
  498    HB3  ARG  61           1HB      ARG  61  11.190  10.043   6.514
  499    HG2  ARG  61           2HG      ARG  61   8.570   8.955   5.479
  500    HG3  ARG  61           1HG      ARG  61   8.766  10.036   6.859
  501    HD2  ARG  61           2HD      ARG  61   9.704  11.755   5.382
  502    HD3  ARG  61           1HD      ARG  61   9.529  10.671   4.002
  503    HE   ARG  61           HE       ARG  61   7.021  10.919   5.166
  504   HH11  ARG  61          1HH1      ARG  61   9.293  12.973   3.577
  505   HH12  ARG  61          2HH1      ARG  61   8.064  14.022   2.960
  506   HH21  ARG  61          1HH2      ARG  61   5.467  12.251   4.333
  507   HH22  ARG  61          2HH2      ARG  61   5.933  13.615   3.373
  508    H    ASN  62           H        ASN  62  12.622   6.755   3.967
  509    HA   ASN  62           HA       ASN  62  15.232   7.668   4.896
  510    HB2  ASN  62           2HB      ASN  62  14.048   6.454   6.809
  511    HB3  ASN  62           1HB      ASN  62  14.107   5.003   5.821
  512   HD21  ASN  62          1HD2      ASN  62  15.402   3.858   7.189
  513   HD22  ASN  62          2HD2      ASN  62  17.053   4.261   7.499
  514    HA   PRO  63           HA       PRO  63  16.154   5.276   1.159
  515    HB2  PRO  63           2HB      PRO  63  18.849   5.363   1.180
  516    HB3  PRO  63           1HB      PRO  63  17.869   6.782   0.805
  517    HG2  PRO  63           2HG      PRO  63  19.214   6.040   3.379
  518    HG3  PRO  63           1HG      PRO  63  19.137   7.619   2.575
  519    HD2  PRO  63           2HD      PRO  63  17.521   6.909   4.663
  520    HD3  PRO  63           1HD      PRO  63  17.047   8.083   3.422
  521    H    ASP  64           H        ASP  64  16.681   4.201   4.294
  522    HA   ASP  64           HA       ASP  64  17.997   1.704   3.461
  523    HB2  ASP  64           2HB      ASP  64  17.690   2.997   6.172
  524    HB3  ASP  64           1HB      ASP  64  18.323   1.367   5.945
  525    H    ASP  65           H        ASP  65  15.014   2.844   5.056
  526    HA   ASP  65           HA       ASP  65  14.128   0.177   5.664
  527    HB2  ASP  65           2HB      ASP  65  11.990   1.199   6.276
  528    HB3  ASP  65           1HB      ASP  65  13.331   2.074   7.000
  529    H    ILE  66           H        ILE  66  13.733   2.413   3.000
  530    HA   ILE  66           HA       ILE  66  11.848   1.220   1.405
  531    HB   ILE  66           HB       ILE  66  14.531   2.311   0.507
  532   HG12  ILE  66          2HG1      ILE  66  11.811   3.641   0.692
  533   HG13  ILE  66          1HG1      ILE  66  13.169   3.930   1.775
  534   HG21  ILE  66          1HG2      ILE  66  13.455   2.647  -1.685
  535   HG22  ILE  66          2HG2      ILE  66  12.020   1.805  -1.097
  536   HG23  ILE  66          3HG2      ILE  66  13.550   0.941  -1.245
  537   HD11  ILE  66          3HD1      ILE  66  12.949   5.710   0.149
  538   HD12  ILE  66          1HD1      ILE  66  13.092   4.551  -1.171
  539   HD13  ILE  66          2HD1      ILE  66  14.461   4.834  -0.093
  540    H    LEU  67           H        LEU  67  15.343   0.439   1.146
  541    HA   LEU  67           HA       LEU  67  14.899  -1.837  -0.478
  542    HB2  LEU  67           2HB      LEU  67  17.301  -2.347  -0.062
  543    HB3  LEU  67           1HB      LEU  67  16.993  -0.727  -0.648
  544    HG   LEU  67           HG       LEU  67  17.120  -0.055   1.882
  545   HD11  LEU  67          1HD1      LEU  67  18.670  -1.426   3.190
  546   HD12  LEU  67          2HD1      LEU  67  18.668  -2.647   1.918
  547   HD13  LEU  67          3HD1      LEU  67  17.187  -2.303   2.811
  548   HD21  LEU  67          3HD2      LEU  67  18.685   0.694   0.169
  549   HD22  LEU  67          1HD2      LEU  67  19.588  -0.816   0.311
  550   HD23  LEU  67          2HD2      LEU  67  19.529   0.311   1.668
  551    H    LEU  68           H        LEU  68  15.163  -1.440   3.000
  552    HA   LEU  68           HA       LEU  68  15.464  -4.108   3.779
  553    HB2  LEU  68           2HB      LEU  68  15.680  -2.401   5.418
  554    HB3  LEU  68           1HB      LEU  68  14.084  -1.766   5.075
  555    HG   LEU  68           HG       LEU  68  13.055  -3.767   6.070
  556   HD11  LEU  68          1HD1      LEU  68  15.902  -4.574   6.707
  557   HD12  LEU  68          2HD1      LEU  68  14.802  -5.398   5.600
  558   HD13  LEU  68          3HD1      LEU  68  14.452  -5.362   7.327
  559   HD21  LEU  68          3HD2      LEU  68  13.465  -1.805   7.471
  560   HD22  LEU  68          1HD2      LEU  68  15.066  -2.419   7.886
  561   HD23  LEU  68          2HD2      LEU  68  13.623  -3.293   8.403
  562    H    PHE  69           H        PHE  69  12.397  -2.275   3.612
  563    HA   PHE  69           HA       PHE  69  10.834  -4.641   3.947
  564    HB2  PHE  69           2HB      PHE  69  10.253  -1.745   3.542
  565    HB3  PHE  69           1HB      PHE  69   8.953  -2.902   3.252
  566    HD1  PHE  69           HD1      PHE  69  11.327  -1.631   5.805
  567    HD2  PHE  69           HD2      PHE  69   7.866  -3.996   5.039
  568    HE1  PHE  69           HE1      PHE  69  10.901  -1.788   8.221
  569    HE2  PHE  69           HE2      PHE  69   7.435  -4.151   7.447
  570    HZ   PHE  69           HZ       PHE  69   8.949  -3.047   9.048
  571    H    ARG  70           H        ARG  70  11.834  -2.775   1.119
  572    HA   ARG  70           HA       ARG  70  10.173  -3.909  -0.808
  573    HB2  ARG  70           2HB      ARG  70  11.704  -2.090  -1.343
  574    HB3  ARG  70           1HB      ARG  70  13.093  -3.118  -1.033
  575    HG2  ARG  70           2HG      ARG  70  11.151  -3.924  -3.160
  576    HG3  ARG  70           1HG      ARG  70  12.285  -2.616  -3.490
  577    HD2  ARG  70           2HD      ARG  70  14.166  -4.051  -3.119
  578    HD3  ARG  70           1HD      ARG  70  13.141  -5.333  -2.476
  579    HE   ARG  70           HE       ARG  70  12.715  -4.514  -5.248
  580   HH11  ARG  70          1HH1      ARG  70  14.093  -6.795  -3.063
  581   HH12  ARG  70          2HH1      ARG  70  14.118  -8.067  -4.235
  582   HH21  ARG  70          1HH2      ARG  70  12.759  -6.148  -6.741
  583   HH22  ARG  70          2HH2      ARG  70  13.380  -7.701  -6.291
  584    H    ASP  71           H        ASP  71  13.159  -5.193   0.614
  585    HA   ASP  71           HA       ASP  71  13.476  -7.414  -1.082
  586    HB2  ASP  71           2HB      ASP  71  15.221  -6.473   0.432
  587    HB3  ASP  71           1HB      ASP  71  14.359  -7.166   1.804
  588    H    ARG  72           H        ARG  72  11.282  -6.914   1.553
  589    HA   ARG  72           HA       ARG  72  10.543  -9.779   1.528
  590    HB2  ARG  72           2HB      ARG  72   9.476  -9.332   3.748
  591    HB3  ARG  72           1HB      ARG  72  11.225  -9.151   3.731
  592    HG2  ARG  72           2HG      ARG  72  11.093  -6.797   3.828
  593    HG3  ARG  72           1HG      ARG  72   9.374  -6.796   3.427
  594    HD2  ARG  72           2HD      ARG  72  10.558  -7.930   5.968
  595    HD3  ARG  72           1HD      ARG  72   9.817  -6.335   5.821
  596    HE   ARG  72           HE       ARG  72   8.150  -8.553   5.000
  597   HH11  ARG  72          1HH1      ARG  72   9.036  -6.476   7.615
  598   HH12  ARG  72          2HH1      ARG  72   7.545  -6.732   8.452
  599   HH21  ARG  72          1HH2      ARG  72   6.256  -8.848   6.065
  600   HH22  ARG  72          2HH2      ARG  72   5.990  -8.068   7.589
  601    H    PHE  73           H        PHE  73   9.613  -7.121   0.028
  602    HA   PHE  73           HA       PHE  73   6.786  -7.929  -0.046
  603    HB2  PHE  73           2HB      PHE  73   7.833  -5.174   0.546
  604    HB3  PHE  73           1HB      PHE  73   6.280  -5.400  -0.241
  605    HD1  PHE  73           HD1      PHE  73   4.636  -7.046   0.959
  606    HD2  PHE  73           HD2      PHE  73   7.905  -5.105   2.890
  607    HE1  PHE  73           HE1      PHE  73   3.545  -7.377   3.136
  608    HE2  PHE  73           HE2      PHE  73   6.813  -5.440   5.065
  609    HZ   PHE  73           HZ       PHE  73   4.634  -6.574   5.191
  610    H    ASP  74           H        ASP  74   9.331  -7.877  -1.794
  611    HA   ASP  74           HA       ASP  74   8.952  -6.185  -3.995
  612    HB2  ASP  74           2HB      ASP  74  10.528  -7.690  -5.167
  613    HB3  ASP  74           1HB      ASP  74  11.078  -7.255  -3.553
  614    H    GLY  75           H        GLY  75   6.995  -8.743  -3.098
  615    HA2  GLY  75           2HA      GLY  75   5.077  -8.645  -4.934
  616    HA3  GLY  75           1HA      GLY  75   6.286  -9.575  -5.806
  617    H    TYR  76           H        TYR  76   4.063  -9.562  -3.093
  618    HA   TYR  76           HA       TYR  76   4.442 -12.490  -2.839
  619    HB2  TYR  76           2HB      TYR  76   4.248 -12.389  -0.492
  620    HB3  TYR  76           1HB      TYR  76   5.317 -11.055  -0.905
  621    HD1  TYR  76           HD1      TYR  76   4.096  -8.717  -1.240
  622    HD2  TYR  76           HD2      TYR  76   2.492 -11.988   0.968
  623    HE1  TYR  76           HE1      TYR  76   2.625  -7.171  -0.016
  624    HE2  TYR  76           HE2      TYR  76   1.021 -10.449   2.190
  625    HH   TYR  76           HH       TYR  76   0.989  -8.026   2.789
  626    H    ILE  77           H        ILE  77   2.580 -13.729  -2.207
  627    HA   ILE  77           HA       ILE  77   0.050 -12.615  -3.158
  628    HB   ILE  77           HB       ILE  77   0.797 -15.434  -2.334
  629   HG12  ILE  77          2HG1      ILE  77   1.830 -14.632  -4.451
  630   HG13  ILE  77          1HG1      ILE  77   0.698 -15.953  -4.711
  631   HG21  ILE  77          1HG2      ILE  77  -1.556 -15.070  -1.879
  632   HG22  ILE  77          2HG2      ILE  77  -1.375 -16.111  -3.291
  633   HG23  ILE  77          3HG2      ILE  77  -1.797 -14.411  -3.498
  634   HD11  ILE  77          3HD1      ILE  77  -0.987 -14.373  -5.472
  635   HD12  ILE  77          1HD1      ILE  77   0.494 -14.235  -6.419
  636   HD13  ILE  77          2HD1      ILE  77   0.125 -13.035  -5.182
  637    H    PHE  78           H        PHE  78  -1.114 -11.505  -1.686
  638    HA   PHE  78           HA       PHE  78  -1.307 -12.477   1.080
  639    HB2  PHE  78           2HB      PHE  78  -0.917 -10.082   0.804
  640    HB3  PHE  78           1HB      PHE  78  -2.338  -9.940  -0.225
  641    HD1  PHE  78           HD1      PHE  78  -1.302 -10.869   3.240
  642    HD2  PHE  78           HD2      PHE  78  -4.416  -9.418   0.713
  643    HE1  PHE  78           HE1      PHE  78  -2.696 -10.408   5.216
  644    HE2  PHE  78           HE2      PHE  78  -5.808  -8.956   2.687
  645    HZ   PHE  78           HZ       PHE  78  -4.947  -9.451   4.941
  646    H    LEU  79           H        LEU  79  -3.153 -13.383   1.925
  647    HA   LEU  79           HA       LEU  79  -5.421 -13.757   0.072
  648    HB2  LEU  79           2HB      LEU  79  -4.332 -15.511   2.263
  649    HB3  LEU  79           1HB      LEU  79  -5.926 -15.760   1.577
  650    HG   LEU  79           HG       LEU  79  -3.376 -15.796  -0.047
  651   HD11  LEU  79          1HD1      LEU  79  -3.379 -17.624   1.572
  652   HD12  LEU  79          2HD1      LEU  79  -3.611 -18.228  -0.068
  653   HD13  LEU  79          3HD1      LEU  79  -4.986 -18.112   1.030
  654   HD21  LEU  79          3HD2      LEU  79  -4.802 -16.857  -1.747
  655   HD22  LEU  79          1HD2      LEU  79  -5.345 -15.228  -1.351
  656   HD23  LEU  79          2HD2      LEU  79  -6.205 -16.625  -0.705
  657    H    ASP  80           H        ASP  80  -7.170 -12.646   0.525
  658    HA   ASP  80           HA       ASP  80  -7.724 -11.527   3.115
  659    HB2  ASP  80           2HB      ASP  80  -8.381 -10.279   1.158
  660    HB3  ASP  80           1HB      ASP  80  -9.317 -11.635   0.537
  661    H    SER  81           H        SER  81 -10.011 -11.849   4.070
  662    HA   SER  81           HA       SER  81 -10.375 -14.450   4.988
  663    HB2  SER  81           2HB      SER  81 -12.434 -12.229   4.826
  664    HB3  SER  81           1HB      SER  81 -12.569 -13.674   5.830
  665    HG   SER  81           HG       SER  81 -11.344 -11.374   6.388
  666    H    LYS  82           H        LYS  82 -11.704 -12.927   2.108
  667    HA   LYS  82           HA       LYS  82 -13.494 -15.164   1.576
  668    HB2  LYS  82           2HB      LYS  82 -12.799 -12.774  -0.151
  669    HB3  LYS  82           1HB      LYS  82 -14.076 -13.938  -0.480
  670    HG2  LYS  82           2HG      LYS  82 -13.950 -12.052   1.873
  671    HG3  LYS  82           1HG      LYS  82 -14.988 -11.892   0.454
  672    HD2  LYS  82           2HD      LYS  82 -16.097 -14.019   1.054
  673    HD3  LYS  82           1HD      LYS  82 -15.078 -14.128   2.492
  674    HE2  LYS  82           2HE      LYS  82 -16.020 -11.999   3.299
  675    HE3  LYS  82           1HE      LYS  82 -17.065 -11.932   1.883
  676    HZ1  LYS  82           3HZ      LYS  82 -18.123 -13.978   2.613
  677    HZ2  LYS  82           1HZ      LYS  82 -18.232 -12.788   3.810
  678    HZ3  LYS  82           2HZ      LYS  82 -17.112 -14.045   3.966
  679    H    GLY  83           H        GLY  83 -10.317 -15.106   1.477
  680    HA2  GLY  83           2HA      GLY  83  -8.797 -16.526   0.482
  681    HA3  GLY  83           1HA      GLY  83 -10.115 -17.215  -0.447
  682    H    LEU  84           H        LEU  84  -9.580 -13.793  -0.632
  683    HA   LEU  84           HA       LEU  84  -9.051 -13.987  -3.460
  684    HB2  LEU  84           2HB      LEU  84  -9.091 -11.527  -1.702
  685    HB3  LEU  84           1HB      LEU  84  -9.174 -11.560  -3.453
  686    HG   LEU  84           HG       LEU  84 -11.291 -12.624  -1.570
  687   HD11  LEU  84          1HD1      LEU  84 -12.649 -10.767  -2.349
  688   HD12  LEU  84          2HD1      LEU  84 -11.324 -10.195  -3.364
  689   HD13  LEU  84          3HD1      LEU  84 -11.162 -10.176  -1.607
  690   HD21  LEU  84          3HD2      LEU  84 -11.234 -12.492  -4.588
  691   HD22  LEU  84          1HD2      LEU  84 -12.653 -12.894  -3.616
  692   HD23  LEU  84          2HD2      LEU  84 -11.240 -13.948  -3.593
  693    H    GLU  85           H        GLU  85  -7.104 -14.009  -4.416
  694    HA   GLU  85           HA       GLU  85  -4.685 -13.711  -2.858
  695    HB2  GLU  85           2HB      GLU  85  -5.047 -14.250  -5.813
  696    HB3  GLU  85           1HB      GLU  85  -3.529 -14.361  -4.934
  697    HG2  GLU  85           2HG      GLU  85  -4.414 -16.204  -3.609
  698    HG3  GLU  85           1HG      GLU  85  -5.962 -16.077  -4.447
  699    H    TYR  86           H        TYR  86  -3.549 -11.884  -2.651
  700    HA   TYR  86           HA       TYR  86  -3.780  -9.782  -4.718
  701    HB2  TYR  86           2HB      TYR  86  -3.158  -9.452  -1.765
  702    HB3  TYR  86           1HB      TYR  86  -3.219  -8.153  -2.950
  703    HD1  TYR  86           HD2      TYR  86  -5.212 -10.506  -0.963
  704    HD2  TYR  86           HD1      TYR  86  -5.351  -7.334  -3.794
  705    HE1  TYR  86           HE2      TYR  86  -7.613 -10.224  -0.525
  706    HE2  TYR  86           HE1      TYR  86  -7.753  -7.047  -3.361
  707    HH   TYR  86           HH       TYR  86  -9.647  -8.404  -2.507
  708    HA   PRO  87           HA       PRO  87   0.636 -11.056  -4.991
  709    HB2  PRO  87           2HB      PRO  87   0.957 -10.421  -7.601
  710    HB3  PRO  87           1HB      PRO  87   0.177 -11.923  -7.087
  711    HG2  PRO  87           2HG      PRO  87  -1.077  -9.356  -8.002
  712    HG3  PRO  87           1HG      PRO  87  -1.503 -11.024  -8.431
  713    HD2  PRO  87           2HD      PRO  87  -2.856  -9.564  -6.560
  714    HD3  PRO  87           1HD      PRO  87  -2.728 -11.334  -6.506
  715    H    ALA  88           H        ALA  88   0.676  -9.045  -3.506
  716    HA   ALA  88           HA       ALA  88   0.775  -6.440  -4.672
  717    HB1  ALA  88           3HB      ALA  88   1.645  -7.316  -1.920
  718    HB2  ALA  88           1HB      ALA  88   0.007  -6.851  -2.374
  719    HB3  ALA  88           2HB      ALA  88   1.309  -5.663  -2.433
  720    H    VAL  89           H        VAL  89   2.388  -5.766  -5.924
  721    HA   VAL  89           HA       VAL  89   5.176  -6.452  -5.211
  722    HB   VAL  89           HB       VAL  89   4.050  -5.493  -7.861
  723   HG11  VAL  89          1HG1      VAL  89   6.876  -6.280  -7.115
  724   HG12  VAL  89          2HG1      VAL  89   6.318  -4.664  -7.552
  725   HG13  VAL  89          3HG1      VAL  89   6.309  -5.953  -8.754
  726   HG21  VAL  89          3HG2      VAL  89   3.441  -7.809  -7.329
  727   HG22  VAL  89          1HG2      VAL  89   5.140  -8.198  -7.060
  728   HG23  VAL  89          2HG2      VAL  89   4.583  -7.739  -8.670
  729    H    VAL  90           H        VAL  90   6.192  -4.874  -4.122
  730    HA   VAL  90           HA       VAL  90   5.359  -2.085  -4.462
  731    HB   VAL  90           HB       VAL  90   5.627  -3.116  -2.176
  732   HG11  VAL  90          1HG1      VAL  90   7.871  -3.319  -1.223
  733   HG12  VAL  90          2HG1      VAL  90   8.579  -2.948  -2.795
