*HEADER    CONTRACTILE PROTEIN                     06-DEC-12   2M1U              
*TITLE     SOLUTION STRUCTURE OF THE SMALL DICTYOSTELIUM DISCOIDEIUM MYOSIN LIGHT
*TITLE    2 CHAIN MLCB PROVIDES INSIGHTS INTO IQ-MOTIF RECOGNITION OF CLASS I    
*TITLE    3 MYOSIN MYO1B                                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MYOSIN LIGHT CHAIN MLCB;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE;                       
*SOURCE   3 ORGANISM_TAXID: 4932;                                                
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR: PET28A                                     
*KEYWDS    MYOSIN LIGHT CHAIN, CONTRACTILE PROTEIN                               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    21                                                                    
*AUTHOR    J.LIBURD, S.CHITAYAT, S.W.CRAWLEY, C.M.DENIS, G.P.COTE, S.P.SMITH     
*REVDAT   1   11-DEC-13 2M1U    0                                                


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! S 22 Phi Psi
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       (resid  22 and name CA) (resid  22 and name C) 1.0   -71.59    30.00  2
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       (resid  22 and name C) (resid  23 and name  N) 1.0   -28.82    32.00  2
! D 23  Phi Psi
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       (resid  23 and name CA) (resid  23 and name C) 1.0   -66.56    30.00  2
assign (resid  23 and name N) (resid  23 and name CA)
       (resid  23 and name C) (resid  24 and name  N) 1.0   -40.36    30.00  2
! E 24  Phi Psi
assign (resid  23 and name C ) (resid  24 and name N)
       (resid  24 and name CA) (resid  24 and name C) 1.0   -60.99    30.00  2
assign (resid  24 and name N) (resid  24 and name CA)
       (resid  24 and name C) (resid  25 and name  N) 1.0   -43.82    30.00  2
! K 25  Phi Psi
assign (resid  24 and name C ) (resid  25 and name N)
       (resid  25 and name CA) (resid  25 and name C) 1.0   -61.13    30.00  2
assign (resid  25 and name N) (resid  25 and name CA)
       (resid  25 and name C) (resid  26 and name  N) 1.0   -39.09    30.00  2
! T 26  Phi Psi
assign (resid  25 and name C ) (resid  26 and name N)
       (resid  26 and name CA) (resid  26 and name C) 1.0   -60.27    30.00  2
assign (resid  26 and name N) (resid  26 and name CA)
       (resid  26 and name C) (resid  27 and name  N) 1.0   -45.42    30.00  2
! Q 27  Phi Psi
assign (resid  26 and name C ) (resid  27 and name N)
       (resid  27 and name CA) (resid  27 and name C) 1.0   -67.68    30.00  2
assign (resid  27 and name N) (resid  27 and name CA)
       (resid  27 and name C) (resid  28 and name  N) 1.0   -34.46    30.00  2
! L 28  Phi Psi
assign (resid  27 and name C ) (resid  28 and name N)
       (resid  28 and name CA) (resid  28 and name C) 1.0   -57.64    30.00  2
assign (resid  28 and name N) (resid  28 and name CA)
       (resid  28 and name C) (resid  29 and name  N) 1.0   -41.62    30.00  2
! I 29  Phi Psi
assign (resid  28 and name C ) (resid  29 and name N)
       (resid  29 and name CA) (resid  29 and name C) 1.0   -65.50    30.00  2