  734   HG13  VAL  90          3HG1      VAL  90   7.645  -4.428  -2.575
  735   HG21  VAL  90          3HG2      VAL  90   7.313  -0.683  -2.757
  736   HG22  VAL  90          1HG2      VAL  90   6.682  -1.144  -1.175
  737   HG23  VAL  90          2HG2      VAL  90   5.573  -0.703  -2.474
  738    H    GLU  91           H        GLU  91   6.633  -0.507  -5.396
  739    HA   GLU  91           HA       GLU  91   9.474  -0.855  -5.684
  740    HB2  GLU  91           2HB      GLU  91   9.543  -0.688  -8.144
  741    HB3  GLU  91           1HB      GLU  91   8.825  -2.183  -7.571
  742    HG2  GLU  91           2HG      GLU  91   6.581  -1.200  -7.990
  743    HG3  GLU  91           1HG      GLU  91   7.380   0.200  -8.711
  744    H    PHE  92           H        PHE  92  10.384   1.008  -7.179
  745    HA   PHE  92           HA       PHE  92   9.573   3.287  -5.559
  746    HB2  PHE  92           2HB      PHE  92  11.981   3.311  -7.351
  747    HB3  PHE  92           1HB      PHE  92  11.759   4.049  -5.767
  748    HD1  PHE  92           HD1      PHE  92  11.073   2.049  -3.939
  749    HD2  PHE  92           HD2      PHE  92  13.591   1.667  -7.353
  750    HE1  PHE  92           HE1      PHE  92  12.189   0.114  -2.905
  751    HE2  PHE  92           HE2      PHE  92  14.708  -0.262  -6.320
  752    HZ   PHE  92           HZ       PHE  92  14.005  -1.046  -4.092
  753    H    ALA  93           H        ALA  93   9.248   5.375  -6.310
  754    HA   ALA  93           HA       ALA  93   8.476   5.663  -9.141
  755    HB1  ALA  93           3HB      ALA  93   7.759   7.383  -6.755
  756    HB2  ALA  93           1HB      ALA  93   6.731   6.144  -7.475
  757    HB3  ALA  93           2HB      ALA  93   7.153   7.586  -8.399
  758    HA   PRO  94           HA       PRO  94  11.792   8.437 -10.116
  759    HB2  PRO  94           2HB      PRO  94  10.542  10.558 -11.345
  760    HB3  PRO  94           1HB      PRO  94  10.840   8.999 -12.118
  761    HG2  PRO  94           2HG      PRO  94   8.343  10.008 -10.799
  762    HG3  PRO  94           1HG      PRO  94   8.525   9.135 -12.335
  763    HD2  PRO  94           2HD      PRO  94   7.737   7.872 -10.109
  764    HD3  PRO  94           1HD      PRO  94   8.819   7.080 -11.275
  765    H    PHE  95           H        PHE  95  12.974   9.681  -8.808
  766    HA   PHE  95           HA       PHE  95  11.746  11.380  -6.811
  767    HB2  PHE  95           2HB      PHE  95  13.692  10.048  -6.198
  768    HB3  PHE  95           1HB      PHE  95  14.654  10.817  -7.456
  769    HD1  PHE  95           HD1      PHE  95  12.788  11.531  -4.318
  770    HD2  PHE  95           HD2      PHE  95  15.880  12.762  -6.984
  771    HE1  PHE  95           HE1      PHE  95  13.482  13.261  -2.715
  772    HE2  PHE  95           HE2      PHE  95  16.575  14.489  -5.378
  773    HZ   PHE  95           HZ       PHE  95  15.377  14.740  -3.243
  774    H    GLN  96           H        GLN  96  13.010  11.821  -9.978
  775    HA   GLN  96           HA       GLN  96  13.479  14.688  -9.562
  776    HB2  GLN  96           2HB      GLN  96  14.236  12.797 -11.787
  777    HB3  GLN  96           1HB      GLN  96  14.414  14.542 -11.936
  778    HG2  GLN  96           2HG      GLN  96  15.677  12.899  -9.745
  779    HG3  GLN  96           1HG      GLN  96  16.489  13.350 -11.246
  780   HE21  GLN  96          1HE2      GLN  96  15.025  14.619  -8.311
  781   HE22  GLN  96          2HE2      GLN  96  15.853  16.135  -8.339
  782    H    LYS  97           H        LYS  97  12.824  16.155 -11.374
  783    HA   LYS  97           HA       LYS  97   9.973  15.988 -11.687
  784    HB2  LYS  97           2HB      LYS  97  12.073  18.020 -12.407
  785    HB3  LYS  97           1HB      LYS  97  10.404  18.226 -12.920
  786    HG2  LYS  97           2HG      LYS  97  11.267  17.887 -10.047
  787    HG3  LYS  97           1HG      LYS  97  11.013  19.446 -10.836
  788    HD2  LYS  97           2HD      LYS  97   8.912  17.288 -10.539
  789    HD3  LYS  97           1HD      LYS  97   9.061  18.711  -9.504
  790    HE2  LYS  97           2HE      LYS  97   8.660  20.172 -11.412
  791    HE3  LYS  97           1HE      LYS  97   8.598  18.779 -12.492
  792    HZ1  LYS  97           3HZ      LYS  97   6.393  19.584 -11.891
  793    HZ2  LYS  97           1HZ      LYS  97   6.714  19.294 -10.257
  794    HZ3  LYS  97           2HZ      LYS  97   6.638  18.004 -11.350
  Start of MODEL   19
    1    H1   MET   1           1H       MET   1  28.939  28.607   0.228
    2    H2   MET   1           2H       MET   1  27.632  27.986  -0.644
    3    H3   MET   1           3H       MET   1  28.613  26.948   0.262
    4    HA   MET   1           HA       MET   1  27.904  28.054   2.307
    5    HB2  MET   1           2HB      MET   1  25.941  29.468   0.481
    6    HB3  MET   1           1HB      MET   1  26.010  29.606   2.232
    7    HG2  MET   1           2HG      MET   1  28.245  30.627   2.037
    8    HG3  MET   1           1HG      MET   1  28.107  30.543   0.282
    9    HE1  MET   1           3HE      MET   1  26.055  31.799  -1.054
   10    HE2  MET   1           1HE      MET   1  24.919  32.878  -0.247
   11    HE3  MET   1           2HE      MET   1  24.886  31.149   0.095
   12    H    GLY   2           H        GLY   2  25.586  27.664   3.267
   13    HA2  GLY   2           2HA      GLY   2  23.603  26.450   3.350
   14    HA3  GLY   2           1HA      GLY   2  23.908  25.870   1.723
   15    H    HIS   3           H        HIS   3  23.413  24.805   4.692
   16    HA   HIS   3           HA       HIS   3  25.330  22.571   4.535
   17    HB2  HIS   3           2HB      HIS   3  23.507  23.341   6.832
   18    HB3  HIS   3           1HB      HIS   3  24.778  22.124   6.863
   19    HD1  HIS   3           HD1      HIS   3  24.195  25.464   7.896
   20    HD2  HIS   3           HD2      HIS   3  27.431  23.488   6.196
   21    HE1  HIS   3           HE1      HIS   3  26.194  26.894   8.396
   22    HE2  HIS   3           HE2      HIS   3  28.151  25.606   7.494
   23    H    HIS   4           H        HIS   4  24.612  20.666   3.754
   24    HA   HIS   4           HA       HIS   4  21.986  20.461   2.717
   25    HB2  HIS   4           2HB      HIS   4  24.081  18.298   3.018
   26    HB3  HIS   4           1HB      HIS   4  22.648  18.203   2.000
   27    HD1  HIS   4           HD1      HIS   4  26.139  19.177   1.921
   28    HD2  HIS   4           HD2      HIS   4  22.693  20.253  -0.132
   29    HE1  HIS   4           HE1      HIS   4  26.932  20.325  -0.164
   30    HE2  HIS   4           HE2      HIS   4  24.838  20.784  -1.475
   31    H    HIS   5           H        HIS   5  20.578  20.706   4.507
   32    HA   HIS   5           HA       HIS   5  20.152  18.183   5.991
   33    HB2  HIS   5           2HB      HIS   5  19.764  21.020   6.955
   34    HB3  HIS   5           1HB      HIS   5  19.040  19.633   7.761
   35    HD1  HIS   5           HD1      HIS   5  20.462  18.384   9.382
   36    HD2  HIS   5           HD2      HIS   5  22.674  21.021   7.058
   37    HE1  HIS   5           HE1      HIS   5  22.757  18.395  10.385
   38    HE2  HIS   5           HE2      HIS   5  24.109  19.891   8.889
   39    H    HIS   6           H        HIS   6  18.722  17.394   4.426
   40    HA   HIS   6           HA       HIS   6  16.029  18.499   4.621
   41    HB2  HIS   6           2HB      HIS   6  15.738  18.247   2.096
   42    HB3  HIS   6           1HB      HIS   6  16.676  19.628   2.649
   43    HD1  HIS   6           HD1      HIS   6  19.189  19.664   2.081
   44    HD2  HIS   6           HD2      HIS   6  17.193  16.313   0.642
   45    HE1  HIS   6           HE1      HIS   6  20.775  18.573   0.471
   46    HE2  HIS   6           HE2      HIS   6  19.615  16.467  -0.260
   47    H    HIS   7           H        HIS   7  15.250  16.733   5.676
   48    HA   HIS   7           HA       HIS   7  16.030  14.075   4.919
   49    HB2  HIS   7           2HB      HIS   7  14.482  13.327   6.716
   50    HB3  HIS   7           1HB      HIS   7  15.660  14.514   7.256
   51    HD1  HIS   7           HD1      HIS   7  14.723  16.956   7.753
   52    HD2  HIS   7           HD2      HIS   7  11.838  14.046   7.055
   53    HE1  HIS   7           HE1      HIS   7  12.566  17.928   8.587
   54    HE2  HIS   7           HE2      HIS   7  10.861  16.114   8.255
   55    H    HIS   8           H        HIS   8  15.360  13.949   2.738
   56    HA   HIS   8           HA       HIS   8  12.642  12.897   2.526
   57    HB2  HIS   8           2HB      HIS   8  13.725  15.123   0.808
   58    HB3  HIS   8           1HB      HIS   8  12.509  14.014   0.178
   59    HD1  HIS   8           HD1      HIS   8  12.574  17.229   1.403
   60    HD2  HIS   8           HD2      HIS   8  10.326  13.900   2.463
   61    HE1  HIS   8           HE1      HIS   8  10.532  18.132   2.549
   62    HE2  HIS   8           HE2      HIS   8   9.142  16.108   3.093
   63    H    SER   9           H        SER   9  12.591  11.017   1.518
   64    HA   SER   9           HA       SER   9  14.984  10.110   0.055
   65    HB2  SER   9           2HB      SER   9  14.436   8.754   2.010
   66    HB3  SER   9           1HB      SER   9  12.792   8.517   1.423
   67    HG   SER   9           HG       SER   9  13.573   6.827   0.468
   68    H    HIS  10           H        HIS  10  14.225   8.128  -1.466
   69    HA   HIS  10           HA       HIS  10  12.702   9.331  -3.591
   70    HB2  HIS  10           2HB      HIS  10  13.795   6.514  -3.340
   71    HB3  HIS  10           1HB      HIS  10  13.176   7.248  -4.817
   72    HD1  HIS  10           HD1      HIS  10  16.208   6.963  -2.746
   73    HD2  HIS  10           HD2      HIS  10  14.851   9.346  -5.866
   74    HE1  HIS  10           HE1      HIS  10  18.242   8.128  -3.632
   75    HE2  HIS  10           HE2      HIS  10  17.427   9.354  -5.665
   76    H    MET  11           H        MET  11  10.541   9.274  -3.775
   77    HA   MET  11           HA       MET  11   8.871   7.841  -2.012
   78    HB2  MET  11           2HB      MET  11   7.005   8.606  -3.459
   79    HB3  MET  11           1HB      MET  11   8.094   9.899  -2.982
   80    HG2  MET  11           2HG      MET  11   9.155   9.825  -5.181
   81    HG3  MET  11           1HG      MET  11   8.069   8.516  -5.660
   82    HE1  MET  11           3HE      MET  11   7.434  10.013  -7.814
   83    HE2  MET  11           1HE      MET  11   8.473  11.315  -7.242
   84    HE3  MET  11           2HE      MET  11   6.804  11.657  -7.700
   85    H    VAL  12           H        VAL  12   7.362   6.160  -2.413
   86    HA   VAL  12           HA       VAL  12   8.173   4.282  -4.546
   87    HB   VAL  12           HB       VAL  12   7.597   3.594  -1.645
   88   HG11  VAL  12          1HG1      VAL  12   8.437   1.781  -3.910
   89   HG12  VAL  12          2HG1      VAL  12   6.853   1.812  -3.139
   90   HG13  VAL  12          3HG1      VAL  12   8.272   1.310  -2.220
   91   HG21  VAL  12          3HG2      VAL  12  10.204   3.528  -3.176
   92   HG22  VAL  12          1HG2      VAL  12   9.968   2.965  -1.520
   93   HG23  VAL  12          2HG2      VAL  12   9.768   4.675  -1.907
   94    H    VAL  13           H        VAL  13   6.529   2.681  -5.122
   95    HA   VAL  13           HA       VAL  13   3.791   3.274  -4.198
   96    HB   VAL  13           HB       VAL  13   2.919   2.824  -6.468
   97   HG11  VAL  13          1HG1      VAL  13   3.563   4.947  -7.493
   98   HG12  VAL  13          2HG1      VAL  13   4.934   5.070  -6.392
   99   HG13  VAL  13          3HG1      VAL  13   3.292   5.134  -5.761
  100   HG21  VAL  13          3HG2      VAL  13   5.822   2.853  -7.325
  101   HG22  VAL  13          1HG2      VAL  13   4.425   2.780  -8.398
  102   HG23  VAL  13          2HG2      VAL  13   4.766   1.439  -7.304
  103    H    ILE  14           H        ILE  14   2.307   1.451  -4.374
  104    HA   ILE  14           HA       ILE  14   3.698  -1.147  -4.504
  105    HB   ILE  14           HB       ILE  14   2.974  -0.579  -2.216
  106   HG12  ILE  14          2HG1      ILE  14   1.359  -2.863  -3.379
  107   HG13  ILE  14          1HG1      ILE  14   3.078  -2.938  -3.004
  108   HG21  ILE  14          1HG2      ILE  14   0.160  -0.630  -3.305
  109   HG22  ILE  14          2HG2      ILE  14   1.028   0.800  -2.750
  110   HG23  ILE  14          3HG2      ILE  14   0.617  -0.479  -1.608
  111   HD11  ILE  14          3HD1      ILE  14   0.828  -2.522  -1.057
  112   HD12  ILE  14          1HD1      ILE  14   2.542  -2.468  -0.641
  113   HD13  ILE  14          2HD1      ILE  14   1.827  -3.962  -1.239
  114    H    ARG  15           H        ARG  15   3.154  -2.280  -6.216
  115    HA   ARG  15           HA       ARG  15   0.726  -1.572  -7.702
  116    HB2  ARG  15           2HB      ARG  15   3.180  -3.106  -8.587
  117    HB3  ARG  15           1HB      ARG  15   1.851  -2.611  -9.625
  118    HG2  ARG  15           2HG      ARG  15   3.722  -0.751  -8.161
  119    HG3  ARG  15           1HG      ARG  15   3.803  -1.162  -9.875
  120    HD2  ARG  15           2HD      ARG  15   1.557   0.289  -8.466
  121    HD3  ARG  15           1HD      ARG  15   2.726   0.990  -9.584
  122    HE   ARG  15           HE       ARG  15   0.838  -1.096 -10.453
  123   HH11  ARG  15          1HH1      ARG  15   2.291   1.996 -10.871
  124   HH12  ARG  15          2HH1      ARG  15   1.423   2.321 -12.330
  125   HH21  ARG  15          1HH2      ARG  15  -0.247  -0.679 -12.334
  126   HH22  ARG  15          2HH2      ARG  15   0.013   0.822 -13.154
  127    H    ARG  16           H        ARG  16  -0.225  -3.361  -9.043
  128    HA   ARG  16           HA       ARG  16  -1.192  -5.382  -9.381
  129    HB2  ARG  16           2HB      ARG  16   1.143  -6.240  -8.860
  130    HB3  ARG  16           1HB      ARG  16   0.580  -6.530  -7.220
  131    HG2  ARG  16           2HG      ARG  16   0.486  -8.582  -8.443
  132    HG3  ARG  16           1HG      ARG  16  -1.167  -8.041  -8.146
  133    HD2  ARG  16           2HD      ARG  16  -1.309  -7.175 -10.423
  134    HD3  ARG  16           1HD      ARG  16   0.367  -7.644 -10.721
  135    HE   ARG  16           HE       ARG  16  -1.572  -9.710  -9.979
  136   HH11  ARG  16          1HH1      ARG  16   0.409  -8.271 -12.404
  137   HH12  ARG  16          2HH1      ARG  16   0.346  -9.659 -13.431
  138   HH21  ARG  16          1HH2      ARG  16  -1.639 -11.484 -11.307
  139   HH22  ARG  16          2HH2      ARG  16  -0.814 -11.450 -12.827
  140    H    LEU  17           H        LEU  17  -2.143  -3.442  -7.418
  141    HA   LEU  17           HA       LEU  17  -3.596  -5.134  -5.507
  142    HB2  LEU  17           2HB      LEU  17  -3.124  -2.181  -5.726
  143    HB3  LEU  17           1HB      LEU  17  -4.496  -2.767  -4.812
  144    HG   LEU  17           HG       LEU  17  -2.633  -2.279  -3.336
  145   HD11  LEU  17          1HD1      LEU  17  -2.502  -4.410  -2.151
  146   HD12  LEU  17          2HD1      LEU  17  -3.126  -5.250  -3.571
  147   HD13  LEU  17          3HD1      LEU  17  -4.142  -4.091  -2.713
  148   HD21  LEU  17          3HD2      LEU  17  -0.778  -2.618  -4.888
  149   HD22  LEU  17          1HD2      LEU  17  -1.091  -4.356  -4.902
  150   HD23  LEU  17          2HD2      LEU  17  -0.551  -3.566  -3.419
  151    HA   PRO  18           HA       PRO  18  -7.133  -4.655  -8.364
  152    HB2  PRO  18           2HB      PRO  18  -8.194  -7.082  -7.992
  153    HB3  PRO  18           1HB      PRO  18  -6.752  -6.869  -8.996
  154    HG2  PRO  18           2HG      PRO  18  -6.967  -7.826  -6.163
  155    HG3  PRO  18           1HG      PRO  18  -5.949  -8.442  -7.479
  156    HD2  PRO  18           2HD      PRO  18  -5.092  -6.706  -5.493
  157    HD3  PRO  18           1HD      PRO  18  -4.307  -6.906  -7.072
  158    HA   PRO  19           HA       PRO  19 -10.246  -3.483  -5.389
  159    HB2  PRO  19           2HB      PRO  19 -12.279  -4.933  -7.008
  160    HB3  PRO  19           1HB      PRO  19 -12.221  -3.232  -6.532
  161    HG2  PRO  19           2HG      PRO  19 -11.690  -3.963  -9.045
  162    HG3  PRO  19           1HG      PRO  19 -10.770  -2.661  -8.263
  163    HD2  PRO  19           2HD      PRO  19  -9.984  -5.519  -8.742
  164    HD3  PRO  19           1HD      PRO  19  -9.011  -4.040  -8.902
  165    H    GLY  20           H        GLY  20 -11.003  -4.293  -3.488
  166    HA2  GLY  20           2HA      GLY  20 -12.420  -6.697  -3.180
  167    HA3  GLY  20           1HA      GLY  20 -10.735  -7.009  -2.791
  168    H    LEU  21           H        LEU  21  -9.922  -6.337  -0.865
  169    HA   LEU  21           HA       LEU  21 -11.742  -5.809   1.233
  170    HB2  LEU  21           2HB      LEU  21  -9.874  -5.799   2.701
  171    HB3  LEU  21           1HB      LEU  21  -9.603  -7.041   1.495
  172    HG   LEU  21           HG       LEU  21  -8.256  -4.333   1.634
  173   HD11  LEU  21          1HD1      LEU  21  -7.452  -5.913   3.300
  174   HD12  LEU  21          2HD1      LEU  21  -6.229  -5.642   2.059
  175   HD13  LEU  21          3HD1      LEU  21  -7.183  -7.125   2.047
  176   HD21  LEU  21          3HD2      LEU  21  -6.871  -5.084  -0.240
  177   HD22  LEU  21          1HD2      LEU  21  -8.568  -4.963  -0.702
  178   HD23  LEU  21          2HD2      LEU  21  -7.851  -6.544  -0.384
  179    H    THR  22           H        THR  22 -11.218  -4.025   2.909
  180    HA   THR  22           HA       THR  22 -11.312  -1.428   1.515
  181    HB   THR  22           HB       THR  22 -12.289  -2.217   4.279
  182    HG1  THR  22           HG1      THR  22 -14.122  -1.199   2.521
  183   HG21  THR  22          3HG2      THR  22 -12.514   0.449   2.861
  184   HG22  THR  22          1HG2      THR  22 -11.537   0.116   4.292
  185   HG23  THR  22          2HG2      THR  22 -13.296   0.028   4.384
  186    H    LYS  23           H        LYS  23 -10.073   0.346   2.248
  187    HA   LYS  23           HA       LYS  23  -7.460   0.063   2.803
  188    HB2  LYS  23           2HB      LYS  23  -7.416   2.368   3.643
  189    HB3  LYS  23           1HB      LYS  23  -8.415   2.205   2.207
  190    HG2  LYS  23           2HG      LYS  23 -10.428   2.257   3.571
  191    HG3  LYS  23           1HG      LYS  23  -9.449   2.343   5.035
  192    HD2  LYS  23           2HD      LYS  23  -9.502   4.411   2.829
  193    HD3  LYS  23           1HD      LYS  23 -10.295   4.557   4.398
  194    HE2  LYS  23           2HE      LYS  23  -8.118   4.441   5.513
  195    HE3  LYS  23           1HE      LYS  23  -7.320   4.277   3.950
  196    HZ1  LYS  23           3HZ      LYS  23  -7.216   6.543   4.756
  197    HZ2  LYS  23           1HZ      LYS  23  -8.902   6.621   4.842
  198    HZ3  LYS  23           2HZ      LYS  23  -8.139   6.465   3.341
  199    H    GLU  24           H        GLU  24  -9.966   0.157   5.298
  200    HA   GLU  24           HA       GLU  24  -8.520   0.371   7.624
  201    HB2  GLU  24           2HB      GLU  24 -10.810  -1.557   7.168
  202    HB3  GLU  24           1HB      GLU  24 -10.308  -0.879   8.712
  203    HG2  GLU  24           2HG      GLU  24 -10.910   1.367   7.908
  204    HG3  GLU  24           1HG      GLU  24 -11.454   0.660   6.388
  205    H    GLN  25           H        GLN  25  -9.415  -2.742   6.137
  206    HA   GLN  25           HA       GLN  25  -7.413  -4.172   7.690
  207    HB2  GLN  25           2HB      GLN  25  -8.412  -6.168   6.460
  208    HB3  GLN  25           1HB      GLN  25  -9.496  -5.285   7.527
  209    HG2  GLN  25           2HG      GLN  25 -10.432  -4.106   5.589
  210    HG3  GLN  25           1HG      GLN  25  -9.356  -5.004   4.525
  211   HE21  GLN  25          1HE2      GLN  25  -9.798  -7.173   4.105
  212   HE22  GLN  25          2HE2      GLN  25 -11.310  -7.899   4.501
  213    H    LEU  26           H        LEU  26  -7.169  -2.384   5.021
  214    HA   LEU  26           HA       LEU  26  -5.516  -4.218   3.448
  215    HB2  LEU  26           2HB      LEU  26  -7.114  -3.072   2.141
  216    HB3  LEU  26           1HB      LEU  26  -6.751  -1.539   2.894
  217    HG   LEU  26           HG       LEU  26  -4.518  -1.573   1.766
  218   HD11  LEU  26          1HD1      LEU  26  -5.656  -3.949   0.288
  219   HD12  LEU  26          2HD1      LEU  26  -4.326  -3.994   1.445
  220   HD13  LEU  26          3HD1      LEU  26  -4.141  -3.122  -0.076
  221   HD21  LEU  26          3HD2      LEU  26  -6.905  -1.743  -0.076
  222   HD22  LEU  26          1HD2      LEU  26  -5.368  -0.955  -0.429
  223   HD23  LEU  26          2HD2      LEU  26  -6.411  -0.321   0.843
  224    H    GLU  27           H        GLU  27  -5.260  -0.946   4.885
  225    HA   GLU  27           HA       GLU  27  -2.559  -0.607   4.076
  226    HB2  GLU  27           2HB      GLU  27  -2.590   1.422   5.402
  227    HB3  GLU  27           1HB      GLU  27  -4.066   1.281   4.461
  228    HG2  GLU  27           2HG      GLU  27  -5.195   0.417   6.517
  229    HG3  GLU  27           1HG      GLU  27  -3.730   0.805   7.413
  230    H    GLU  28           H        GLU  28  -3.966  -2.178   6.813
  231    HA   GLU  28           HA       GLU  28  -2.027  -1.808   8.763
  232    HB2  GLU  28           2HB      GLU  28  -2.780  -3.965   9.726
  233    HB3  GLU  28           1HB      GLU  28  -4.106  -2.892   9.303
  234    HG2  GLU  28           2HG      GLU  28  -4.602  -4.181   7.340
  235    HG3  GLU  28           1HG      GLU  28  -3.166  -5.177   7.581
  236    H    GLN  29           H        GLN  29  -1.960  -4.095   6.038
  237    HA   GLN  29           HA       GLN  29   0.720  -4.965   6.856
  238    HB2  GLN  29           2HB      GLN  29   0.586  -6.554   4.951
  239    HB3  GLN  29           1HB      GLN  29  -0.670  -6.781   6.153
  240    HG2  GLN  29           2HG      GLN  29  -1.307  -5.090   3.791
  241    HG3  GLN  29           1HG      GLN  29  -1.172  -6.832   3.551
  242   HE21  GLN  29          1HE2      GLN  29  -3.525  -5.184   3.311
  243   HE22  GLN  29          2HE2      GLN  29  -4.671  -5.794   4.451
  244    H    LEU  30           H        LEU  30  -0.684  -2.619   4.837
  245    HA   LEU  30           HA       LEU  30   1.495  -2.523   2.928
  246    HB2  LEU  30           2HB      LEU  30  -0.715  -0.516   3.399
  247    HB3  LEU  30           1HB      LEU  30   0.385  -0.539   2.033
  248    HG   LEU  30           HG       LEU  30  -1.877  -2.427   2.640
  249   HD11  LEU  30          1HD1      LEU  30  -2.433  -0.439   1.380
  250   HD12  LEU  30          2HD1      LEU  30  -2.546  -1.865   0.350
  251   HD13  LEU  30          3HD1      LEU  30  -1.154  -0.788   0.215
  252   HD21  LEU  30          3HD2      LEU  30  -1.113  -3.785   0.701
  253   HD22  LEU  30          1HD2      LEU  30  -0.047  -3.885   2.104
  254   HD23  LEU  30          2HD2      LEU  30   0.402  -2.886   0.725
  255    H    ARG  31           H        ARG  31   0.763  -1.084   6.007
  256    HA   ARG  31           HA       ARG  31   3.320   0.372   5.807
  257    HB2  ARG  31           2HB      ARG  31   2.371   1.989   7.525
  258    HB3  ARG  31           1HB      ARG  31   1.743   2.117   5.890
  259    HG2  ARG  31           2HG      ARG  31  -0.325   1.179   6.486
  260    HG3  ARG  31           1HG      ARG  31   0.298   0.540   8.008
  261    HD2  ARG  31           2HD      ARG  31   0.470   2.745   8.939
  262    HD3  ARG  31           1HD      ARG  31   0.099   3.487   7.385
  263    HE   ARG  31           HE       ARG  31  -2.141   3.055   7.725
  264   HH11  ARG  31          1HH1      ARG  31  -0.319   1.395  10.152
  265   HH12  ARG  31          2HH1      ARG  31  -1.704   1.135  11.150
  266   HH21  ARG  31          1HH2      ARG  31  -3.880   2.722   8.997
  267   HH22  ARG  31          2HH2      ARG  31  -3.719   1.863  10.492
  268    HA   PRO  32           HA       PRO  32   3.733  -2.330   9.543
  269    HB2  PRO  32           2HB      PRO  32   5.330  -4.258   8.643
  270    HB3  PRO  32           1HB      PRO  32   3.596  -4.297   8.288
  271    HG2  PRO  32           2HG      PRO  32   5.871  -3.465   6.525
  272    HG3  PRO  32           1HG      PRO  32   4.430  -4.416   6.119
  273    HD2  PRO  32           2HD      PRO  32   4.746  -1.677   5.666
  274    HD3  PRO  32           1HD      PRO  32   3.200  -2.545   5.690
  275    H    LEU  33           H        LEU  33   5.324  -0.094   7.965
  276    HA   LEU  33           HA       LEU  33   8.078  -0.492   8.469
  277    HB2  LEU  33           2HB      LEU  33   6.452   2.014   8.001
  278    HB3  LEU  33           1HB      LEU  33   8.195   2.035   8.185
  279    HG   LEU  33           HG       LEU  33   8.406   0.586   6.176
  280   HD11  LEU  33          1HD1      LEU  33   6.497   0.262   4.696
  281   HD12  LEU  33          2HD1      LEU  33   5.434   1.012   5.889
  282   HD13  LEU  33          3HD1      LEU  33   6.231  -0.518   6.255
  283   HD21  LEU  33          3HD2      LEU  33   7.825   2.320   4.538
  284   HD22  LEU  33          1HD2      LEU  33   8.614   2.996   5.962
  285   HD23  LEU  33          2HD2      LEU  33   6.869   3.152   5.766
  286    HA   PRO  34           HA       PRO  34   8.640   0.213  12.795
  287    HB2  PRO  34           2HB      PRO  34  10.822   1.958  12.756
  288    HB3  PRO  34           1HB      PRO  34  10.913   0.196  12.681
  289    HG2  PRO  34           2HG      PRO  34  11.016   2.196  10.457
  290    HG3  PRO  34           1HG      PRO  34  11.946   0.699  10.665
  291    HD2  PRO  34           2HD      PRO  34   9.881   0.816   8.969
  292    HD3  PRO  34           1HD      PRO  34  10.183  -0.641   9.942
  293    H    ALA  35           H        ALA  35   9.479   3.363  11.291
  294    HA   ALA  35           HA       ALA  35   7.075   4.575  12.384
  295    HB1  ALA  35           3HB      ALA  35   9.785   5.630  13.206
  296    HB2  ALA  35           1HB      ALA  35   8.686   4.727  14.248
  297    HB3  ALA  35           2HB      ALA  35   8.215   6.312  13.634
  298    H    HIS  36           H        HIS  36   6.866   4.565   9.975
  299    HA   HIS  36           HA       HIS  36   7.924   7.088   8.881
  300    HB2  HIS  36           2HB      HIS  36   7.827   4.456   7.370
  301    HB3  HIS  36           1HB      HIS  36   8.232   6.016   6.661
  302    HD1  HIS  36           HD1      HIS  36  10.029   3.244   7.176
  303    HD2  HIS  36           HD2      HIS  36  10.434   7.017   8.886
  304    HE1  HIS  36           HE1      HIS  36  12.390   3.364   8.001
  305    HE2  HIS  36           HE2      HIS  36  12.542   5.555   9.211
  306    H    ASP  37           H        ASP  37   6.589   8.033   7.204
  307    HA   ASP  37           HA       ASP  37   3.821   7.807   7.889
  308    HB2  ASP  37           2HB      ASP  37   4.883   9.980   7.473
  309    HB3  ASP  37           1HB      ASP  37   5.182   9.523   5.799
  310    H    TYR  38           H        TYR  38   2.069   7.629   6.360
  311    HA   TYR  38           HA       TYR  38   2.643   5.843   4.074
  312    HB2  TYR  38           2HB      TYR  38   0.375   4.911   4.387
  313    HB3  TYR  38           1HB      TYR  38   1.364   4.693   5.826
  314    HD1  TYR  38           HD2      TYR  38   0.884   5.956   7.875
  315    HD2  TYR  38           HD1      TYR  38  -1.560   6.391   4.415
  316    HE1  TYR  38           HE2      TYR  38  -0.848   7.042   9.240
  317    HE2  TYR  38           HE1      TYR  38  -3.297   7.480   5.769
  318    HH   TYR  38           HH       TYR  38  -4.018   7.554   8.142
  319    H    PHE  39           H        PHE  39   1.244   6.126   2.161
  320    HA   PHE  39           HA       PHE  39   0.727   8.962   1.742
  321    HB2  PHE  39           2HB      PHE  39   2.002   7.463   0.112
  322    HB3  PHE  39           1HB      PHE  39   0.443   6.780  -0.325
  323    HD1  PHE  39           HD2      PHE  39   2.434   9.889  -0.273
  324    HD2  PHE  39           HD1      PHE  39  -1.008   7.913  -1.806
  325    HE1  PHE  39           HE2      PHE  39   2.103  11.722  -1.885
  326    HE2  PHE  39           HE1      PHE  39  -1.346   9.736  -3.417
  327    HZ   PHE  39           HZ       PHE  39   0.214  11.644  -3.462
  328    H    GLU  40           H        GLU  40  -1.217   6.406   0.199
  329    HA   GLU  40           HA       GLU  40  -3.443   6.701   1.947
  330    HB2  GLU  40           2HB      GLU  40  -5.030   7.781   0.455
  331    HB3  GLU  40           1HB      GLU  40  -3.672   8.846   0.782
  332    HG2  GLU  40           2HG      GLU  40  -2.705   8.148  -1.420
  333    HG3  GLU  40           1HG      GLU  40  -4.215   7.297  -1.743
  334    H    PHE  41           H        PHE  41  -5.436   5.544   1.069
  335    HA   PHE  41           HA       PHE  41  -4.620   3.276  -0.623
  336    HB2  PHE  41           2HB      PHE  41  -5.931   2.890   2.077
  337    HB3  PHE  41           1HB      PHE  41  -5.245   1.652   1.028
  338    HD1  PHE  41           HD1      PHE  41  -2.787   1.446   0.801
  339    HD2  PHE  41           HD2      PHE  41  -4.556   4.185   3.542
  340    HE1  PHE  41           HE1      PHE  41  -0.630   1.676   1.962
  341    HE2  PHE  41           HE2      PHE  41  -2.402   4.414   4.704
  342    HZ   PHE  41           HZ       PHE  41  -0.435   3.162   3.911
  343    H    PHE  42           H        PHE  42  -6.496   1.804  -1.127
  344    HA   PHE  42           HA       PHE  42  -8.847   3.463  -1.713
  345    HB2  PHE  42           2HB      PHE  42  -9.384   1.825  -3.439
  346    HB3  PHE  42           1HB      PHE  42  -7.731   2.396  -3.624
  347    HD1  PHE  42           HD2      PHE  42  -5.842   0.909  -3.185
  348    HD2  PHE  42           HD1      PHE  42  -9.856  -0.479  -2.846
  349    HE1  PHE  42           HE2      PHE  42  -5.039  -1.417  -3.220
  350    HE2  PHE  42           HE1      PHE  42  -9.057  -2.807  -2.883
  351    HZ   PHE  42           HZ       PHE  42  -6.644  -3.275  -3.069
  352    H    ALA  43           H        ALA  43 -10.985   2.326  -1.777
  353    HA   ALA  43           HA       ALA  43 -11.270   0.197   0.236
  354    HB1  ALA  43           3HB      ALA  43 -13.204   1.333   1.232
  355    HB2  ALA  43           1HB      ALA  43 -12.942   2.712   0.165
  356    HB3  ALA  43           2HB      ALA  43 -11.736   2.302   1.385
  357    H    ALA  44           H        ALA  44 -12.079  -1.464  -0.916
  358    HA   ALA  44           HA       ALA  44 -14.154  -0.884  -2.942
  359    HB1  ALA  44           3HB      ALA  44 -12.001  -1.476  -3.962
  360    HB2  ALA  44           1HB      ALA  44 -13.251  -2.670  -4.318
  361    HB3  ALA  44           2HB      ALA  44 -12.022  -3.015  -3.098
  362    H    ASP  45           H        ASP  45 -15.278  -3.031  -3.622
  363    HA   ASP  45           HA       ASP  45 -16.282  -4.343  -1.204
  364    HB2  ASP  45           2HB      ASP  45 -17.338  -4.183  -4.037
  365    HB3  ASP  45           1HB      ASP  45 -18.057  -5.212  -2.803
  366    H    LEU  46           H        LEU  46 -15.456  -6.270  -0.667
  367    HA   LEU  46           HA       LEU  46 -14.091  -7.963  -2.558
  368    HB2  LEU  46           2HB      LEU  46 -14.083  -9.558  -0.506
  369    HB3  LEU  46           1HB      LEU  46 -13.119  -8.097  -0.469
  370    HG   LEU  46           HG       LEU  46 -14.929  -7.003   0.886
  371   HD11  LEU  46          1HD1      LEU  46 -16.066  -9.799   1.003
  372   HD12  LEU  46          2HD1      LEU  46 -16.824  -8.386   0.265
  373   HD13  LEU  46          3HD1      LEU  46 -16.576  -8.441   2.010
  374   HD21  LEU  46          3HD2      LEU  46 -12.937  -7.902   1.943
  375   HD22  LEU  46          1HD2      LEU  46 -13.682  -9.497   2.042
  376   HD23  LEU  46          2HD2      LEU  46 -14.345  -8.154   2.973
  377    H    SER  47           H        SER  47 -16.603  -7.571  -3.518
  378    HA   SER  47           HA       SER  47 -18.094 -10.060  -2.952
  379    HB2  SER  47           2HB      SER  47 -20.138  -8.864  -3.576
  380    HB3  SER  47           1HB      SER  47 -19.305  -7.985  -2.296
  381    HG   SER  47           HG       SER  47 -19.772  -6.443  -3.748
  382    H    LEU  48           H        LEU  48 -19.731 -10.371  -4.970
  383    HA   LEU  48           HA       LEU  48 -18.018 -10.830  -7.271
  384    HB2  LEU  48           2HB      LEU  48 -20.933 -11.496  -6.827
  385    HB3  LEU  48           1HB      LEU  48 -19.967 -12.033  -8.189
  386    HG   LEU  48           HG       LEU  48 -19.532 -12.798  -5.295
  387   HD11  LEU  48          1HD1      LEU  48 -20.198 -15.039  -6.020
  388   HD12  LEU  48          2HD1      LEU  48 -20.536 -14.420  -7.636
  389   HD13  LEU  48          3HD1      LEU  48 -21.493 -13.868  -6.263
  390   HD21  LEU  48          3HD2      LEU  48 -18.036 -13.631  -7.785
  391   HD22  LEU  48          1HD2      LEU  48 -17.841 -14.359  -6.189
  392   HD23  LEU  48          2HD2      LEU  48 -17.407 -12.671  -6.445
  393    H    TYR  49           H        TYR  49 -19.317  -8.086  -6.381
  394    HA   TYR  49           HA       TYR  49 -20.566  -7.359  -8.940
  395    HB2  TYR  49           2HB      TYR  49 -20.346  -5.757  -6.374
  396    HB3  TYR  49           1HB      TYR  49 -21.277  -5.307  -7.799
  397    HD1  TYR  49           HD2      TYR  49 -23.130  -7.008  -8.534
  398    HD2  TYR  49           HD1      TYR  49 -21.397  -6.914  -4.645
  399    HE1  TYR  49           HE2      TYR  49 -25.087  -8.197  -7.637
  400    HE2  TYR  49           HE1      TYR  49 -23.348  -8.105  -3.742
  401    HH   TYR  49           HH       TYR  49 -25.778  -8.405  -4.371
  402    HA   PRO  50           HA       PRO  50 -16.841  -5.350 -10.323
  403    HB2  PRO  50           2HB      PRO  50 -17.892  -3.627 -12.153
  404    HB3  PRO  50           1HB      PRO  50 -17.754  -5.365 -12.435
  405    HG2  PRO  50           2HG      PRO  50 -20.139  -3.771 -11.565
  406    HG3  PRO  50           1HG      PRO  50 -20.045  -5.081 -12.757
  407    HD2  PRO  50           2HD      PRO  50 -20.941  -5.476 -10.227
  408    HD3  PRO  50           1HD      PRO  50 -20.075  -6.729 -11.139
  409    H    HIS  51           H        HIS  51 -15.999  -4.132  -8.654
  410    HA   HIS  51           HA       HIS  51 -17.200  -1.541  -8.008