assign (resid  29 and name N) (resid  29 and name CA)
       (resid  29 and name C) (resid  30 and name  N) 1.0   -40.86    30.00  2
! E 30  Phi Psi
assign (resid  29 and name C ) (resid  30 and name N)
       (resid  30 and name CA) (resid  30 and name C) 1.0   -65.02    30.00  2
assign (resid  30 and name N) (resid  30 and name CA)
       (resid  30 and name C) (resid  31 and name  N) 1.0   -33.72    32.34  2
! A 31  Phi Psi
assign (resid  30 and name C ) (resid  31 and name N)
       (resid  31 and name CA) (resid  31 and name C) 1.0   -63.22    30.00  2
assign (resid  31 and name N) (resid  31 and name CA)
       (resid  31 and name C) (resid  32 and name  N) 1.0   -42.03    30.00  2
! F 32  Phi Psi
assign (resid  31 and name C ) (resid  32 and name N)
       (resid  32 and name CA) (resid  32 and name C) 1.0   -69.14    30.00  2
assign (resid  32 and name N) (resid  32 and name CA)
       (resid  32 and name C) (resid  33 and name  N) 1.0   -38.27    30.00  2
! F 42  Phi Psi
assign (resid  41 and name C ) (resid  42 and name N)
       (resid  42 and name CA) (resid  42 and name C) 1.0  -103.70    50.74  2
assign (resid  42 and name N) (resid  42 and name CA)
       (resid  42 and name C) (resid  43 and name  N) 1.0   153.90    30.00  2
! V 43  Phi Psi
assign (resid  42 and name C ) (resid  43 and name N)
       (resid  43 and name CA) (resid  43 and name C) 1.0  -113.60    68.82  2
assign (resid  43 and name N) (resid  43 and name CA)
       (resid  43 and name C) (resid  44 and name  N) 1.0   139.25    33.08  2
! S 44  Phi Psi
assign (resid  43 and name C ) (resid  44 and name N)
       (resid  44 and name CA) (resid  44 and name C) 1.0   -84.23    58.10  2
assign (resid  44 and name N) (resid  44 and name CA)
       (resid  44 and name C) (resid  45 and name  N) 1.0   156.49    30.00  2
! V 45  Phi Psi
assign (resid  44 and name C ) (resid  45 and name N)
       (resid  45 and name CA) (resid  45 and name C) 1.0   -59.41    30.00  2
assign (resid  45 and name N) (resid  45 and name CA)
       (resid  45 and name C) (resid  46 and name  N) 1.0   -39.42    30.00  2
! E 46  Phi Psi
assign (resid  45 and name C ) (resid  46 and name N)
       (resid  46 and name CA) (resid  46 and name C) 1.0   -63.67    30.00  2
assign (resid  46 and name N) (resid  46 and name CA)
       (resid  46 and name C) (resid  47 and name  N) 1.0   -41.46    30.00  2
! E 47  Phi Psi
assign (resid  46 and name C ) (resid  47 and name N)
       (resid  47 and name CA) (resid  47 and name C) 1.0   -66.42    30.00  2
assign (resid  47 and name N) (resid  47 and name CA)
       (resid  47 and name C) (resid  48 and name  N) 1.0   -40.64    30.00  2
! F 48  Phi Psi
assign (resid  47 and name C ) (resid  48 and name N)
       (resid  48 and name CA) (resid  48 and name C) 1.0   -64.51    30.00  2
assign (resid  48 and name N) (resid  48 and name CA)
       (resid  48 and name C) (resid  49 and name  N) 1.0   -40.92    30.00  2
! R 49  Phi Psi
assign (resid  48 and name C ) (resid  49 and name N)
       (resid  49 and name CA) (resid  49 and name C) 1.0   -60.64    30.00  2
assign (resid  49 and name N) (resid  49 and name CA)