  411    HB2  HIS  51           2HB      HIS  51 -16.420  -3.080  -6.189
  412    HB3  HIS  51           1HB      HIS  51 -14.772  -2.870  -6.767
  413    HD1  HIS  51           HD1      HIS  51 -17.392  -1.256  -4.717
  414    HD2  HIS  51           HD2      HIS  51 -13.681  -0.258  -6.297
  415    HE1  HIS  51           HE1      HIS  51 -16.685   0.827  -3.514
  416    HE2  HIS  51           HE2      HIS  51 -14.525   1.505  -4.599
  417    H    LEU  52           H        LEU  52 -16.266   0.424  -8.472
  418    HA   LEU  52           HA       LEU  52 -14.580   0.684 -10.687
  419    HB2  LEU  52           2HB      LEU  52 -15.130   2.684  -8.486
  420    HB3  LEU  52           1HB      LEU  52 -14.406   3.070 -10.039
  421    HG   LEU  52           HG       LEU  52 -17.208   2.000  -9.618
  422   HD11  LEU  52          1HD1      LEU  52 -17.924   4.211 -10.413
  423   HD12  LEU  52          2HD1      LEU  52 -16.241   4.741 -10.421
  424   HD13  LEU  52          3HD1      LEU  52 -17.021   4.303  -8.901
  425   HD21  LEU  52          3HD2      LEU  52 -16.267   1.202 -11.724
  426   HD22  LEU  52          1HD2      LEU  52 -15.813   2.851 -12.162
  427   HD23  LEU  52          2HD2      LEU  52 -17.514   2.412 -12.016
  428    H    TYR  53           H        TYR  53 -12.400   1.415 -10.899
  429    HA   TYR  53           HA       TYR  53 -10.725  -0.049  -9.046
  430    HB2  TYR  53           2HB      TYR  53 -10.117   1.291 -11.684
  431    HB3  TYR  53           1HB      TYR  53  -8.930   0.402 -10.736
  432    HD1  TYR  53           HD1      TYR  53  -9.126  -2.033 -10.462
  433    HD2  TYR  53           HD2      TYR  53 -11.825   0.130 -12.948
  434    HE1  TYR  53           HE1      TYR  53  -9.834  -4.134 -11.516
  435    HE2  TYR  53           HE2      TYR  53 -12.540  -1.971 -14.005
  436    HH   TYR  53           HH       TYR  53 -11.792  -5.021 -12.734
  437    H    SER  54           H        SER  54  -9.231   0.683  -7.697
  438    HA   SER  54           HA       SER  54  -8.075   3.335  -7.908
  439    HB2  SER  54           2HB      SER  54  -9.587   2.486  -5.413
  440    HB3  SER  54           1HB      SER  54  -8.540   3.900  -5.517
  441    HG   SER  54           HG       SER  54 -10.337   3.932  -7.525
  442    H    ARG  55           H        ARG  55  -6.042   3.468  -6.829
  443    HA   ARG  55           HA       ARG  55  -4.992   0.847  -5.924
  444    HB2  ARG  55           2HB      ARG  55  -3.617   2.996  -7.553
  445    HB3  ARG  55           1HB      ARG  55  -2.821   1.554  -6.930
  446    HG2  ARG  55           2HG      ARG  55  -4.144   0.129  -8.312
  447    HG3  ARG  55           1HG      ARG  55  -5.198   1.464  -8.786
  448    HD2  ARG  55           2HD      ARG  55  -2.256   1.240  -9.445
  449    HD3  ARG  55           1HD      ARG  55  -3.581   0.850 -10.544
  450    HE   ARG  55           HE       ARG  55  -3.500   3.548  -9.430
  451   HH11  ARG  55          1HH1      ARG  55  -2.983   1.480 -12.141
  452   HH12  ARG  55          2HH1      ARG  55  -2.914   2.795 -13.258
  453   HH21  ARG  55          1HH2      ARG  55  -3.447   5.214 -10.885
  454   HH22  ARG  55          2HH2      ARG  55  -3.181   4.878 -12.564
  455    H    ALA  56           H        ALA  56  -3.031   0.974  -4.548
  456    HA   ALA  56           HA       ALA  56  -3.287   3.170  -2.597
  457    HB1  ALA  56           3HB      ALA  56  -2.122   0.406  -2.232
  458    HB2  ALA  56           1HB      ALA  56  -3.739   0.916  -1.744
  459    HB3  ALA  56           2HB      ALA  56  -2.322   1.626  -0.972
  460    H    TYR  57           H        TYR  57  -1.370   4.066  -1.619
  461    HA   TYR  57           HA       TYR  57   1.161   3.631  -3.069
  462    HB2  TYR  57           2HB      TYR  57   0.036   6.383  -2.480
  463    HB3  TYR  57           1HB      TYR  57   1.539   6.020  -3.320
  464    HD1  TYR  57           HD2      TYR  57   1.497   5.208  -5.641
  465    HD2  TYR  57           HD1      TYR  57  -2.106   6.194  -3.602
  466    HE1  TYR  57           HE2      TYR  57   0.298   5.232  -7.786
  467    HE2  TYR  57           HE1      TYR  57  -3.317   6.222  -5.743
  468    HH   TYR  57           HH       TYR  57  -2.967   6.397  -8.061
  469    H    ILE  58           H        ILE  58   3.076   4.306  -1.882
  470    HA   ILE  58           HA       ILE  58   2.684   4.847   0.998
  471    HB   ILE  58           HB       ILE  58   4.544   2.693  -0.051
  472   HG12  ILE  58          2HG1      ILE  58   1.962   2.294   1.491
  473   HG13  ILE  58          1HG1      ILE  58   2.093   2.112  -0.254
  474   HG21  ILE  58          1HG2      ILE  58   4.830   2.114   2.314
  475   HG22  ILE  58          2HG2      ILE  58   3.773   3.450   2.772
  476   HG23  ILE  58          3HG2      ILE  58   5.321   3.779   1.994
  477   HD11  ILE  58          3HD1      ILE  58   3.678   0.295   0.039
  478   HD12  ILE  58          1HD1      ILE  58   2.168  -0.031   0.893
  479   HD13  ILE  58          2HD1      ILE  58   3.593   0.492   1.791
  480    H    ASN  59           H        ASN  59   4.163   6.354   1.793
  481    HA   ASN  59           HA       ASN  59   6.365   7.065  -0.027
  482    HB2  ASN  59           2HB      ASN  59   6.437   9.256   1.083
  483    HB3  ASN  59           1HB      ASN  59   4.848   8.912   0.417
  484   HD21  ASN  59          1HD2      ASN  59   3.115   8.597   1.836
  485   HD22  ASN  59          2HD2      ASN  59   3.212   9.040   3.503
  486    H    PHE  60           H        PHE  60   8.015   5.707   0.519
  487    HA   PHE  60           HA       PHE  60   8.803   5.130   3.185
  488    HB2  PHE  60           2HB      PHE  60  10.067   4.732   0.490
  489    HB3  PHE  60           1HB      PHE  60  11.028   4.479   1.943
  490    HD1  PHE  60           HD2      PHE  60   7.920   3.375   0.212
  491    HD2  PHE  60           HD1      PHE  60  10.860   2.511   3.171
  492    HE1  PHE  60           HE2      PHE  60   7.012   1.101   0.457
  493    HE2  PHE  60           HE1      PHE  60   9.955   0.247   3.420
  494    HZ   PHE  60           HZ       PHE  60   8.028  -0.469   2.061
  495    H    ARG  61           H        ARG  61   9.556   6.555   4.569
  496    HA   ARG  61           HA       ARG  61  10.675   9.077   3.712
  497    HB2  ARG  61           2HB      ARG  61  10.288   8.010   6.521
  498    HB3  ARG  61           1HB      ARG  61  10.557   9.688   6.064
  499    HG2  ARG  61           2HG      ARG  61   8.141   8.047   5.295
  500    HG3  ARG  61           1HG      ARG  61   8.207   9.204   6.624
  501    HD2  ARG  61           2HD      ARG  61   8.612   9.838   3.695
  502    HD3  ARG  61           1HD      ARG  61   7.160  10.178   4.637
  503    HE   ARG  61           HE       ARG  61   9.638  11.346   5.600
  504   HH11  ARG  61          1HH1      ARG  61   6.682  11.788   3.899
  505   HH12  ARG  61          2HH1      ARG  61   6.762  13.509   3.993
  506   HH21  ARG  61          1HH2      ARG  61   9.734  13.533   5.733
  507   HH22  ARG  61          2HH2      ARG  61   8.484  14.499   5.024
  508    H    ASN  62           H        ASN  62  12.117   6.147   4.020
  509    HA   ASN  62           HA       ASN  62  14.714   7.324   4.745
  510    HB2  ASN  62           2HB      ASN  62  13.812   6.196   6.755
  511    HB3  ASN  62           1HB      ASN  62  13.644   4.706   5.842
  512   HD21  ASN  62          1HD2      ASN  62  15.020   3.593   7.255
  513   HD22  ASN  62          2HD2      ASN  62  16.729   3.866   7.268
  514    HA   PRO  63           HA       PRO  63  15.690   5.414   0.809
  515    HB2  PRO  63           2HB      PRO  63  18.449   5.502   1.080
  516    HB3  PRO  63           1HB      PRO  63  17.443   6.838   0.511
  517    HG2  PRO  63           2HG      PRO  63  18.544   6.330   3.250
  518    HG3  PRO  63           1HG      PRO  63  18.432   7.857   2.352
  519    HD2  PRO  63           2HD      PRO  63  16.695   7.269   4.301
  520    HD3  PRO  63           1HD      PRO  63  16.167   8.117   2.829
  521    H    ASP  64           H        ASP  64  17.580   4.333   3.652
  522    HA   ASP  64           HA       ASP  64  18.243   1.786   2.584
  523    HB2  ASP  64           2HB      ASP  64  18.059   2.562   5.505
  524    HB3  ASP  64           1HB      ASP  64  19.011   1.248   4.815
  525    H    ASP  65           H        ASP  65  15.455   3.003   4.264
  526    HA   ASP  65           HA       ASP  65  14.338   0.526   5.112
  527    HB2  ASP  65           2HB      ASP  65  13.812   2.891   5.941
  528    HB3  ASP  65           1HB      ASP  65  12.803   3.059   4.510
  529    H    ILE  66           H        ILE  66  14.183   2.392   2.142
  530    HA   ILE  66           HA       ILE  66  12.009   1.225   0.848
  531    HB   ILE  66           HB       ILE  66  14.611   2.148  -0.402
  532   HG12  ILE  66          2HG1      ILE  66  12.015   3.647   0.061
  533   HG13  ILE  66          1HG1      ILE  66  13.512   3.898   0.952
  534   HG21  ILE  66          1HG2      ILE  66  13.313   2.438  -2.462
  535   HG22  ILE  66          2HG2      ILE  66  11.894   1.754  -1.668
  536   HG23  ILE  66          3HG2      ILE  66  13.322   0.754  -1.938
  537   HD11  ILE  66          3HD1      ILE  66  13.184   5.622  -0.717
  538   HD12  ILE  66          1HD1      ILE  66  13.098   4.402  -1.986
  539   HD13  ILE  66          2HD1      ILE  66  14.603   4.647  -1.100
  540    H    LEU  67           H        LEU  67  15.446   0.293   0.394
  541    HA   LEU  67           HA       LEU  67  14.790  -2.117  -0.965
  542    HB2  LEU  67           2HB      LEU  67  17.214  -2.673  -0.672
  543    HB3  LEU  67           1HB      LEU  67  16.891  -1.140  -1.451
  544    HG   LEU  67           HG       LEU  67  17.269  -0.110   0.909
  545   HD11  LEU  67          1HD1      LEU  67  17.290  -2.182   2.183
  546   HD12  LEU  67          2HD1      LEU  67  18.841  -1.353   2.315
  547   HD13  LEU  67          3HD1      LEU  67  18.678  -2.755   1.258
  548   HD21  LEU  67          3HD2      LEU  67  18.738   0.256  -0.999
  549   HD22  LEU  67          1HD2      LEU  67  19.560  -1.271  -0.677
  550   HD23  LEU  67          2HD2      LEU  67  19.674   0.055   0.482
  551    H    LEU  68           H        LEU  68  15.194  -1.312   2.394
  552    HA   LEU  68           HA       LEU  68  15.583  -3.836   3.524
  553    HB2  LEU  68           2HB      LEU  68  15.762  -1.874   4.880
  554    HB3  LEU  68           1HB      LEU  68  14.110  -1.403   4.529
  555    HG   LEU  68           HG       LEU  68  13.288  -3.341   5.824
  556   HD11  LEU  68          1HD1      LEU  68  16.205  -3.773   6.493
  557   HD12  LEU  68          2HD1      LEU  68  15.189  -4.843   5.528
  558   HD13  LEU  68          3HD1      LEU  68  14.841  -4.608   7.240
  559   HD21  LEU  68          3HD2      LEU  68  13.504  -1.184   6.920
  560   HD22  LEU  68          1HD2      LEU  68  15.185  -1.529   7.325
  561   HD23  LEU  68          2HD2      LEU  68  13.889  -2.482   8.048
  562    H    PHE  69           H        PHE  69  12.451  -2.128   3.245
  563    HA   PHE  69           HA       PHE  69  10.984  -4.520   3.808
  564    HB2  PHE  69           2HB      PHE  69  10.279  -1.688   3.203
  565    HB3  PHE  69           1HB      PHE  69   9.016  -2.910   3.054
  566    HD1  PHE  69           HD1      PHE  69  11.242  -1.135   5.359
  567    HD2  PHE  69           HD2      PHE  69   8.205  -4.096   5.007
  568    HE1  PHE  69           HE1      PHE  69  10.915  -1.087   7.799
  569    HE2  PHE  69           HE2      PHE  69   7.870  -4.053   7.437
  570    HZ   PHE  69           HZ       PHE  69   9.224  -2.546   8.841
  571    H    ARG  70           H        ARG  70  11.889  -2.866   0.827
  572    HA   ARG  70           HA       ARG  70  10.181  -4.106  -0.981
  573    HB2  ARG  70           2HB      ARG  70  11.585  -2.497  -1.943
  574    HB3  ARG  70           1HB      ARG  70  13.036  -3.193  -1.230
  575    HG2  ARG  70           2HG      ARG  70  12.802  -5.145  -2.741
  576    HG3  ARG  70           1HG      ARG  70  11.414  -4.362  -3.494
  577    HD2  ARG  70           2HD      ARG  70  12.717  -2.771  -4.538
  578    HD3  ARG  70           1HD      ARG  70  14.014  -2.894  -3.349
  579    HE   ARG  70           HE       ARG  70  14.561  -5.074  -4.375
  580   HH11  ARG  70          1HH1      ARG  70  12.741  -2.825  -6.261
  581   HH12  ARG  70          2HH1      ARG  70  13.295  -3.490  -7.756
  582   HH21  ARG  70          1HH2      ARG  70  15.261  -5.883  -6.295
  583   HH22  ARG  70          2HH2      ARG  70  14.685  -5.195  -7.777
  584    H    ASP  71           H        ASP  71  13.367  -5.327   0.109
  585    HA   ASP  71           HA       ASP  71  13.300  -7.604  -1.561
  586    HB2  ASP  71           2HB      ASP  71  15.312  -6.424  -0.451
  587    HB3  ASP  71           1HB      ASP  71  14.954  -7.432   0.949
  588    H    ARG  72           H        ARG  72  11.612  -7.035   1.316
  589    HA   ARG  72           HA       ARG  72  11.229  -9.934   1.764
  590    HB2  ARG  72           2HB      ARG  72  10.451  -9.256   4.066
  591    HB3  ARG  72           1HB      ARG  72  12.157  -8.974   3.738
  592    HG2  ARG  72           2HG      ARG  72  11.709  -6.612   3.338
  593    HG3  ARG  72           1HG      ARG  72   9.990  -6.882   3.619
  594    HD2  ARG  72           2HD      ARG  72  12.127  -7.444   5.672
  595    HD3  ARG  72           1HD      ARG  72  11.257  -5.916   5.560
  596    HE   ARG  72           HE       ARG  72   9.428  -8.067   5.714
  597   HH11  ARG  72          1HH1      ARG  72  11.715  -6.378   7.671
  598   HH12  ARG  72          2HH1      ARG  72  10.789  -6.589   9.116
  599   HH21  ARG  72          1HH2      ARG  72   8.272  -8.346   7.582
  600   HH22  ARG  72          2HH2      ARG  72   8.878  -7.698   9.068
  601    H    PHE  73           H        PHE  73   9.757  -7.442   0.248
  602    HA   PHE  73           HA       PHE  73   7.075  -8.568   0.729
  603    HB2  PHE  73           2HB      PHE  73   7.896  -5.689   0.898
  604    HB3  PHE  73           1HB      PHE  73   6.276  -6.094   0.352
  605    HD1  PHE  73           HD1      PHE  73   4.712  -7.252   1.861
  606    HD2  PHE  73           HD2      PHE  73   8.512  -5.890   3.217
  607    HE1  PHE  73           HE1      PHE  73   3.944  -7.438   4.188
  608    HE2  PHE  73           HE2      PHE  73   7.749  -6.078   5.546
  609    HZ   PHE  73           HZ       PHE  73   5.463  -6.854   6.035
  610    H    ASP  74           H        ASP  74   9.407  -7.818  -1.542
  611    HA   ASP  74           HA       ASP  74   7.980  -6.696  -3.657
  612    HB2  ASP  74           2HB      ASP  74   9.794  -7.538  -5.109
  613    HB3  ASP  74           1HB      ASP  74  10.393  -6.746  -3.657
  614    H    GLY  75           H        GLY  75   5.958  -7.630  -3.923
  615    HA2  GLY  75           2HA      GLY  75   4.564  -8.865  -5.304
  616    HA3  GLY  75           1HA      GLY  75   5.950  -9.810  -5.818
  617    H    TYR  76           H        TYR  76   5.049  -9.437  -2.428
  618    HA   TYR  76           HA       TYR  76   4.863 -12.295  -2.128
  619    HB2  TYR  76           2HB      TYR  76   4.891 -11.934   0.156
  620    HB3  TYR  76           1HB      TYR  76   5.683 -10.470  -0.409
  621    HD1  TYR  76           HD1      TYR  76   4.199  -8.355  -0.667
  622    HD2  TYR  76           HD2      TYR  76   3.009 -11.810   1.522
  623    HE1  TYR  76           HE1      TYR  76   2.534  -7.012   0.548
  624    HE2  TYR  76           HE2      TYR  76   1.343 -10.477   2.738
  625    HH   TYR  76           HH       TYR  76   0.474  -7.311   1.798
  626    H    ILE  77           H        ILE  77   3.006 -13.482  -1.384
  627    HA   ILE  77           HA       ILE  77   0.551 -12.495  -2.630
  628    HB   ILE  77           HB       ILE  77   1.206 -15.255  -1.570
  629   HG12  ILE  77          2HG1      ILE  77   2.594 -14.532  -3.514
  630   HG13  ILE  77          1HG1      ILE  77   1.548 -15.896  -3.893
  631   HG21  ILE  77          1HG2      ILE  77  -1.195 -14.849  -1.561
  632   HG22  ILE  77          2HG2      ILE  77  -0.778 -15.980  -2.849
  633   HG23  ILE  77          3HG2      ILE  77  -1.130 -14.294  -3.234
  634   HD11  ILE  77          3HD1      ILE  77  -0.002 -14.380  -5.021
  635   HD12  ILE  77          1HD1      ILE  77   1.618 -14.289  -5.709
  636   HD13  ILE  77          2HD1      ILE  77   1.047 -13.019  -4.629
  637    H    PHE  78           H        PHE  78  -0.491 -11.152  -1.201
  638    HA   PHE  78           HA       PHE  78  -1.071 -12.063   1.507
  639    HB2  PHE  78           2HB      PHE  78  -0.647  -9.697   1.255
  640    HB3  PHE  78           1HB      PHE  78  -1.873  -9.562  -0.001
  641    HD1  PHE  78           HD1      PHE  78  -1.477 -10.480   3.594
  642    HD2  PHE  78           HD2      PHE  78  -4.031  -8.915   0.565
  643    HE1  PHE  78           HE1      PHE  78  -3.173  -9.955   5.297
  644    HE2  PHE  78           HE2      PHE  78  -5.729  -8.389   2.262
  645    HZ   PHE  78           HZ       PHE  78  -5.301  -8.907   4.632