       (resid  49 and name C) (resid  50 and name  N) 1.0   -41.52    30.00  2
! I 51  Phi Psi
assign (resid  50 and name C ) (resid  51 and name N)
       (resid  51 and name CA) (resid  51 and name C) 1.0   -65.57    30.00  2
assign (resid  51 and name N) (resid  51 and name CA)
       (resid  51 and name C) (resid  52 and name  N) 1.0   -34.83    30.00  2
! I 52  Phi Psi
assign (resid  51 and name C ) (resid  52 and name N)
       (resid  52 and name CA) (resid  52 and name C) 1.0   -63.15    30.00  2
assign (resid  52 and name N) (resid  52 and name CA)
       (resid  52 and name C) (resid  53 and name  N) 1.0   -39.39    30.00  2
! R 53  Phi Psi
assign (resid  52 and name C ) (resid  53 and name N)
       (resid  53 and name CA) (resid  53 and name C) 1.0   -64.25    30.00  2
assign (resid  53 and name N) (resid  53 and name CA)
       (resid  53 and name C) (resid  54 and name  N) 1.0   -40.93    30.00  2
! D 54  Phi Psi
assign (resid  53 and name C ) (resid  54 and name N)
       (resid  54 and name CA) (resid  54 and name C) 1.0   -81.55    30.00  2
assign (resid  54 and name N) (resid  54 and name CA)
       (resid  54 and name C) (resid  55 and name  N) 1.0   -21.30    35.72  2
! L 56  Phi Psi
assign (resid  55 and name C ) (resid  56 and name N)
       (resid  56 and name CA) (resid  56 and name C) 1.0   -90.29    38.70  2
assign (resid  56 and name N) (resid  56 and name CA)
       (resid  56 and name C) (resid  57 and name  N) 1.0   138.36    39.68  2
! M 58  Phi Psi
assign (resid  57 and name C ) (resid  58 and name N)
       (resid  58 and name CA) (resid  58 and name C) 1.0  -105.47    58.18  2
assign (resid  58 and name N) (resid  58 and name CA)
       (resid  58 and name C) (resid  59 and name  N) 1.0   149.28    30.00  2
! T 59  Phi Psi
assign (resid  58 and name C ) (resid  59 and name N)
       (resid  59 and name CA) (resid  59 and name C) 1.0   -86.54    30.00  2
assign (resid  59 and name N) (resid  59 and name CA)
       (resid  59 and name C) (resid  60 and name  N) 1.0   167.75    30.00  2
! E 60  Phi Psi
assign (resid  59 and name C ) (resid  60 and name N)
       (resid  60 and name CA) (resid  60 and name C) 1.0   -57.15    30.00  2
assign (resid  60 and name N) (resid  60 and name CA)
       (resid  60 and name C) (resid  61 and name  N) 1.0   -38.98    30.00  2
! A 61  Phi Psi
assign (resid  60 and name C ) (resid  61 and name N)
       (resid  61 and name CA) (resid  61 and name C) 1.0   -62.33    30.00  2
assign (resid  61 and name N) (resid  61 and name CA)
       (resid  61 and name C) (resid  62 and name  N) 1.0   -42.51    30.00  2
! E 62  Phi Psi
assign (resid  61 and name C ) (resid  62 and name N)
       (resid  62 and name CA) (resid  62 and name C) 1.0   -65.66    30.00  2
assign (resid  62 and name N) (resid  62 and name CA)
       (resid  62 and name C) (resid  63 and name  N) 1.0   -40.86    30.00  2
! I 63  Phi Psi
assign (resid  62 and name C ) (resid  63 and name N)
       (resid  63 and name CA) (resid  63 and name C) 1.0   -65.75    30.00  2
assign (resid  63 and name N) (resid  63 and name CA)
       (resid  63 and name C) (resid  64 and name  N) 1.0   -41.92    30.00  2
! T 64  Phi Psi
assign (resid  63 and name C ) (resid  64 and name N)
       (resid  64 and name CA) (resid  64 and name C) 1.0   -62.50    30.00  2
assign (resid  64 and name N) (resid  64 and name CA)
       (resid  64 and name C) (resid  65 and name  N) 1.0   -39.00    30.00  2
! E 65  Phi Psi
assign (resid  64 and name C ) (resid  65 and name N)
       (resid  65 and name CA) (resid  65 and name C) 1.0   -59.73    30.00  2
assign (resid  65 and name N) (resid  65 and name CA)
       (resid  65 and name C) (resid  66 and name  N) 1.0   -41.72    30.00  2
! F 66  Phi Psi
assign (resid  65 and name C ) (resid  66 and name N)
       (resid  66 and name CA) (resid  66 and name C) 1.0   -66.29    30.00  2
assign (resid  66 and name N) (resid  66 and name CA)
       (resid  66 and name C) (resid  67 and name  N) 1.0   -41.96    30.00  2
! F 67  Phi Psi
assign (resid  66 and name C ) (resid  67 and name N)
       (resid  67 and name CA) (resid  67 and name C) 1.0   -65.34    30.00  2
assign (resid  67 and name N) (resid  67 and name CA)
       (resid  67 and name C) (resid  68 and name  N) 1.0   -37.61    30.00  2
! E 68  Phi Psi
assign (resid  67 and name C ) (resid  68 and name N)
       (resid  68 and name CA) (resid  68 and name C) 1.0   -63.96    30.00  2
assign (resid  68 and name N) (resid  68 and name CA)
       (resid  68 and name C) (resid  69 and name  N) 1.0   -40.13    30.00  2
! A 69  Phi Psi
assign (resid  68 and name C ) (resid  69 and name N)
       (resid  69 and name CA) (resid  69 and name C) 1.0   -69.55    30.00  2
assign (resid  69 and name N) (resid  69 and name CA)
       (resid  69 and name C) (resid  70 and name  N) 1.0   -27.60    30.00  2
! A 70  Phi Psi
assign (resid  69 and name C ) (resid  70 and name N)
       (resid  70 and name CA) (resid  70 and name C) 1.0   -82.22    30.00  2
assign (resid  70 and name N) (resid  70 and name CA)
       (resid  70 and name C) (resid  71 and name  N) 1.0   -17.32    46.98  2
! D 71  Phi Psi
assign (resid  71 and name N) (resid  71 and name CA)
       (resid  71 and name C) (resid  72 and name  N) 1.0    82.85    48.94  2
! P 72  Phi Psi
assign (resid  71 and name C ) (resid  72 and name N)
       (resid  72 and name CA) (resid  72 and name C) 1.0   -61.15    30.00  2
assign (resid  72 and name N) (resid  72 and name CA)
       (resid  72 and name C) (resid  73 and name  N) 1.0   -23.85    30.00  2
! N 73  Phi Psi
assign (resid  72 and name C ) (resid  73 and name N)
       (resid  73 and name CA) (resid  73 and name C) 1.0   -98.57    30.00  2
assign (resid  73 and name N) (resid  73 and name CA)
       (resid  73 and name C) (resid  74 and name  N) 1.0    -2.57    30.00  2
! F 77  Phi Psi
assign (resid  76 and name C ) (resid  77 and name N)
       (resid  77 and name CA) (resid  77 and name C) 1.0  -120.58    35.82  2
assign (resid  77 and name N) (resid  77 and name CA)
       (resid  77 and name C) (resid  78 and name  N) 1.0   159.52    30.00  2
! I 78  Phi Psi
assign (resid  77 and name C ) (resid  78 and name N)
       (resid  78 and name CA) (resid  78 and name C) 1.0  -126.16    30.00  2
assign (resid  78 and name N) (resid  78 and name CA)
       (resid  78 and name C) (resid  79 and name  N) 1.0   140.03    32.78  2