  646    H    LEU  79           H        LEU  79  -2.938 -13.022   2.159
  647    HA   LEU  79           HA       LEU  79  -5.075 -13.356   0.145
  648    HB2  LEU  79           2HB      LEU  79  -4.182 -15.130   2.414
  649    HB3  LEU  79           1HB      LEU  79  -5.702 -15.374   1.572
  650    HG   LEU  79           HG       LEU  79  -3.010 -15.392   0.194
  651   HD11  LEU  79          1HD1      LEU  79  -3.139 -17.227   1.815
  652   HD12  LEU  79          2HD1      LEU  79  -3.194 -17.823   0.155
  653   HD13  LEU  79          3HD1      LEU  79  -4.674 -17.740   1.111
  654   HD21  LEU  79          3HD2      LEU  79  -4.265 -16.467  -1.628
  655   HD22  LEU  79          1HD2      LEU  79  -4.875 -14.851  -1.272
  656   HD23  LEU  79          2HD2      LEU  79  -5.758 -16.268  -0.706
  657    H    ASP  80           H        ASP  80  -6.904 -12.291   0.497
  658    HA   ASP  80           HA       ASP  80  -7.588 -11.199   3.088
  659    HB2  ASP  80           2HB      ASP  80  -8.063  -9.971   0.992
  660    HB3  ASP  80           1HB      ASP  80  -9.163 -11.251   0.492
  661    H    SER  81           H        SER  81  -9.940 -11.532   3.894
  662    HA   SER  81           HA       SER  81 -10.434 -14.172   4.647
  663    HB2  SER  81           2HB      SER  81 -12.394 -11.866   4.446
  664    HB3  SER  81           1HB      SER  81 -12.722 -13.381   5.281
  665    HG   SER  81           HG       SER  81 -10.903 -11.328   5.954
  666    H    LYS  82           H        LYS  82 -11.614 -12.388   1.831
  667    HA   LYS  82           HA       LYS  82 -13.333 -14.543   0.957
  668    HB2  LYS  82           2HB      LYS  82 -12.528 -11.884  -0.164
  669    HB3  LYS  82           1HB      LYS  82 -13.268 -13.069  -1.230
  670    HG2  LYS  82           2HG      LYS  82 -14.486 -12.007   1.320
  671    HG3  LYS  82           1HG      LYS  82 -14.911 -11.501  -0.318
  672    HD2  LYS  82           2HD      LYS  82 -15.587 -13.827  -0.828
  673    HD3  LYS  82           1HD      LYS  82 -15.227 -14.280   0.837
  674    HE2  LYS  82           2HE      LYS  82 -16.944 -12.695   1.618
  675    HE3  LYS  82           1HE      LYS  82 -17.313 -12.288  -0.059
  676    HZ1  LYS  82           3HZ      LYS  82 -17.909 -14.624  -0.427
  677    HZ2  LYS  82           1HZ      LYS  82 -18.874 -13.907   0.764
  678    HZ3  LYS  82           2HZ      LYS  82 -17.624 -14.953   1.205
  679    H    GLY  83           H        GLY  83 -10.211 -14.761   1.222
  680    HA2  GLY  83           2HA      GLY  83  -8.592 -16.044   0.219
  681    HA3  GLY  83           1HA      GLY  83  -9.883 -16.771  -0.720
  682    H    LEU  84           H        LEU  84  -9.083 -13.352  -0.813
  683    HA   LEU  84           HA       LEU  84  -8.559 -13.552  -3.669
  684    HB2  LEU  84           2HB      LEU  84  -8.630 -11.099  -1.895
  685    HB3  LEU  84           1HB      LEU  84  -8.600 -11.110  -3.648
  686    HG   LEU  84           HG       LEU  84 -10.866 -12.151  -1.931
  687   HD11  LEU  84          1HD1      LEU  84 -12.118 -10.232  -2.771
  688   HD12  LEU  84          2HD1      LEU  84 -10.688  -9.662  -3.633
  689   HD13  LEU  84          3HD1      LEU  84 -10.692  -9.715  -1.870
  690   HD21  LEU  84          3HD2      LEU  84 -10.683 -13.406  -4.005
  691   HD22  LEU  84          1HD2      LEU  84 -10.625 -11.906  -4.933
  692   HD23  LEU  84          2HD2      LEU  84 -12.092 -12.346  -4.055
  693    H    GLU  85           H        GLU  85  -6.555 -13.873  -4.410
  694    HA   GLU  85           HA       GLU  85  -4.216 -13.497  -2.803
  695    HB2  GLU  85           2HB      GLU  85  -4.526 -14.115  -5.747
  696    HB3  GLU  85           1HB      GLU  85  -2.987 -14.083  -4.901
  697    HG2  GLU  85           2HG      GLU  85  -3.766 -15.900  -3.441
  698    HG3  GLU  85           1HG      GLU  85  -5.283 -15.951  -4.338
  699    H    TYR  86           H        TYR  86  -3.162 -11.666  -2.494
  700    HA   TYR  86           HA       TYR  86  -3.209  -9.583  -4.585
  701    HB2  TYR  86           2HB      TYR  86  -2.845  -9.280  -1.589
  702    HB3  TYR  86           1HB      TYR  86  -2.701  -7.968  -2.754
  703    HD1  TYR  86           HD1      TYR  86  -4.721  -7.207  -4.012
  704    HD2  TYR  86           HD2      TYR  86  -5.004 -10.035  -0.839
  705    HE1  TYR  86           HE1      TYR  86  -7.138  -6.783  -3.851
  706    HE2  TYR  86           HE2      TYR  86  -7.421  -9.613  -0.675
  707    HH   TYR  86           HH       TYR  86  -9.161  -7.924  -3.050
  708    HA   PRO  87           HA       PRO  87   1.196 -10.904  -4.504
  709    HB2  PRO  87           2HB      PRO  87   1.295 -10.173  -7.299
  710    HB3  PRO  87           1HB      PRO  87   1.422 -11.780  -6.584
  711    HG2  PRO  87           2HG      PRO  87  -0.698 -10.901  -8.118
  712    HG3  PRO  87           1HG      PRO  87  -0.779 -12.246  -6.969
  713    HD2  PRO  87           2HD      PRO  87  -1.728  -9.428  -6.675
  714    HD3  PRO  87           1HD      PRO  87  -2.428 -10.934  -6.040
  715    H    ALA  88           H        ALA  88   1.089  -8.802  -3.196
  716    HA   ALA  88           HA       ALA  88   1.028  -6.286  -4.448
  717    HB1  ALA  88           3HB      ALA  88   2.140  -6.991  -1.734
  718    HB2  ALA  88           1HB      ALA  88   0.449  -6.645  -2.101
  719    HB3  ALA  88           2HB      ALA  88   1.666  -5.386  -2.285
  720    H    VAL  89           H        VAL  89   2.492  -5.768  -5.966
  721    HA   VAL  89           HA       VAL  89   5.321  -6.374  -5.604
  722    HB   VAL  89           HB       VAL  89   3.924  -4.958  -7.894
  723   HG11  VAL  89          1HG1      VAL  89   6.720  -6.097  -7.747
  724   HG12  VAL  89          2HG1      VAL  89   6.303  -4.381  -7.731
  725   HG13  VAL  89          3HG1      VAL  89   5.966  -5.357  -9.161
  726   HG21  VAL  89          3HG2      VAL  89   3.160  -7.261  -7.659
  727   HG22  VAL  89          1HG2      VAL  89   4.829  -7.832  -7.647
  728   HG23  VAL  89          2HG2      VAL  89   4.162  -7.085  -9.099
  729    H    VAL  90           H        VAL  90   5.991  -5.009  -3.919
  730    HA   VAL  90           HA       VAL  90   5.572  -2.174  -4.011
  731    HB   VAL  90           HB       VAL  90   5.870  -3.249  -1.859
  732   HG11  VAL  90          1HG1      VAL  90   8.013  -4.196  -1.142
  733   HG12  VAL  90          2HG1      VAL  90   8.669  -3.943  -2.760
  734   HG13  VAL  90          3HG1      VAL  90   7.345  -5.081  -2.514
  735   HG21  VAL  90          3HG2      VAL  90   8.174  -1.396  -2.500
  736   HG22  VAL  90          1HG2      VAL  90   7.573  -1.762  -0.881
  737   HG23  VAL  90          2HG2      VAL  90   6.542  -0.914  -2.034
  738    H    GLU  91           H        GLU  91   6.538  -0.864  -5.418
  739    HA   GLU  91           HA       GLU  91   9.380  -1.265  -6.055
  740    HB2  GLU  91           2HB      GLU  91   8.954  -0.841  -8.450
  741    HB3  GLU  91           1HB      GLU  91   8.180  -2.315  -7.888
  742    HG2  GLU  91           2HG      GLU  91   6.035  -1.170  -7.772
  743    HG3  GLU  91           1HG      GLU  91   6.796   0.333  -8.288
  744    H    PHE  92           H        PHE  92  10.512   0.624  -6.639
  745    HA   PHE  92           HA       PHE  92   9.640   2.989  -5.392
  746    HB2  PHE  92           2HB      PHE  92  11.610   4.031  -6.741
  747    HB3  PHE  92           1HB      PHE  92  11.948   2.829  -5.502
  748    HD1  PHE  92           HD2      PHE  92  11.384   3.147  -9.182
  749    HD2  PHE  92           HD1      PHE  92  13.220   0.987  -6.011
  750    HE1  PHE  92           HE2      PHE  92  12.586   1.770 -10.826
  751    HE2  PHE  92           HE1      PHE  92  14.432  -0.400  -7.651
  752    HZ   PHE  92           HZ       PHE  92  14.113  -0.008 -10.063
  753    H    ALA  93           H        ALA  93   9.339   5.097  -6.335
  754    HA   ALA  93           HA       ALA  93   7.601   4.938  -8.712
  755    HB1  ALA  93           3HB      ALA  93   6.488   6.902  -7.868
  756    HB2  ALA  93           1HB      ALA  93   7.694   7.089  -6.594
  757    HB3  ALA  93           2HB      ALA  93   6.601   5.707  -6.577
  758    HA   PRO  94           HA       PRO  94  10.207   7.607 -11.196
  759    HB2  PRO  94           2HB      PRO  94   7.741   9.164 -11.826
  760    HB3  PRO  94           1HB      PRO  94   8.890   8.384 -12.919
  761    HG2  PRO  94           2HG      PRO  94   6.488   7.313 -12.503
  762    HG3  PRO  94           1HG      PRO  94   7.925   6.285 -12.656
  763    HD2  PRO  94           2HD      PRO  94   6.436   7.099 -10.182
  764    HD3  PRO  94           1HD      PRO  94   7.148   5.526 -10.604
  765    H    PHE  95           H        PHE  95  11.384   8.655  -9.569
  766    HA   PHE  95           HA       PHE  95  10.316  10.781  -7.977
  767    HB2  PHE  95           2HB      PHE  95  12.196   9.300  -7.268
  768    HB3  PHE  95           1HB      PHE  95  13.216  10.053  -8.486
  769    HD1  PHE  95           HD1      PHE  95  11.281  10.738  -5.392
  770    HD2  PHE  95           HD2      PHE  95  14.361  12.058  -8.025
  771    HE1  PHE  95           HE1      PHE  95  11.929  12.467  -3.764
  772    HE2  PHE  95           HE2      PHE  95  15.012  13.788  -6.401
  773    HZ   PHE  95           HZ       PHE  95  13.797  13.993  -4.268
  774    H    GLN  96           H        GLN  96  11.750  10.600 -11.106
  775    HA   GLN  96           HA       GLN  96  12.061  13.521 -11.250
  776    HB2  GLN  96           2HB      GLN  96  13.137  11.252 -12.903
  777    HB3  GLN  96           1HB      GLN  96  13.112  12.892 -13.543
  778    HG2  GLN  96           2HG      GLN  96  14.434  12.112 -10.948
  779    HG3  GLN  96           1HG      GLN  96  15.272  12.237 -12.497
  780   HE21  GLN  96          1HE2      GLN  96  13.507  14.040 -10.059
  781   HE22  GLN  96          2HE2      GLN  96  14.135  15.591 -10.489
  782    H    LYS  97           H        LYS  97  11.390  14.563 -13.305
  783    HA   LYS  97           HA       LYS  97   8.655  14.524 -13.634
  784    HB2  LYS  97           2HB      LYS  97  10.845  15.462 -15.483
  785    HB3  LYS  97           1HB      LYS  97   9.143  15.769 -15.806
  786    HG2  LYS  97           2HG      LYS  97  10.642  16.687 -13.354
  787    HG3  LYS  97           1HG      LYS  97  10.306  17.679 -14.772
  788    HD2  LYS  97           2HD      LYS  97   7.870  17.335 -14.366
  789    HD3  LYS  97           1HD      LYS  97   8.277  16.475 -12.878
  790    HE2  LYS  97           2HE      LYS  97   9.368  18.479 -12.003
  791    HE3  LYS  97           1HE      LYS  97   9.016  19.342 -13.499
  792    HZ1  LYS  97           3HZ      LYS  97   7.392  19.966 -11.915
  793    HZ2  LYS  97           1HZ      LYS  97   7.069  18.358 -11.490
  794    HZ3  LYS  97           2HZ      LYS  97   6.622  18.935 -13.011
  Start of MODEL   20
    1    H1   MET   1           1H       MET   1  11.753  28.349 -12.219
    2    H2   MET   1           2H       MET   1  11.127  26.797 -11.952
    3    H3   MET   1           3H       MET   1  12.568  27.269 -11.209
    4    HA   MET   1           HA       MET   1   9.952  28.556 -10.719
    5    HB2  MET   1           2HB      MET   1  11.403  26.438  -9.115
    6    HB3  MET   1           1HB      MET   1  10.053  27.382  -8.493
    7    HG2  MET   1           2HG      MET   1   9.361  25.166  -9.273
    8    HG3  MET   1           1HG      MET   1   8.587  26.461 -10.187
    9    HE1  MET   1           3HE      MET   1   7.872  24.817 -12.133
   10    HE2  MET   1           1HE      MET   1   8.564  23.478 -11.217
   11    HE3  MET   1           2HE      MET   1   8.982  23.692 -12.916
   12    H    GLY   2           H        GLY   2  10.027  29.758  -8.582
   13    HA2  GLY   2           2HA      GLY   2  12.204  31.620  -8.760
   14    HA3  GLY   2           1HA      GLY   2  10.847  31.703  -7.654
   15    H    HIS   3           H        HIS   3  14.005  30.189  -8.172
   16    HA   HIS   3           HA       HIS   3  15.764  29.920  -6.756
   17    HB2  HIS   3           2HB      HIS   3  14.922  32.288  -6.156
   18    HB3  HIS   3           1HB      HIS   3  14.291  31.547  -4.692
   19    HD1  HIS   3           HD1      HIS   3  16.111  30.505  -3.046
   20    HD2  HIS   3           HD2      HIS   3  17.603  32.835  -6.146
   21    HE1  HIS   3           HE1      HIS   3  18.458  31.079  -2.385
   22    HE2  HIS   3           HE2      HIS   3  19.275  32.633  -4.185
   23    H    HIS   4           H        HIS   4  13.147  28.220  -6.381
   24    HA   HIS   4           HA       HIS   4  13.435  27.411  -3.588
   25    HB2  HIS   4           2HB      HIS   4  11.385  26.844  -5.711
   26    HB3  HIS   4           1HB      HIS   4  11.463  25.855  -4.255
   27    HD1  HIS   4           HD1      HIS   4  10.253  29.106  -5.505
   28    HD2  HIS   4           HD2      HIS   4  10.959  27.314  -1.826
   29    HE1  HIS   4           HE1      HIS   4   9.048  30.520  -3.828
   30    HE2  HIS   4           HE2      HIS   4   9.685  29.547  -1.605
   31    H    HIS   5           H        HIS   5  14.846  25.929  -3.043
   32    HA   HIS   5           HA       HIS   5  15.756  23.887  -4.922
   33    HB2  HIS   5           2HB      HIS   5  16.588  24.502  -2.070
   34    HB3  HIS   5           1HB      HIS   5  17.332  23.274  -3.087
   35    HD1  HIS   5           HD1      HIS   5  19.162  24.021  -4.630
   36    HD2  HIS   5           HD2      HIS   5  17.022  27.207  -3.035
   37    HE1  HIS   5           HE1      HIS   5  20.419  26.085  -5.307
   38    HE2  HIS   5           HE2      HIS   5  19.232  27.969  -4.133
   39    H    HIS   6           H        HIS   6  15.622  21.588  -4.465
   40    HA   HIS   6           HA       HIS   6  13.827  20.669  -2.391
   41    HB2  HIS   6           2HB      HIS   6  12.167  19.698  -3.991
   42    HB3  HIS   6           1HB      HIS   6  12.162  21.458  -3.937
   43    HD1  HIS   6           HD1      HIS   6  13.145  18.582  -6.176
   44    HD2  HIS   6           HD2      HIS   6  12.840  22.725  -6.307
   45    HE1  HIS   6           HE1      HIS   6  13.395  19.198  -8.593
   46    HE2  HIS   6           HE2      HIS   6  13.083  21.692  -8.660
   47    H    HIS   7           H        HIS   7  15.000  18.986  -1.693
   48    HA   HIS   7           HA       HIS   7  15.204  16.699  -3.478
   49    HB2  HIS   7           2HB      HIS   7  17.587  18.056  -2.288
   50    HB3  HIS   7           1HB      HIS   7  17.588  16.298  -2.346
   51    HD1  HIS   7           HD1      HIS   7  17.370  15.218  -4.773
   52    HD2  HIS   7           HD2      HIS   7  18.200  19.287  -4.668
   53    HE1  HIS   7           HE1      HIS   7  18.208  15.791  -7.069
   54    HE2  HIS   7           HE2      HIS   7  18.835  18.223  -6.940
   55    H    HIS   8           H        HIS   8  14.033  15.241  -2.437
   56    HA   HIS   8           HA       HIS   8  14.616  14.705   0.399
   57    HB2  HIS   8           2HB      HIS   8  11.855  14.922  -0.835
   58    HB3  HIS   8           1HB      HIS   8  12.176  14.306   0.784
   59    HD1  HIS   8           HD1      HIS   8  11.874  17.447  -1.166
   60    HD2  HIS   8           HD2      HIS   8  13.018  16.288   2.660
   61    HE1  HIS   8           HE1      HIS   8  11.953  19.563   0.181
   62    HE2  HIS   8           HE2      HIS   8  12.634  18.840   2.493
   63    H    SER   9           H        SER   9  13.114  12.578   0.928
   64    HA   SER   9           HA       SER   9  14.444  10.411  -0.201
   65    HB2  SER   9           2HB      SER   9  12.739   8.996   0.880
   66    HB3  SER   9           1HB      SER   9  13.255  10.295   1.955
   67    HG   SER   9           HG       SER   9  11.082  10.881   0.336
   68    H    HIS  10           H        HIS  10  14.107   9.061  -1.912
   69    HA   HIS  10           HA       HIS  10  12.365   9.894  -4.021
   70    HB2  HIS  10           2HB      HIS  10  13.937   7.319  -3.725
   71    HB3  HIS  10           1HB      HIS  10  13.200   7.906  -5.212
   72    HD1  HIS  10           HD1      HIS  10  16.336   7.895  -3.473
   73    HD2  HIS  10           HD2      HIS  10  14.363  10.580  -5.960
   74    HE1  HIS  10           HE1      HIS  10  18.110   9.452  -4.330
   75    HE2  HIS  10           HE2      HIS  10  16.925  10.946  -5.962
   76    H    MET  11           H        MET  11  10.337   9.244  -4.518
   77    HA   MET  11           HA       MET  11   8.813   7.846  -2.569
   78    HB2  MET  11           2HB      MET  11   8.056   8.684  -5.377
   79    HB3  MET  11           1HB      MET  11   6.927   8.111  -4.157
   80    HG2  MET  11           2HG      MET  11   6.815  10.497  -4.250
   81    HG3  MET  11           1HG      MET  11   7.571  10.031  -2.727
   82    HE1  MET  11           3HE      MET  11   8.535  12.476  -2.325
   83    HE2  MET  11           1HE      MET  11   7.696  12.978  -3.794
   84    HE3  MET  11           2HE      MET  11   9.396  13.389  -3.567
   85    H    VAL  12           H        VAL  12   8.280   5.764  -2.388
   86    HA   VAL  12           HA       VAL  12   8.781   3.930  -4.651
   87    HB   VAL  12           HB       VAL  12   9.080   3.302  -1.702
   88   HG11  VAL  12          1HG1      VAL  12   8.377   1.364  -2.990
   89   HG12  VAL  12          2HG1      VAL  12  10.044   1.177  -2.451
   90   HG13  VAL  12          3HG1      VAL  12   9.703   1.612  -4.126
   91   HG21  VAL  12          3HG2      VAL  12  11.223   3.699  -3.798
   92   HG22  VAL  12          1HG2      VAL  12  11.493   3.167  -2.138
   93   HG23  VAL  12          2HG2      VAL  12  10.865   4.785  -2.456
   94    H    VAL  13           H        VAL  13   6.873   3.201  -5.426
   95    HA   VAL  13           HA       VAL  13   4.520   3.267  -3.656
   96    HB   VAL  13           HB       VAL  13   3.152   3.347  -5.686
   97   HG11  VAL  13          1HG1      VAL  13   3.917   5.446  -4.707
   98   HG12  VAL  13          2HG1      VAL  13   3.812   5.581  -6.461
   99   HG13  VAL  13          3HG1      VAL  13   5.383   5.384  -5.686
  100   HG21  VAL  13          3HG2      VAL  13   4.211   3.608  -7.900
  101   HG22  VAL  13          1HG2      VAL  13   4.550   2.032  -7.184
  102   HG23  VAL  13          2HG2      VAL  13   5.786   3.289  -7.173
  103    H    ILE  14           H        ILE  14   2.714   1.702  -4.596
  104    HA   ILE  14           HA       ILE  14   3.869  -1.019  -4.697
  105    HB   ILE  14           HB       ILE  14   2.920  -0.463  -2.481
  106   HG12  ILE  14          2HG1      ILE  14   1.192  -2.387  -2.414
  107   HG13  ILE  14          1HG1      ILE  14   1.541  -2.581  -4.128
  108   HG21  ILE  14          1HG2      ILE  14   0.499  -0.139  -2.195
  109   HG22  ILE  14          2HG2      ILE  14   0.310  -0.085  -3.948
  110   HG23  ILE  14          3HG2      ILE  14   1.244   1.162  -3.124
  111   HD11  ILE  14          3HD1      ILE  14   3.918  -2.928  -3.565
  112   HD12  ILE  14          1HD1      ILE  14   2.849  -4.131  -2.848
  113   HD13  ILE  14          2HD1      ILE  14   3.496  -2.827  -1.855
  114    H    ARG  15           H        ARG  15   3.133  -2.298  -6.352
  115    HA   ARG  15           HA       ARG  15   0.959  -1.262  -8.057
  116    HB2  ARG  15           2HB      ARG  15   3.091  -3.321  -8.647
  117    HB3  ARG  15           1HB      ARG  15   1.804  -2.886  -9.754
  118    HG2  ARG  15           2HG      ARG  15   2.748  -0.536  -9.738
  119    HG3  ARG  15           1HG      ARG  15   4.145  -1.205  -8.879
  120    HD2  ARG  15           2HD      ARG  15   4.378  -2.885 -10.725
  121    HD3  ARG  15           1HD      ARG  15   3.107  -2.033 -11.595
  122    HE   ARG  15           HE       ARG  15   5.478  -0.509 -10.850
  123   HH11  ARG  15          1HH1      ARG  15   3.628  -2.089 -13.285
  124   HH12  ARG  15          2HH1      ARG  15   4.619  -1.508 -14.574
  125   HH21  ARG  15          1HH2      ARG  15   6.778   0.205 -12.507
  126   HH22  ARG  15          2HH2      ARG  15   6.393  -0.233 -14.141
  127    H    ARG  16           H        ARG  16  -0.517  -2.772  -9.060
  128    HA   ARG  16           HA       ARG  16  -1.585  -4.704  -9.538
  129    HB2  ARG  16           2HB      ARG  16   0.750  -5.645  -9.358
  130    HB3  ARG  16           1HB      ARG  16   0.346  -6.142  -7.721
  131    HG2  ARG  16           2HG      ARG  16  -1.376  -7.615  -8.535
  132    HG3  ARG  16           1HG      ARG  16  -1.157  -7.023 -10.183
  133    HD2  ARG  16           2HD      ARG  16   1.130  -7.912 -10.192
  134    HD3  ARG  16           1HD      ARG  16   0.903  -8.504  -8.544
  135    HE   ARG  16           HE       ARG  16  -1.127  -9.554 -10.150
  136   HH11  ARG  16          1HH1      ARG  16   2.295  -9.840  -9.743
  137   HH12  ARG  16          2HH1      ARG  16   2.331 -11.463 -10.333
  138   HH21  ARG  16          1HH2      ARG  16  -1.057 -11.640 -10.878
  139   HH22  ARG  16          2HH2      ARG  16   0.462 -12.462 -10.973
  140    H    LEU  17           H        LEU  17  -2.165  -3.079  -7.010
  141    HA   LEU  17           HA       LEU  17  -3.325  -4.912  -5.145
  142    HB2  LEU  17           2HB      LEU  17  -3.724  -1.949  -5.560
  143    HB3  LEU  17           1HB      LEU  17  -4.577  -2.849  -4.323
  144    HG   LEU  17           HG       LEU  17  -2.733  -1.735  -3.291
  145   HD11  LEU  17          1HD1      LEU  17  -1.463  -3.613  -2.353
  146   HD12  LEU  17          2HD1      LEU  17  -2.084  -4.665  -3.626
  147   HD13  LEU  17          3HD1      LEU  17  -3.189  -3.963  -2.443
  148   HD21  LEU  17          3HD2      LEU  17  -0.938  -3.079  -5.309
  149   HD22  LEU  17          1HD2      LEU  17  -0.424  -2.044  -3.977
  150   HD23  LEU  17          2HD2      LEU  17  -1.377  -1.372  -5.298
  151    HA   PRO  18           HA       PRO  18  -7.224  -5.351  -7.417
  152    HB2  PRO  18           2HB      PRO  18  -7.755  -7.813  -6.151
  153    HB3  PRO  18           1HB      PRO  18  -6.986  -7.594  -7.722
  154    HG2  PRO  18           2HG      PRO  18  -5.773  -8.628  -5.391
  155    HG3  PRO  18           1HG      PRO  18  -4.954  -8.159  -6.890
  156    HD2  PRO  18           2HD      PRO  18  -5.264  -6.638  -4.337
  157    HD3  PRO  18           1HD      PRO  18  -3.914  -6.649  -5.494
  158    HA   PRO  19           HA       PRO  19  -9.971  -3.878  -4.201
  159    HB2  PRO  19           2HB      PRO  19 -12.387  -4.493  -5.332
  160    HB3  PRO  19           1HB      PRO  19 -11.391  -3.127  -5.849
  161    HG2  PRO  19           2HG      PRO  19 -11.625  -5.861  -7.062
  162    HG3  PRO  19           1HG      PRO  19 -11.595  -4.280  -7.867
  163    HD2  PRO  19           2HD      PRO  19  -9.412  -5.851  -7.754
  164    HD3  PRO  19           1HD      PRO  19  -9.292  -4.082  -7.674
  165    H    GLY  20           H        GLY  20 -10.249  -4.901  -2.292
  166    HA2  GLY  20           2HA      GLY  20 -11.847  -7.326  -2.149
  167    HA3  GLY  20           1HA      GLY  20 -10.166  -7.523  -1.688
  168    H    LEU  21           H        LEU  21  -9.673  -7.202   0.387
  169    HA   LEU  21           HA       LEU  21 -11.590  -6.566   2.333
  170    HB2  LEU  21           2HB      LEU  21  -9.839  -6.648   3.953
  171    HB3  LEU  21           1HB      LEU  21  -9.562  -7.913   2.772
  172    HG   LEU  21           HG       LEU  21  -8.080  -5.273   2.872
  173   HD11  LEU  21          1HD1      LEU  21  -7.208  -8.030   3.740
  174   HD12  LEU  21          2HD1      LEU  21  -7.540  -6.655   4.795
  175   HD13  LEU  21          3HD1      LEU  21  -6.182  -6.599   3.674
  176   HD21  LEU  21          3HD2      LEU  21  -6.529  -6.344   1.282
  177   HD22  LEU  21          1HD2      LEU  21  -8.149  -6.153   0.609
  178   HD23  LEU  21          2HD2      LEU  21  -7.612  -7.734   1.179
  179    H    THR  22           H        THR  22 -11.428  -4.809   3.967
  180    HA   THR  22           HA       THR  22 -11.571  -2.283   2.594
  181    HB   THR  22           HB       THR  22 -12.062  -2.990   5.499
  182    HG1  THR  22           HG1      THR  22 -13.533  -3.285   3.279
  183   HG21  THR  22          3HG2      THR  22 -13.176  -0.784   5.658
  184   HG22  THR  22          1HG2      THR  22 -12.585  -0.388   4.046
  185   HG23  THR  22          2HG2      THR  22 -11.444  -0.640   5.365
  186    H    LYS  23           H        LYS  23 -10.446  -0.397   3.062
  187    HA   LYS  23           HA       LYS  23  -7.743  -0.421   3.141
  188    HB2  LYS  23           2HB      LYS  23  -7.870   1.986   3.773
  189    HB3  LYS  23           1HB      LYS  23  -8.985   1.531   2.488
  190    HG2  LYS  23           2HG      LYS  23 -10.770   1.326   4.271
  191    HG3  LYS  23           1HG      LYS  23  -9.626   2.083   5.381
  192    HD2  LYS  23           2HD      LYS  23 -10.618   3.301   2.796
  193    HD3  LYS  23           1HD      LYS  23 -11.226   3.696   4.402
  194    HE2  LYS  23           2HE      LYS  23  -8.963   4.473   5.028
  195    HE3  LYS  23           1HE      LYS  23  -8.414   4.134   3.387
  196    HZ1  LYS  23           3HZ      LYS  23  -8.979   6.477   3.733
  197    HZ2  LYS  23           1HZ      LYS  23 -10.573   6.048   4.096
  198    HZ3  LYS  23           2HZ      LYS  23  -9.962   5.766   2.549
  199    H    GLU  24           H        GLU  24  -9.811  -0.289   6.031
  200    HA   GLU  24           HA       GLU  24  -7.902   0.480   7.916
  201    HB2  GLU  24           2HB      GLU  24 -10.267  -1.360   8.341
  202    HB3  GLU  24           1HB      GLU  24  -9.398  -0.495   9.604
  203    HG2  GLU  24           2HG      GLU  24 -10.068   1.643   8.546
  204    HG3  GLU  24           1HG      GLU  24 -11.019   0.729   7.376
  205    H    GLN  25           H        GLN  25  -8.508  -2.705   6.557
  206    HA   GLN  25           HA       GLN  25  -6.373  -3.872   8.223
  207    HB2  GLN  25           2HB      GLN  25  -8.314  -5.172   6.288
  208    HB3  GLN  25           1HB      GLN  25  -7.085  -6.032   7.204
  209    HG2  GLN  25           2HG      GLN  25  -8.167  -5.423   9.290
  210    HG3  GLN  25           1HG      GLN  25  -9.363  -4.469   8.410
  211   HE21  GLN  25          1HE2      GLN  25 -10.995  -5.519   7.297
  212   HE22  GLN  25          2HE2      GLN  25 -11.335  -7.200   7.501
  213    H    LEU  26           H        LEU  26  -7.307  -3.432   4.842
  214    HA   LEU  26           HA       LEU  26  -5.192  -4.607   3.527
  215    HB2  LEU  26           2HB      LEU  26  -7.022  -3.946   2.247
  216    HB3  LEU  26           1HB      LEU  26  -7.027  -2.322   2.896
  217    HG   LEU  26           HG       LEU  26  -4.938  -1.853   1.581
  218   HD11  LEU  26          1HD1      LEU  26  -5.498  -4.550   0.344
  219   HD12  LEU  26          2HD1      LEU  26  -4.119  -4.144   1.366
  220   HD13  LEU  26          3HD1      LEU  26  -4.302  -3.378  -0.212
  221   HD21  LEU  26          3HD2      LEU  26  -7.345  -2.754  -0.011
  222   HD22  LEU  26          1HD2      LEU  26  -6.066  -1.682  -0.588
  223   HD23  LEU  26          2HD2      LEU  26  -7.116  -1.171   0.735
  224    H    GLU  27           H        GLU  27  -5.214  -1.549   5.228
  225    HA   GLU  27           HA       GLU  27  -2.887  -0.468   3.970
  226    HB2  GLU  27           2HB      GLU  27  -2.990   1.268   5.637
  227    HB3  GLU  27           1HB      GLU  27  -4.621   0.914   5.089
  228    HG2  GLU  27           2HG      GLU  27  -4.990  -0.449   7.101
  229    HG3  GLU  27           1HG      GLU  27  -3.367  -0.048   7.658
  230    H    GLU  28           H        GLU  28  -3.349  -2.632   6.704
  231    HA   GLU  28           HA       GLU  28  -1.070  -1.909   8.189
  232    HB2  GLU  28           2HB      GLU  28  -1.447  -3.829   9.525
  233    HB3  GLU  28           1HB      GLU  28  -3.031  -3.282   9.007
  234    HG2  GLU  28           2HG      GLU  28  -3.071  -5.028   7.286
  235    HG3  GLU  28           1HG      GLU  28  -1.482  -5.576   7.814
  236    H    GLN  29           H        GLN  29  -1.455  -4.405   5.677
  237    HA   GLN  29           HA       GLN  29   1.276  -5.282   5.879
  238    HB2  GLN  29           2HB      GLN  29   0.814  -6.517   3.765
  239    HB3  GLN  29           1HB      GLN  29  -0.333  -6.867   5.047
  240    HG2  GLN  29           2HG      GLN  29  -1.061  -4.734   3.111
  241    HG3  GLN  29           1HG      GLN  29  -1.083  -6.400   2.536
  242   HE21  GLN  29          1HE2      GLN  29  -3.321  -6.356   2.287
  243   HE22  GLN  29          2HE2      GLN  29  -4.395  -6.410   3.633
  244    H    LEU  30           H        LEU  30  -0.379  -2.775   4.131
  245    HA   LEU  30           HA       LEU  30   1.766  -2.345   2.242
  246    HB2  LEU  30           2HB      LEU  30  -0.686  -0.691   2.859
  247    HB3  LEU  30           1HB      LEU  30   0.438  -0.365   1.551
  248    HG   LEU  30           HG       LEU  30  -1.321  -2.813   1.822
  249   HD11  LEU  30          1HD1      LEU  30  -2.573  -0.830   1.195
  250   HD12  LEU  30          2HD1      LEU  30  -2.444  -1.939  -0.170
  251   HD13  LEU  30          3HD1      LEU  30  -1.431  -0.496  -0.109
  252   HD21  LEU  30          3HD2      LEU  30  -0.503  -3.417  -0.413
  253   HD22  LEU  30          1HD2      LEU  30   0.793  -3.412   0.782
  254   HD23  LEU  30          2HD2      LEU  30   0.637  -2.073  -0.355
  255    H    ARG  31           H        ARG  31   0.906  -1.126   5.404
  256    HA   ARG  31           HA       ARG  31   3.393   0.439   5.333
  257    HB2  ARG  31           2HB      ARG  31   2.417   2.218   6.709
  258    HB3  ARG  31           1HB      ARG  31   1.626   2.080   5.149
  259    HG2  ARG  31           2HG      ARG  31  -0.326   1.130   6.113
  260    HG3  ARG  31           1HG      ARG  31   0.481   0.865   7.663
  261    HD2  ARG  31           2HD      ARG  31   0.705   3.299   7.947
  262    HD3  ARG  31           1HD      ARG  31  -0.126   3.551   6.415
  263    HE   ARG  31           HE       ARG  31  -2.089   2.448   7.519
  264   HH11  ARG  31          1HH1      ARG  31   0.338   4.012   9.422
  265   HH12  ARG  31          2HH1      ARG  31  -0.776   4.445  10.670
  266   HH21  ARG  31          1HH2      ARG  31  -3.494   3.016   9.129
  267   HH22  ARG  31          2HH2      ARG  31  -2.916   3.862  10.526
  268    HA   PRO  32           HA       PRO  32   3.560  -2.074   9.199
  269    HB2  PRO  32           2HB      PRO  32   5.370  -3.914   8.510
  270    HB3  PRO  32           1HB      PRO  32   3.674  -4.099   8.041
  271    HG2  PRO  32           2HG      PRO  32   6.007  -3.181   6.402
  272    HG3  PRO  32           1HG      PRO  32   4.659  -4.237   5.942
  273    HD2  PRO  32           2HD      PRO  32   4.839  -1.509   5.379
  274    HD3  PRO  32           1HD      PRO  32   3.346  -2.467   5.351
  275    H    LEU  33           H        LEU  33   5.235   0.124   7.561
  276    HA   LEU  33           HA       LEU  33   7.908  -0.061   8.445
  277    HB2  LEU  33           2HB      LEU  33   6.216   2.274   7.544
  278    HB3  LEU  33           1HB      LEU  33   7.898   2.461   7.995
  279    HG   LEU  33           HG       LEU  33   8.544   0.893   6.179
  280   HD11  LEU  33          1HD1      LEU  33   6.919   0.294   4.450
  281   HD12  LEU  33          2HD1      LEU  33   5.624   1.006   5.414
  282   HD13  LEU  33          3HD1      LEU  33   6.492  -0.409   6.008
  283   HD21  LEU  33          3HD2      LEU  33   8.114   2.435   4.320
  284   HD22  LEU  33          1HD2      LEU  33   8.598   3.289   5.785
  285   HD23  LEU  33          2HD2      LEU  33   6.903   3.271   5.294
  286    HA   PRO  34           HA       PRO  34   7.818   0.651  12.787
  287    HB2  PRO  34           2HB      PRO  34   9.975   2.503  12.883
  288    HB3  PRO  34           1HB      PRO  34  10.059   0.752  13.098
  289    HG2  PRO  34           2HG      PRO  34  10.580   2.393  10.669
  290    HG3  PRO  34           1HG      PRO  34  11.346   0.884  11.196
  291    HD2  PRO  34           2HD      PRO  34   9.588   0.901   9.190
  292    HD3  PRO  34           1HD      PRO  34   9.603  -0.430  10.369
  293    H    ALA  35           H        ALA  35   8.790   3.829  11.397
  294    HA   ALA  35           HA       ALA  35   6.362   5.047  12.501
  295    HB1  ALA  35           3HB      ALA  35   9.120   6.032  13.251
  296    HB2  ALA  35           1HB      ALA  35   8.032   5.136  14.313
  297    HB3  ALA  35           2HB      ALA  35   7.580   6.743  13.742
  298    H    HIS  36           H        HIS  36   7.421   4.605   9.782
  299    HA   HIS  36           HA       HIS  36   8.183   7.272   8.849
  300    HB2  HIS  36           2HB      HIS  36   7.746   4.778   7.188
  301    HB3  HIS  36           1HB      HIS  36   8.592   6.244   6.707
  302    HD1  HIS  36           HD1      HIS  36  10.669   6.714   8.725
  303    HD2  HIS  36           HD2      HIS  36   9.558   2.857   7.673
  304    HE1  HIS  36           HE1      HIS  36  12.604   5.258   9.372
  305    HE2  HIS  36           HE2      HIS  36  11.979   2.963   8.554
  306    H    ASP  37           H        ASP  37   7.040   7.832   6.596
  307    HA   ASP  37           HA       ASP  37   4.266   8.290   7.330
  308    HB2  ASP  37           2HB      ASP  37   5.726  10.149   6.584
  309    HB3  ASP  37           1HB      ASP  37   5.884   9.378   5.011
  310    H    TYR  38           H        TYR  38   2.602   8.267   5.548
  311    HA   TYR  38           HA       TYR  38   2.968   6.126   3.570
  312    HB2  TYR  38           2HB      TYR  38   0.749   5.159   4.217
  313    HB3  TYR  38           1HB      TYR  38   1.989   4.979   5.453
  314    HD1  TYR  38           HD2      TYR  38   1.837   6.194   7.563
  315    HD2  TYR  38           HD1      TYR  38  -1.164   6.641   4.574
  316    HE1  TYR  38           HE2      TYR  38   0.354   7.239   9.217
  317    HE2  TYR  38           HE1      TYR  38  -2.656   7.688   6.224
  318    HH   TYR  38           HH       TYR  38  -1.542   8.622   9.376
  319    H    PHE  39           H        PHE  39   0.377   6.013   2.575
  320    HA   PHE  39           HA       PHE  39  -0.478   8.754   2.024
  321    HB2  PHE  39           2HB      PHE  39   1.063   7.171   0.166
  322    HB3  PHE  39           1HB      PHE  39  -0.536   7.457  -0.501
  323    HD1  PHE  39           HD1      PHE  39  -1.298   9.735  -0.983