! D 79  Phi Psi
assign (resid  78 and name C ) (resid  79 and name N)
       (resid  79 and name CA) (resid  79 and name C) 1.0   -97.08    60.56  2
assign (resid  79 and name N) (resid  79 and name CA)
       (resid  79 and name C) (resid  80 and name  N) 1.0   126.56    30.00  2
! Y 80  Phi Psi
assign (resid  79 and name C ) (resid  80 and name N)
       (resid  80 and name CA) (resid  80 and name C) 1.0   -58.79    30.00  2
assign (resid  80 and name N) (resid  80 and name CA)
       (resid  80 and name C) (resid  81 and name  N) 1.0   -37.55    30.00  2
! K 81  Phi Psi
assign (resid  80 and name C ) (resid  81 and name N)
       (resid  81 and name CA) (resid  81 and name C) 1.0   -60.85    30.00  2
assign (resid  81 and name N) (resid  81 and name CA)
       (resid  81 and name C) (resid  82 and name  N) 1.0   -41.74    30.00  2
! A 82  Phi Psi
assign (resid  81 and name C ) (resid  82 and name N)
       (resid  82 and name CA) (resid  82 and name C) 1.0   -62.89    30.00  2
assign (resid  82 and name N) (resid  82 and name CA)
       (resid  82 and name C) (resid  83 and name  N) 1.0   -42.06    30.00  2
! F 83  Phi Psi
assign (resid  82 and name C ) (resid  83 and name N)
       (resid  83 and name CA) (resid  83 and name C) 1.0   -64.25    30.00  2
assign (resid  83 and name N) (resid  83 and name CA)
       (resid  83 and name C) (resid  84 and name  N) 1.0   -42.32    30.00  2
! A 84  Phi Psi
assign (resid  83 and name C ) (resid  84 and name N)
       (resid  84 and name CA) (resid  84 and name C) 1.0   -61.55    30.00  2
assign (resid  84 and name N) (resid  84 and name CA)
       (resid  84 and name C) (resid  85 and name  N) 1.0   -39.39    30.00  2
! A 85  Phi Psi
assign (resid  84 and name C ) (resid  85 and name N)
       (resid  85 and name CA) (resid  85 and name C) 1.0   -64.06    30.00  2
assign (resid  85 and name N) (resid  85 and name CA)
       (resid  85 and name C) (resid  86 and name  N) 1.0   -42.22    30.00  2
! M 86  Phi Psi
assign (resid  85 and name C ) (resid  86 and name N)
       (resid  86 and name CA) (resid  86 and name C) 1.0   -66.19    30.00  2
assign (resid  86 and name N) (resid  86 and name CA)
       (resid  86 and name C) (resid  87 and name  N) 1.0   -36.62    30.00  2
! L 87  Phi Psi
assign (resid  86 and name C ) (resid  87 and name N)
       (resid  87 and name CA) (resid  87 and name C) 1.0   -70.62    30.00  2
assign (resid  87 and name N) (resid  87 and name CA)
       (resid  87 and name C) (resid  88 and name  N) 1.0   -29.23    30.00  2
! Y 88  Phi Psi
assign (resid  87 and name C ) (resid  88 and name N)
       (resid  88 and name CA) (resid  88 and name C) 1.0   -93.35    32.52  2
assign (resid  88 and name N) (resid  88 and name CA)
       (resid  88 and name C) (resid  89 and name  N) 1.0    -8.17    30.00  2
set message on echo on end
assign ( resid 75 and name Hg# ) ( resid 73 and name Hb* ) 2.2 0.4 0.8
assign ( resid 84 and name Hb* ) ( resid 81 and name ha ) 2.2 0.4 0.8
assign ( resid 58 and name He* ) ( resid 63 and name ha ) 2.2 0.4 0.8
assign ( resid 52 and name hb ) ( resid 49 and name ha ) 3 1.2 2
assign ( resid 73 and name Hb* ) ( resid 75 and name hg21 ) 2.2 0.4 0.8
assign ( resid 73 and name Hb* ) ( resid 75 and name hg21 ) 2.2 0.4 0.8
assign ( resid 75 and name hb ) ( resid 77 and name Hd* ) 3 1.2 2
assign ( resid 84 and name Hb* ) ( resid 80 and name Hd* ) 3 1.2 2
assign ( resid 84 and name Hb* ) ( resid 88 and name Hd* ) 3 1.2 2
assign ( resid 75 and name Hg# ) ( resid 73 and name Hb* ) 2.2 0.4 0.8
assign ( resid 76 and name Ha* ) ( resid 45 and name hb ) 3 1.2 2
assign ( resid 76 and name Ha* ) ( resid 45 and name hb ) 4.3 2.5 1.7
assign ( resid 76 and name Ha* ) ( resid 45 and name hg21 ) 3 1.2 2
assign ( resid 76 and name Ha* ) ( resid 45 and name hg11 ) 3 1.2 2
assign ( resid 76 and name Ha* ) ( resid 45 and name hg21 ) 3 1.2 2
assign ( resid 77 and name ha ) ( resid 45 and name hg21 ) 3 1.2 2
assign ( resid 77 and name ha ) ( resid 44 and name ha ) 3 1.2 2
assign ( resid 78 and name Hd# ) ( resid 83 and name Hb* ) 3 1.2 2
assign ( resid 78 and name Hd# ) ( resid 48 and name Hb* ) 3 1.2 2
assign ( resid 78 and name Hd# ) ( resid 67 and name ha ) 3 1.2 2
assign ( resid 78 and name Hd# ) ( resid 83 and name Hd* ) 3 1.2 2
assign ( resid 78 and name Hd# ) ( resid 67 and name He* ) 2.2 0.4 0.8
assign ( resid 78 and name Hd# ) ( resid 67 and name Hd* ) 3 1.2 2
assign ( resid 78 and name Hg# ) ( resid 71 and name Hb* ) 3 1.2 2
assign ( resid 78 and name Hg# ) ( resid 71 and name Hb* ) 3 1.2 2
assign ( resid 78 and name Hg# ) ( resid 83 and name Hb* ) 3 1.2 2
assign ( resid 78 and name Hg# ) ( resid 67 and name ha ) 3 1.2 2
assign ( resid 78 and name Hg# ) ( resid 83 and name He* ) 3 1.2 2
assign ( resid 78 and name Hg# ) ( resid 48 and name Hd* ) 3 1.2 2
assign ( resid 78 and name Hg# ) ( resid 83 and name Hd* ) 3 1.2 2
assign ( resid 71 and name Hb* ) ( resid 78 and name hg21 ) 3 1.2 2
assign ( resid 71 and name Hb* ) ( resid 78 and name hg21 ) 3 1.2 2
assign ( resid 71 and name Hb* ) ( resid 78 and name Hd# ) 3 1.2 2
assign ( resid 71 and name Hb* ) ( resid 78 and name Hd# ) 3 1.2 2
assign ( resid 79 and name ha ) ( resid 42 and name ha ) 3 1.2 2
assign ( resid 80 and name Hb* ) ( resid 43 and name hg11 ) 3 1.2 2
assign ( resid 84 and name Hb* ) ( resid 81 and name Hb* ) 3 1.2 2
assign ( resid 80 and name ha ) ( resid 78 and name Hd# ) 3 1.2 2
assign ( resid 80 and name ha ) ( resid 78 and name hg21 ) 3 1.2 2
assign ( resid 80 and name ha ) ( resid 43 and name hg11 ) 3 1.2 2
assign ( resid 80 and name ha ) ( resid 83 and name Hd* ) 3 1.2 2
assign ( resid 43 and name Hg# ) ( resid 80 and name Hb* ) 3 1.2 2
assign ( resid 43 and name Hg# ) ( resid 80 and name Hd* ) 3 1.2 2
assign ( resid 81 and name ha ) ( resid 84 and name Hb* ) 2.2 0.4 0.8
assign ( resid 82 and name Hb* ) ( resid 78 and name hg21 ) 3 1.2 2
assign ( resid 82 and name Hb* ) ( resid 70 and name Hb* ) 3 1.2 2
assign ( resid 82 and name Hb* ) ( resid 79 and name Hb* ) 3 1.2 2
assign ( resid 82 and name Hb* ) ( resid 79 and name Hb* ) 2.2 0.4 0.8
assign ( resid 82 and name Hb* ) ( resid 83 and name He* ) 3 1.2 2
assign ( resid 83 and name Hb* ) ( resid 78 and name hg21 ) 3 1.2 2
assign ( resid 83 and name Hb* ) ( resid 78 and name hg21 ) 3 1.2 2
assign ( resid 83 and name Hb* ) ( resid 70 and name Hb* ) 3 1.2 2