  324    HD2  PHE  39           HD2      PHE  39   2.644   8.965   0.442
  325    HE1  PHE  39           HE1      PHE  39  -0.603  11.985  -1.696
  326    HE2  PHE  39           HE2      PHE  39   3.341  11.215  -0.267
  327    HZ   PHE  39           HZ       PHE  39   1.718  12.727  -1.337
  328    H    GLU  40           H        GLU  40  -2.277   8.209  -0.034
  329    HA   GLU  40           HA       GLU  40  -4.496   7.312   1.453
  330    HB2  GLU  40           2HB      GLU  40  -5.775   7.589  -0.632
  331    HB3  GLU  40           1HB      GLU  40  -4.736   8.971  -0.307
  332    HG2  GLU  40           2HG      GLU  40  -3.138   8.196  -1.966
  333    HG3  GLU  40           1HG      GLU  40  -4.098   6.744  -2.245
  334    H    PHE  41           H        PHE  41  -5.642   5.451   1.491
  335    HA   PHE  41           HA       PHE  41  -4.763   3.189  -0.200
  336    HB2  PHE  41           2HB      PHE  41  -6.021   3.067   2.562
  337    HB3  PHE  41           1HB      PHE  41  -5.536   1.682   1.589
  338    HD1  PHE  41           HD1      PHE  41  -3.107   1.289   1.133
  339    HD2  PHE  41           HD2      PHE  41  -4.458   4.239   3.903
  340    HE1  PHE  41           HE1      PHE  41  -0.862   1.379   2.138
  341    HE2  PHE  41           HE2      PHE  41  -2.215   4.325   4.906
  342    HZ   PHE  41           HZ       PHE  41  -0.412   2.900   4.024
  343    H    PHE  42           H        PHE  42  -6.257   2.547  -1.652
  344    HA   PHE  42           HA       PHE  42  -8.730   3.841  -1.927
  345    HB2  PHE  42           2HB      PHE  42  -9.179   2.326  -3.759
  346    HB3  PHE  42           1HB      PHE  42  -7.491   2.808  -3.801
  347    HD1  PHE  42           HD2      PHE  42  -5.743   1.178  -2.936
  348    HD2  PHE  42           HD1      PHE  42  -9.794   0.060  -3.656
  349    HE1  PHE  42           HE2      PHE  42  -5.080  -1.189  -2.998
  350    HE2  PHE  42           HE1      PHE  42  -9.132  -2.309  -3.713
  351    HZ   PHE  42           HZ       PHE  42  -6.772  -2.937  -3.387
  352    H    ALA  43           H        ALA  43 -10.879   3.173  -1.653
  353    HA   ALA  43           HA       ALA  43 -11.271   0.881   0.178
  354    HB1  ALA  43           3HB      ALA  43 -11.654   2.998   1.312
  355    HB2  ALA  43           1HB      ALA  43 -13.162   2.099   1.150
  356    HB3  ALA  43           2HB      ALA  43 -12.829   3.465   0.083
  357    H    ALA  44           H        ALA  44 -11.679  -0.575  -1.528
  358    HA   ALA  44           HA       ALA  44 -14.321  -0.240  -2.809
  359    HB1  ALA  44           3HB      ALA  44 -11.910  -1.562  -4.063
  360    HB2  ALA  44           1HB      ALA  44 -12.507   0.052  -4.453
  361    HB3  ALA  44           2HB      ALA  44 -13.501  -1.363  -4.798
  362    H    ASP  45           H        ASP  45 -15.650  -1.628  -1.821
  363    HA   ASP  45           HA       ASP  45 -14.767  -3.893  -0.351
  364    HB2  ASP  45           2HB      ASP  45 -17.596  -3.223  -1.193
  365    HB3  ASP  45           1HB      ASP  45 -17.104  -4.238   0.162
  366    H    LEU  46           H        LEU  46 -14.473  -5.932  -0.957
  367    HA   LEU  46           HA       LEU  46 -14.486  -6.851  -3.559
  368    HB2  LEU  46           2HB      LEU  46 -14.181  -9.076  -2.688
  369    HB3  LEU  46           1HB      LEU  46 -13.261  -7.932  -1.736
  370    HG   LEU  46           HG       LEU  46 -15.906  -9.139  -0.878
  371   HD11  LEU  46          1HD1      LEU  46 -13.098  -9.837  -0.022
  372   HD12  LEU  46          2HD1      LEU  46 -14.162 -10.836  -1.010
  373   HD13  LEU  46          3HD1      LEU  46 -14.584 -10.490   0.666
  374   HD21  LEU  46          3HD2      LEU  46 -13.903  -7.443   0.622
  375   HD22  LEU  46          1HD2      LEU  46 -15.284  -8.264   1.353
  376   HD23  LEU  46          2HD2      LEU  46 -15.545  -6.987   0.167
  377    H    SER  47           H        SER  47 -16.057  -7.247  -4.953
  378    HA   SER  47           HA       SER  47 -17.913  -8.099  -5.932
  379    HB2  SER  47           2HB      SER  47 -17.451 -10.149  -4.671
  380    HB3  SER  47           1HB      SER  47 -18.366  -9.526  -3.300
  381    HG   SER  47           HG       SER  47 -19.287 -10.392  -5.824
  382    H    LEU  48           H        LEU  48 -18.316  -6.390  -2.922
  383    HA   LEU  48           HA       LEU  48 -21.130  -6.212  -2.869
  384    HB2  LEU  48           2HB      LEU  48 -19.252  -5.555  -1.119
  385    HB3  LEU  48           1HB      LEU  48 -19.424  -3.970  -1.845
  386    HG   LEU  48           HG       LEU  48 -21.683  -5.523  -0.557
  387   HD11  LEU  48          1HD1      LEU  48 -20.054  -3.222   0.521
  388   HD12  LEU  48          2HD1      LEU  48 -20.008  -4.888   1.095
  389   HD13  LEU  48          3HD1      LEU  48 -21.474  -3.930   1.292
  390   HD21  LEU  48          3HD2      LEU  48 -21.538  -2.667  -1.535
  391   HD22  LEU  48          1HD2      LEU  48 -22.882  -3.377  -0.639
  392   HD23  LEU  48          2HD2      LEU  48 -22.482  -3.973  -2.249
  393    H    TYR  49           H        TYR  49 -19.150  -3.297  -3.447
  394    HA   TYR  49           HA       TYR  49 -20.437  -2.925  -6.058
  395    HB2  TYR  49           2HB      TYR  49 -20.596  -0.991  -3.762
  396    HB3  TYR  49           1HB      TYR  49 -20.614  -0.397  -5.418
  397    HD1  TYR  49           HD2      TYR  49 -22.338  -1.816  -6.976
  398    HD2  TYR  49           HD1      TYR  49 -22.675  -1.258  -2.767
  399    HE1  TYR  49           HE2      TYR  49 -24.755  -2.231  -7.121
  400    HE2  TYR  49           HE1      TYR  49 -25.093  -1.676  -2.904
  401    HH   TYR  49           HH       TYR  49 -26.899  -1.536  -4.602
  402    HA   PRO  50           HA       PRO  50 -15.973  -1.826  -6.469
  403    HB2  PRO  50           2HB      PRO  50 -16.108  -3.398  -8.933
  404    HB3  PRO  50           1HB      PRO  50 -15.048  -3.610  -7.538
  405    HG2  PRO  50           2HG      PRO  50 -17.037  -5.359  -8.153
  406    HG3  PRO  50           1HG      PRO  50 -16.495  -5.064  -6.490
  407    HD2  PRO  50           2HD      PRO  50 -18.900  -3.968  -7.921
  408    HD3  PRO  50           1HD      PRO  50 -18.761  -4.572  -6.254
  409    H    HIS  51           H        HIS  51 -17.003   0.277  -6.839
  410    HA   HIS  51           HA       HIS  51 -18.335   1.006  -9.191
  411    HB2  HIS  51           2HB      HIS  51 -18.387   2.335  -7.120
  412    HB3  HIS  51           1HB      HIS  51 -16.693   2.760  -7.344
  413    HD1  HIS  51           HD1      HIS  51 -16.891   5.216  -7.706
  414    HD2  HIS  51           HD2      HIS  51 -19.478   3.063 -10.141
  415    HE1  HIS  51           HE1      HIS  51 -17.890   6.896  -9.275
  416    HE2  HIS  51           HE2      HIS  51 -19.584   5.602 -10.603
  417    H    LEU  52           H        LEU  52 -14.868   1.266  -8.401
  418    HA   LEU  52           HA       LEU  52 -14.125   0.854 -11.120
  419    HB2  LEU  52           2HB      LEU  52 -13.101   2.931 -11.665
  420    HB3  LEU  52           1HB      LEU  52 -14.749   3.276 -11.183
  421    HG   LEU  52           HG       LEU  52 -12.319   3.689  -9.421
  422   HD11  LEU  52          1HD1      LEU  52 -12.316   5.201 -11.344
  423   HD12  LEU  52          2HD1      LEU  52 -12.640   6.070  -9.847
  424   HD13  LEU  52          3HD1      LEU  52 -13.962   5.706 -10.957
  425   HD21  LEU  52          3HD2      LEU  52 -14.369   3.261  -8.147
  426   HD22  LEU  52          1HD2      LEU  52 -15.195   4.542  -9.039
  427   HD23  LEU  52          2HD2      LEU  52 -13.842   4.938  -7.973
  428    H    TYR  53           H        TYR  53 -11.791   0.704 -11.408
  429    HA   TYR  53           HA       TYR  53 -10.488  -0.440  -9.149
  430    HB2  TYR  53           2HB      TYR  53  -8.612  -0.824 -10.626
  431    HB3  TYR  53           1HB      TYR  53 -10.102  -1.174 -11.495
  432    HD1  TYR  53           HD1      TYR  53 -11.022   0.719 -13.039
  433    HD2  TYR  53           HD2      TYR  53  -7.024   0.614 -11.564
  434    HE1  TYR  53           HE1      TYR  53 -10.319   2.239 -14.839
  435    HE2  TYR  53           HE2      TYR  53  -6.321   2.133 -13.361
  436    HH   TYR  53           HH       TYR  53  -7.128   2.739 -15.682
  437    H    SER  54           H        SER  54  -8.660   0.260  -8.014
  438    HA   SER  54           HA       SER  54  -7.531   2.887  -8.462
  439    HB2  SER  54           2HB      SER  54  -9.061   2.321  -5.900
  440    HB3  SER  54           1HB      SER  54  -8.019   3.717  -6.163
  441    HG   SER  54           HG       SER  54  -9.658   3.732  -8.185
  442    H    ARG  55           H        ARG  55  -5.884   3.340  -6.560
  443    HA   ARG  55           HA       ARG  55  -4.636   0.819  -5.701
  444    HB2  ARG  55           2HB      ARG  55  -2.450   1.539  -6.580
  445    HB3  ARG  55           1HB      ARG  55  -3.636   1.345  -7.869
  446    HG2  ARG  55           2HG      ARG  55  -4.009   3.798  -7.844
  447    HG3  ARG  55           1HG      ARG  55  -2.725   3.945  -6.641
  448    HD2  ARG  55           2HD      ARG  55  -1.129   2.973  -8.237
  449    HD3  ARG  55           1HD      ARG  55  -2.419   2.846  -9.438
  450    HE   ARG  55           HE       ARG  55  -2.131   5.502  -8.447
  451   HH11  ARG  55          1HH1      ARG  55  -0.838   3.259 -10.715
  452   HH12  ARG  55          2HH1      ARG  55  -0.201   4.495 -11.733
  453   HH21  ARG  55          1HH2      ARG  55  -1.297   7.069  -9.727
  454   HH22  ARG  55          2HH2      ARG  55  -0.449   6.637 -11.173
  455    H    ALA  56           H        ALA  56  -2.638   1.297  -4.331
  456    HA   ALA  56           HA       ALA  56  -3.150   3.622  -2.581
  457    HB1  ALA  56           3HB      ALA  56  -1.794   1.010  -1.895
  458    HB2  ALA  56           1HB      ALA  56  -3.454   1.444  -1.486
  459    HB3  ALA  56           2HB      ALA  56  -2.109   2.345  -0.784
  460    H    TYR  57           H        TYR  57  -1.236   4.643  -1.608
  461    HA   TYR  57           HA       TYR  57   1.201   4.342  -3.263
  462    HB2  TYR  57           2HB      TYR  57   0.028   6.908  -2.159
  463    HB3  TYR  57           1HB      TYR  57   1.586   6.783  -2.964
  464    HD1  TYR  57           HD1      TYR  57  -2.065   6.620  -3.439
  465    HD2  TYR  57           HD2      TYR  57   1.736   6.618  -5.361
  466    HE1  TYR  57           HE1      TYR  57  -3.164   7.008  -5.601
  467    HE2  TYR  57           HE2      TYR  57   0.644   7.004  -7.530
  468    HH   TYR  57           HH       TYR  57  -2.655   7.901  -7.791
  469    H    ILE  58           H        ILE  58   3.182   4.536  -2.233
  470    HA   ILE  58           HA       ILE  58   3.182   4.815   0.708
  471    HB   ILE  58           HB       ILE  58   4.881   2.846  -0.862
  472   HG12  ILE  58          2HG1      ILE  58   2.518   2.272   0.958
  473   HG13  ILE  58          1HG1      ILE  58   2.486   2.178  -0.800
  474   HG21  ILE  58          1HG2      ILE  58   6.021   3.628   1.122
  475   HG22  ILE  58          2HG2      ILE  58   5.484   1.966   1.378
  476   HG23  ILE  58          3HG2      ILE  58   4.598   3.302   2.112
  477   HD11  ILE  58          3HD1      ILE  58   4.145   0.383  -0.732
  478   HD12  ILE  58          1HD1      ILE  58   2.696  -0.020   0.191
  479   HD13  ILE  58          2HD1      ILE  58   4.165   0.475   1.029
  480    H    ASN  59           H        ASN  59   5.088   5.819   1.586
  481    HA   ASN  59           HA       ASN  59   7.195   6.553  -0.308
  482    HB2  ASN  59           2HB      ASN  59   7.245   8.871   0.277
  483    HB3  ASN  59           1HB      ASN  59   5.587   8.485  -0.169
  484   HD21  ASN  59          1HD2      ASN  59   4.001   8.439   1.459
  485   HD22  ASN  59          2HD2      ASN  59   4.257   9.205   2.984
  486    H    PHE  60           H        PHE  60   9.144   6.150   0.504
  487    HA   PHE  60           HA       PHE  60   9.343   5.377   3.307
  488    HB2  PHE  60           2HB      PHE  60  11.144   4.975   0.920
  489    HB3  PHE  60           1HB      PHE  60  11.660   4.581   2.558
  490    HD1  PHE  60           HD2      PHE  60   9.094   3.806  -0.012
  491    HD2  PHE  60           HD1      PHE  60  11.042   2.571   3.553
  492    HE1  PHE  60           HE2      PHE  60   8.023   1.596  -0.201
  493    HE2  PHE  60           HE1      PHE  60   9.986   0.362   3.385
  494    HZ   PHE  60           HZ       PHE  60   8.469  -0.135   1.500
  495    H    ARG  61           H        ARG  61   9.528   7.178   4.535
  496    HA   ARG  61           HA       ARG  61  11.022   9.479   4.042
  497    HB2  ARG  61           2HB      ARG  61  10.404   8.127   6.678
  498    HB3  ARG  61           1HB      ARG  61  11.056   9.750   6.535
  499    HG2  ARG  61           2HG      ARG  61   8.397   8.881   5.404
  500    HG3  ARG  61           1HG      ARG  61   8.617   9.662   6.969
  501    HD2  ARG  61           2HD      ARG  61   9.784  11.538   5.665
  502    HD3  ARG  61           1HD      ARG  61   9.080  10.799   4.225
  503    HE   ARG  61           HE       ARG  61   7.310  11.519   6.444
  504   HH11  ARG  61          1HH1      ARG  61   8.367  12.121   3.204
  505   HH12  ARG  61          2HH1      ARG  61   7.058  13.196   2.883
  506   HH21  ARG  61          1HH2      ARG  61   5.639  12.872   5.993
  507   HH22  ARG  61          2HH2      ARG  61   5.517  13.603   4.429
  508    H    ASN  62           H        ASN  62  12.139   6.311   4.826
  509    HA   ASN  62           HA       ASN  62  14.823   7.345   5.498
  510    HB2  ASN  62           2HB      ASN  62  13.589   6.109   7.339
  511    HB3  ASN  62           1HB      ASN  62  13.702   4.664   6.343
  512   HD21  ASN  62          1HD2      ASN  62  15.036   3.511   7.660
  513   HD22  ASN  62          2HD2      ASN  62  16.666   3.967   8.001
  514    HA   PRO  63           HA       PRO  63  16.067   5.338   1.671
  515    HB2  PRO  63           2HB      PRO  63  18.782   5.411   2.155
  516    HB3  PRO  63           1HB      PRO  63  17.847   6.761   1.506
  517    HG2  PRO  63           2HG      PRO  63  18.720   6.244   4.327
  518    HG3  PRO  63           1HG      PRO  63  18.727   7.766   3.413
  519    HD2  PRO  63           2HD      PRO  63  16.816   7.228   5.220
  520    HD3  PRO  63           1HD      PRO  63  16.442   8.103   3.720
  521    H    ASP  64           H        ASP  64  17.147   4.258   4.867
  522    HA   ASP  64           HA       ASP  64  18.274   1.785   4.102
  523    HB2  ASP  64           2HB      ASP  64  16.892   2.520   6.696
  524    HB3  ASP  64           1HB      ASP  64  17.916   1.107   6.454
  525    H    ASP  65           H        ASP  65  14.991   2.505   5.308
  526    HA   ASP  65           HA       ASP  65  13.895  -0.030   5.130
  527    HB2  ASP  65           2HB      ASP  65  12.600   2.668   4.717
  528    HB3  ASP  65           1HB      ASP  65  11.698   1.164   4.867
  529    H    ILE  66           H        ILE  66  14.482   2.288   2.552
  530    HA   ILE  66           HA       ILE  66  12.893   1.202   0.521
  531    HB   ILE  66           HB       ILE  66  15.590   2.554   0.241
  532   HG12  ILE  66          2HG1      ILE  66  12.767   3.663   0.178
  533   HG13  ILE  66          1HG1      ILE  66  13.971   3.947   1.430
  534   HG21  ILE  66          1HG2      ILE  66  14.887   3.082  -2.051
  535   HG22  ILE  66          2HG2      ILE  66  13.420   2.132  -1.821
  536   HG23  ILE  66          3HG2      ILE  66  14.996   1.341  -1.794
  537   HD11  ILE  66          3HD1      ILE  66  13.783   5.866  -0.003
  538   HD12  ILE  66          1HD1      ILE  66  14.111   4.879  -1.428
  539   HD13  ILE  66          2HD1      ILE  66  15.367   5.121  -0.214
  540    H    LEU  67           H        LEU  67  16.094   0.189   1.672
  541    HA   LEU  67           HA       LEU  67  16.115  -1.963  -0.336
  542    HB2  LEU  67           2HB      LEU  67  18.453  -2.372   0.424
  543    HB3  LEU  67           1HB      LEU  67  18.180  -0.784  -0.257
  544    HG   LEU  67           HG       LEU  67  17.984   0.030   2.182
  545   HD11  LEU  67          1HD1      LEU  67  19.269  -1.291   3.822
  546   HD12  LEU  67          2HD1      LEU  67  19.351  -2.619   2.661
  547   HD13  LEU  67          3HD1      LEU  67  17.792  -2.101   3.302
  548   HD21  LEU  67          3HD2      LEU  67  19.842   0.593   0.716
  549   HD22  LEU  67          1HD2      LEU  67  20.641  -0.928   1.118
  550   HD23  LEU  67          2HD2      LEU  67  20.408   0.303   2.359
  551    H    LEU  68           H        LEU  68  15.246  -1.432   2.873
  552    HA   LEU  68           HA       LEU  68  15.722  -4.133   3.819
  553    HB2  LEU  68           2HB      LEU  68  15.928  -2.362   5.415
  554    HB3  LEU  68           1HB      LEU  68  14.345  -1.732   5.008
  555    HG   LEU  68           HG       LEU  68  13.302  -3.762   5.982
  556   HD11  LEU  68          1HD1      LEU  68  16.115  -4.433   6.865
  557   HD12  LEU  68          2HD1      LEU  68  15.167  -5.313   5.664
  558   HD13  LEU  68          3HD1      LEU  68  14.642  -5.280   7.347
  559   HD21  LEU  68          3HD2      LEU  68  15.139  -2.259   7.855
  560   HD22  LEU  68          1HD2      LEU  68  13.710  -3.180   8.324
  561   HD23  LEU  68          2HD2      LEU  68  13.540  -1.738   7.325
  562    H    PHE  69           H        PHE  69  12.704  -2.208   3.723
  563    HA   PHE  69           HA       PHE  69  11.060  -4.503   3.953
  564    HB2  PHE  69           2HB      PHE  69  10.576  -1.600   3.464
  565    HB3  PHE  69           1HB      PHE  69   9.251  -2.733   3.204
  566    HD1  PHE  69           HD1      PHE  69  11.454  -1.184   5.689
  567    HD2  PHE  69           HD2      PHE  69   8.274  -3.951   5.062
  568    HE1  PHE  69           HE1      PHE  69  10.989  -1.198   8.103
  569    HE2  PHE  69           HE2      PHE  69   7.801  -3.960   7.471
  570    HZ   PHE  69           HZ       PHE  69   9.159  -2.582   9.002
  571    H    ARG  70           H        ARG  70  12.004  -2.569   1.130
  572    HA   ARG  70           HA       ARG  70  10.245  -3.664  -0.744
  573    HB2  ARG  70           2HB      ARG  70  11.694  -1.685  -1.121
  574    HB3  ARG  70           1HB      ARG  70  13.094  -2.738  -1.217
  575    HG2  ARG  70           2HG      ARG  70  10.797  -3.176  -3.084
  576    HG3  ARG  70           1HG      ARG  70  11.922  -1.855  -3.389
  577    HD2  ARG  70           2HD      ARG  70  12.638  -4.783  -3.125
  578    HD3  ARG  70           1HD      ARG  70  12.566  -3.859  -4.627
  579    HE   ARG  70           HE       ARG  70  14.335  -2.467  -3.138
  580   HH11  ARG  70          1HH1      ARG  70  14.127  -5.799  -4.006
  581   HH12  ARG  70          2HH1      ARG  70  15.839  -6.021  -3.953
  582   HH21  ARG  70          1HH2      ARG  70  16.515  -2.766  -3.083
  583   HH22  ARG  70          2HH2      ARG  70  17.180  -4.325  -3.440
  584    H    ASP  71           H        ASP  71  13.108  -5.040   0.695
  585    HA   ASP  71           HA       ASP  71  13.509  -7.095  -1.261
  586    HB2  ASP  71           2HB      ASP  71  15.306  -6.235   0.229
  587    HB3  ASP  71           1HB      ASP  71  14.485  -6.962   1.606
  588    H    ARG  72           H        ARG  72  11.748  -6.905   1.812
  589    HA   ARG  72           HA       ARG  72  11.044  -9.727   1.689
  590    HB2  ARG  72           2HB      ARG  72   9.747  -9.233   3.788
  591    HB3  ARG  72           1HB      ARG  72  11.477  -8.946   3.888
  592    HG2  ARG  72           2HG      ARG  72  11.181  -6.587   3.775
  593    HG3  ARG  72           1HG      ARG  72   9.474  -6.762   3.362
  594    HD2  ARG  72           2HD      ARG  72  10.706  -7.662   5.972
  595    HD3  ARG  72           1HD      ARG  72   9.878  -6.119   5.740
  596    HE   ARG  72           HE       ARG  72   8.174  -8.185   4.910
  597   HH11  ARG  72          1HH1      ARG  72   9.573  -7.011   7.844
  598   HH12  ARG  72          2HH1      ARG  72   8.224  -7.521   8.802
  599   HH21  ARG  72          1HH2      ARG  72   6.476  -8.814   6.143
  600   HH22  ARG  72          2HH2      ARG  72   6.484  -8.514   7.848
  601    H    PHE  73           H        PHE  73   9.639  -6.694   0.779
  602    HA   PHE  73           HA       PHE  73   7.014  -7.959   0.332
  603    HB2  PHE  73           2HB      PHE  73   7.904  -5.103   0.618
  604    HB3  PHE  73           1HB      PHE  73   6.372  -5.510  -0.137
  605    HD1  PHE  73           HD1      PHE  73   4.653  -6.770   1.185
  606    HD2  PHE  73           HD2      PHE  73   8.143  -5.127   2.990
  607    HE1  PHE  73           HE1      PHE  73   3.591  -6.952   3.393
  608    HE2  PHE  73           HE2      PHE  73   7.085  -5.310   5.201
  609    HZ   PHE  73           HZ       PHE  73   4.807  -6.223   5.405
  610    H    ASP  74           H        ASP  74   9.246  -8.471  -1.366
  611    HA   ASP  74           HA       ASP  74   9.273  -7.008  -3.761
  612    HB2  ASP  74           2HB      ASP  74  10.439  -8.944  -4.718
  613    HB3  ASP  74           1HB      ASP  74  11.064  -8.555  -3.118
  614    H    GLY  75           H        GLY  75   6.957  -9.270  -2.584
  615    HA2  GLY  75           2HA      GLY  75   4.947  -8.863  -4.339
  616    HA3  GLY  75           1HA      GLY  75   5.942 -10.021  -5.207
  617    H    TYR  76           H        TYR  76   3.998  -9.515  -2.310
  618    HA   TYR  76           HA       TYR  76   4.092 -12.387  -1.700
  619    HB2  TYR  76           2HB      TYR  76   3.151 -11.811   0.464
  620    HB3  TYR  76           1HB      TYR  76   4.539 -10.784   0.130
  621    HD1  TYR  76           HD1      TYR  76   4.253  -8.399  -0.327
  622    HD2  TYR  76           HD2      TYR  76   0.915 -10.868   0.613
  623    HE1  TYR  76           HE1      TYR  76   2.902  -6.395   0.107
  624    HE2  TYR  76           HE2      TYR  76  -0.449  -8.868   1.049
  625    HH   TYR  76           HH       TYR  76   0.589  -5.716   0.187
  626    H    ILE  77           H        ILE  77   2.176 -13.602  -1.295
  627    HA   ILE  77           HA       ILE  77  -0.214 -12.612  -2.725
  628    HB   ILE  77           HB       ILE  77   0.618 -15.458  -2.088
  629   HG12  ILE  77          2HG1      ILE  77   1.937 -14.432  -3.893
  630   HG13  ILE  77          1HG1      ILE  77   0.892 -15.704  -4.514
  631   HG21  ILE  77          1HG2      ILE  77  -1.804 -15.259  -2.009
  632   HG22  ILE  77          2HG2      ILE  77  -1.312 -16.146  -3.453
  633   HG23  ILE  77          3HG2      ILE  77  -1.810 -14.458  -3.583
  634   HD11  ILE  77          3HD1      ILE  77   0.955 -13.762  -5.983
  635   HD12  ILE  77          1HD1      ILE  77   0.333 -12.752  -4.680
  636   HD13  ILE  77          2HD1      ILE  77  -0.666 -14.041  -5.348
  637    H    PHE  78           H        PHE  78  -1.531 -11.656  -1.231
  638    HA   PHE  78           HA       PHE  78  -1.938 -12.973   1.372
  639    HB2  PHE  78           2HB      PHE  78  -1.399 -10.546   1.336
  640    HB3  PHE  78           1HB      PHE  78  -2.880 -10.247   0.437
  641    HD1  PHE  78           HD1      PHE  78  -1.623 -11.651   3.650
  642    HD2  PHE  78           HD2      PHE  78  -4.879  -9.830   1.588
  643    HE1  PHE  78           HE1      PHE  78  -2.845 -11.429   5.775
  644    HE2  PHE  78           HE2      PHE  78  -6.100  -9.608   3.710
  645    HZ   PHE  78           HZ       PHE  78  -5.085 -10.406   5.805
  646    H    LEU  79           H        LEU  79  -3.872 -13.848   2.001
  647    HA   LEU  79           HA       LEU  79  -6.075 -13.809   0.028
  648    HB2  LEU  79           2HB      LEU  79  -5.329 -15.914   2.064
  649    HB3  LEU  79           1HB      LEU  79  -6.765 -15.976   1.057
  650    HG   LEU  79           HG       LEU  79  -3.924 -15.994   0.013
  651   HD11  LEU  79          1HD1      LEU  79  -4.342 -18.355  -0.501
  652   HD12  LEU  79          2HD1      LEU  79  -5.900 -18.256   0.319
  653   HD13  LEU  79          3HD1      LEU  79  -4.407 -18.036   1.231
  654   HD21  LEU  79          3HD2      LEU  79  -4.966 -16.600  -2.118
  655   HD22  LEU  79          1HD2      LEU  79  -5.507 -15.018  -1.563
  656   HD23  LEU  79          2HD2      LEU  79  -6.560 -16.421  -1.392
  657    H    ASP  80           H        ASP  80  -8.203 -13.564   0.724
  658    HA   ASP  80           HA       ASP  80  -8.580 -12.622   3.497
  659    HB2  ASP  80           2HB      ASP  80 -10.473 -11.380   2.699
  660    HB3  ASP  80           1HB      ASP  80  -9.153 -11.080   1.570
  661    H    SER  81           H        SER  81 -11.504 -12.960   3.329
  662    HA   SER  81           HA       SER  81 -11.700 -15.710   4.136
  663    HB2  SER  81           2HB      SER  81 -13.863 -13.622   3.729
  664    HB3  SER  81           1HB      SER  81 -14.104 -15.197   4.489
  665    HG   SER  81           HG       SER  81 -12.813 -12.920   5.456
  666    H    LYS  82           H        LYS  82 -12.861 -13.852   1.322
  667    HA   LYS  82           HA       LYS  82 -14.204 -16.012   0.062
  668    HB2  LYS  82           2HB      LYS  82 -13.048 -13.451  -1.063
  669    HB3  LYS  82           1HB      LYS  82 -13.984 -14.590  -2.022
  670    HG2  LYS  82           2HG      LYS  82 -14.973 -13.096   0.411
  671    HG3  LYS  82           1HG      LYS  82 -15.356 -12.720  -1.272
  672    HD2  LYS  82           2HD      LYS  82 -16.368 -14.997  -1.478
  673    HD3  LYS  82           1HD      LYS  82 -16.109 -15.215   0.255
  674    HE2  LYS  82           2HE      LYS  82 -17.792 -13.052  -1.020
  675    HE3  LYS  82           1HE      LYS  82 -18.405 -14.514  -0.249
  676    HZ1  LYS  82           3HZ      LYS  82 -17.451 -13.771   1.842
  677    HZ2  LYS  82           1HZ      LYS  82 -18.519 -12.613   1.228
  678    HZ3  LYS  82           2HZ      LYS  82 -16.851 -12.372   1.103
  679    H    GLY  83           H        GLY  83 -10.858 -14.910  -0.039
  680    HA2  GLY  83           2HA      GLY  83  -9.068 -16.460  -0.415
  681    HA3  GLY  83           1HA      GLY  83 -10.140 -17.423  -1.420
  682    H    LEU  84           H        LEU  84  -9.800 -13.944  -1.674
  683    HA   LEU  84           HA       LEU  84  -9.003 -14.176  -4.456
  684    HB2  LEU  84           2HB      LEU  84  -9.445 -11.698  -2.776
  685    HB3  LEU  84           1HB      LEU  84  -9.300 -11.755  -4.522
  686    HG   LEU  84           HG       LEU  84 -11.557 -12.958  -2.902
  687   HD11  LEU  84          1HD1      LEU  84 -11.596 -10.507  -2.962
  688   HD12  LEU  84          2HD1      LEU  84 -12.935 -11.208  -3.870
  689   HD13  LEU  84          3HD1      LEU  84 -11.539 -10.549  -4.724
  690   HD21  LEU  84          3HD2      LEU  84 -11.169 -12.812  -5.898
  691   HD22  LEU  84          1HD2      LEU  84 -12.619 -13.387  -5.071
  692   HD23  LEU  84          2HD2      LEU  84 -11.101 -14.270  -4.906
  693    H    GLU  85           H        GLU  85  -6.883 -14.554  -4.842
  694    HA   GLU  85           HA       GLU  85  -4.761 -13.932  -3.105
  695    HB2  GLU  85           2HB      GLU  85  -4.696 -14.402  -6.091
  696    HB3  GLU  85           1HB      GLU  85  -3.288 -14.408  -5.037
  697    HG2  GLU  85           2HG      GLU  85  -4.146 -16.348  -3.856
  698    HG3  GLU  85           1HG      GLU  85  -5.616 -16.315  -4.833
  699    H    TYR  86           H        TYR  86  -4.244 -11.928  -2.499
  700    HA   TYR  86           HA       TYR  86  -4.257  -9.723  -4.427
  701    HB2  TYR  86           2HB      TYR  86  -3.580  -9.590  -1.476
  702    HB3  TYR  86           1HB      TYR  86  -3.982  -8.250  -2.540
  703    HD1  TYR  86           HD1      TYR  86  -6.434  -8.654  -3.743
  704    HD2  TYR  86           HD2      TYR  86  -5.199 -10.164   0.046
  705    HE1  TYR  86           HE1      TYR  86  -8.786  -8.804  -3.035
  706    HE2  TYR  86           HE2      TYR  86  -7.542 -10.316   0.755
  707    HH   TYR  86           HH       TYR  86 -10.103 -10.235  -1.267
  708    HA   PRO  87           HA       PRO  87   0.248 -10.518  -4.506
  709    HB2  PRO  87           2HB      PRO  87   0.435  -9.971  -7.248
  710    HB3  PRO  87           1HB      PRO  87   0.219 -11.562  -6.523
  711    HG2  PRO  87           2HG      PRO  87  -1.643 -10.159  -8.136
  712    HG3  PRO  87           1HG      PRO  87  -1.920 -11.668  -7.252
  713    HD2  PRO  87           2HD      PRO  87  -2.637  -8.873  -6.501
  714    HD3  PRO  87           1HD      PRO  87  -3.460 -10.398  -6.109
  715    H    ALA  88           H        ALA  88   1.069  -8.745  -3.435
  716    HA   ALA  88           HA       ALA  88   0.927  -6.118  -4.769
  717    HB1  ALA  88           3HB      ALA  88  -0.024  -6.249  -2.508
  718    HB2  ALA  88           1HB      ALA  88   1.345  -5.141  -2.584
  719    HB3  ALA  88           2HB      ALA  88   1.548  -6.748  -1.883
  720    H    VAL  89           H        VAL  89   2.687  -5.388  -5.759
  721    HA   VAL  89           HA       VAL  89   5.351  -6.291  -4.846
  722    HB   VAL  89           HB       VAL  89   4.848  -7.194  -7.055
  723   HG11  VAL  89          1HG1      VAL  89   3.216  -5.591  -7.829
  724   HG12  VAL  89          2HG1      VAL  89   4.528  -5.722  -9.000
  725   HG13  VAL  89          3HG1      VAL  89   4.449  -4.333  -7.916
  726   HG21  VAL  89          3HG2      VAL  89   7.162  -6.611  -6.593
  727   HG22  VAL  89          1HG2      VAL  89   6.889  -4.964  -7.162
  728   HG23  VAL  89          2HG2      VAL  89   6.796  -6.317  -8.292
  729    H    VAL  90           H        VAL  90   6.777  -4.744  -4.240
  730    HA   VAL  90           HA       VAL  90   5.906  -1.939  -4.499
  731    HB   VAL  90           HB       VAL  90   6.102  -2.724  -2.213
  732   HG11  VAL  90          1HG1      VAL  90   8.241  -3.406  -1.243
  733   HG12  VAL  90          2HG1      VAL  90   9.002  -3.292  -2.829
  734   HG13  VAL  90          3HG1      VAL  90   7.746  -4.496  -2.539
  735   HG21  VAL  90          3HG2      VAL  90   7.596  -1.001  -1.312
  736   HG22  VAL  90          1HG2      VAL  90   6.625  -0.378  -2.646
  737   HG23  VAL  90          2HG2      VAL  90   8.320  -0.791  -2.906
  738    H    GLU  91           H        GLU  91   7.105  -0.419  -5.509
  739    HA   GLU  91           HA       GLU  91   9.943  -0.759  -5.999
  740    HB2  GLU  91           2HB      GLU  91   9.792  -0.543  -8.436
  741    HB3  GLU  91           1HB      GLU  91   9.006  -2.013  -7.875
  742    HG2  GLU  91           2HG      GLU  91   6.838  -1.063  -8.191
  743    HG3  GLU  91           1HG      GLU  91   7.518   0.533  -8.502
  744    H    PHE  92           H        PHE  92  10.862   1.164  -7.215
  745    HA   PHE  92           HA       PHE  92   9.837   3.562  -6.007
  746    HB2  PHE  92           2HB      PHE  92  11.790   4.678  -6.949
  747    HB3  PHE  92           1HB      PHE  92  12.260   3.171  -6.176
  748    HD1  PHE  92           HD1      PHE  92  12.735   1.158  -7.629
  749    HD2  PHE  92           HD2      PHE  92  12.281   5.087  -9.216
  750    HE1  PHE  92           HE1      PHE  92  13.882   0.460  -9.690
  751    HE2  PHE  92           HE2      PHE  92  13.429   4.389 -11.274
  752    HZ   PHE  92           HZ       PHE  92  14.230   2.075 -11.514
  753    H    ALA  93           H        ALA  93   9.284   5.523  -7.098
  754    HA   ALA  93           HA       ALA  93   7.932   5.046  -9.689
  755    HB1  ALA  93           3HB      ALA  93   6.277   6.722  -8.976
  756    HB2  ALA  93           1HB      ALA  93   7.127   6.894  -7.438
  757    HB3  ALA  93           2HB      ALA  93   6.362   5.361  -7.857
  758    HA   PRO  94           HA       PRO  94  10.153   8.253 -11.829
  759    HB2  PRO  94           2HB      PRO  94   7.448   9.347 -12.506
  760    HB3  PRO  94           1HB      PRO  94   8.821   9.002 -13.567
  761    HG2  PRO  94           2HG      PRO  94   6.755   7.339 -13.487
  762    HG3  PRO  94           1HG      PRO  94   8.411   6.704 -13.563
  763    HD2  PRO  94           2HD      PRO  94   6.533   6.845 -11.238
  764    HD3  PRO  94           1HD      PRO  94   7.713   5.587 -11.662
  765    H    PHE  95           H        PHE  95  10.706  10.479 -11.749
  766    HA   PHE  95           HA       PHE  95  10.076  11.584  -9.101
  767    HB2  PHE  95           2HB      PHE  95  12.399  12.304 -10.906
  768    HB3  PHE  95           1HB      PHE  95  12.250  12.592  -9.174
  769    HD1  PHE  95           HD2      PHE  95  12.399  10.674  -7.588
  770    HD2  PHE  95           HD1      PHE  95  13.161  10.215 -11.753
  771    HE1  PHE  95           HE2      PHE  95  13.515   8.527  -7.146
  772    HE2  PHE  95           HE1      PHE  95  14.272   8.066 -11.316
  773    HZ   PHE  95           HZ       PHE  95  14.452   7.220  -9.011
  774    H    GLN  96           H        GLN  96   8.191  12.127 -11.183
  775    HA   GLN  96           HA       GLN  96   8.671  14.650 -12.407
  776    HB2  GLN  96           2HB      GLN  96   7.077  13.132 -13.391
  777    HB3  GLN  96           1HB      GLN  96   6.101  13.132 -11.931
  778    HG2  GLN  96           2HG      GLN  96   5.116  14.480 -13.732
  779    HG3  GLN  96           1HG      GLN  96   5.464  15.433 -12.294
  780   HE21  GLN  96          1HE2      GLN  96   7.069  17.016 -12.388
  781   HE22  GLN  96          2HE2      GLN  96   7.765  17.537 -13.878
  782    H    LYS  97           H        LYS  97   6.004  14.058 -10.121
  783    HA   LYS  97           HA       LYS  97   4.948  15.422  -8.657
  784    HB2  LYS  97           2HB      LYS  97   6.933  15.034  -7.302
  785    HB3  LYS  97           1HB      LYS  97   7.777  16.351  -8.102
  786    HG2  LYS  97           2HG      LYS  97   7.002  17.011  -5.883
  787    HG3  LYS  97           1HG      LYS  97   6.216  17.962  -7.145
  788    HD2  LYS  97           2HD      LYS  97   4.578  17.343  -5.481
  789    HD3  LYS  97           1HD      LYS  97   4.233  16.479  -6.977
  790    HE2  LYS  97           2HE      LYS  97   5.342  14.481  -6.061
  791    HE3  LYS  97           1HE      LYS  97   5.660  15.353  -4.563
  792    HZ1  LYS  97           3HZ      LYS  97   3.007  14.623  -5.674
  793    HZ2  LYS  97           1HZ      LYS  97   3.222  15.624  -4.328
  794    HZ3  LYS  97           2HZ      LYS  97   3.728  14.014  -4.270