assign ( resid 83 and name Hb* ) ( resid 70 and name Hb* ) 3 1.2 2
assign ( resid 83 and name Hb* ) ( resid 78 and name hg12 ) 4.3 2.5 1.7
assign ( resid 83 and name Hb* ) ( resid 78 and name hg12 ) 3 1.2 2
assign ( resid 78 and name Hg# ) ( resid 67 and name Hd* ) 4.3 2.5 1.7
assign ( resid 82 and name Hb* ) ( resid 83 and name Hd* ) 4.3 2.5 1.7
assign ( resid 83 and name ha ) ( resid 86 and name Hg* ) 3 1.2 2
assign ( resid 83 and name ha ) ( resid 86 and name Hb* ) 3 1.2 2
assign ( resid 83 and name ha ) ( resid 86 and name He* ) 3 1.2 2
assign ( resid 83 and name ha ) ( resid 82 and name Hb* ) 3 1.2 2
assign ( resid 83 and name Hb* ) ( resid 80 and name ha ) 3 1.2 2
assign ( resid 83 and name Hb* ) ( resid 80 and name ha ) 3 1.2 2
assign ( resid 83 and name Hb* ) ( resid 78 and name Hd# ) 3 1.2 2
assign ( resid 83 and name Hb* ) ( resid 78 and name Hd# ) 3 1.2 2
assign ( resid 70 and name Hb* ) ( resid 83 and name Hd* ) 3 1.2 2
assign ( resid 70 and name Hb* ) ( resid 78 and name Hd# ) 2.2 0.4 0.8
assign ( resid 70 and name Hb* ) ( resid 78 and name hg21 ) 2.2 0.4 0.8
assign ( resid 84 and name ha ) ( resid 88 and name He* ) 3 1.2 2
assign ( resid 84 and name ha ) ( resid 88 and name Hd* ) 3 1.2 2
assign ( resid 84 and name ha ) ( resid 87 and name Hd# ) 2.2 0.4 0.8
assign ( resid 84 and name ha ) ( resid 87 and name Hb* ) 3 1.2 2
assign ( resid 87 and name Hd# ) ( resid 84 and name ha ) 3 1.2 2
assign ( resid 87 and name Hd# ) ( resid 83 and name Hd* ) 3 1.2 2
assign ( resid 85 and name ha ) ( resid 88 and name Hd* ) 3 1.2 2
assign ( resid 85 and name ha ) ( resid 88 and name Hb* ) 3 1.2 2
assign ( resid 85 and name ha ) ( resid 88 and name Hb* ) 4.3 2.5 1.7
assign ( resid 86 and name Hb* ) ( resid 83 and name ha ) 4.3 2.5 1.7
assign ( resid 86 and name Hb* ) ( resid 83 and name ha ) 3 1.2 2
assign ( resid 87 and name Hb* ) ( resid 84 and name ha ) 3 1.2 2
assign ( resid 87 and name Hb* ) ( resid 84 and name ha ) 3 1.2 2
assign ( resid 87 and name Hd# ) ( resid 83 and name Hd* ) 3 1.2 2
assign ( resid 71 and name Hb* ) ( resid 70 and name Hb* ) 4.3 2.5 1.7
assign ( resid 71 and name Hb* ) ( resid 70 and name Hb* ) 3 1.2 2
assign ( resid 71 and name ha ) ( resid 72 and name Hg* ) 3 1.2 2
assign ( resid 71 and name ha ) ( resid 72 and name Hg* ) 3 1.2 2
assign ( resid 71 and name ha ) ( resid 72 and name Hd* ) 2.2 0.4 0.8
assign ( resid 71 and name ha ) ( resid 72 and name Hd* ) 2.2 0.4 0.8
assign ( resid 45 and name Hg# ) ( resid 67 and name Hd* ) 3 1.2 2
assign ( resid 48 and name Hb* ) ( resid 45 and name ha ) 3 1.2 2
assign ( resid 48 and name Hb* ) ( resid 45 and name ha ) 2.2 0.4 0.8
assign ( resid 48 and name Hb* ) ( resid 43 and name hg21 ) 2.2 0.4 0.8
assign ( resid 48 and name Hb* ) ( resid 43 and name hg21 ) 2.2 0.4 0.8
assign ( resid 43 and name Hg# ) ( resid 48 and name Hd* ) 2.2 0.4 0.8
assign ( resid 43 and name Hg# ) ( resid 48 and name Hd* ) 2.2 0.4 0.8
assign ( resid 61 and name Hb* ) ( resid 60 and name Hb* ) 3 1.2 2
assign ( resid 61 and name Hb* ) ( resid 60 and name Hg* ) 2.2 0.4 0.8
assign ( resid 61 and name Hb* ) ( resid 64 and name hb ) 3 1.2 2
assign ( resid 61 and name ha ) ( resid 64 and name hg21 ) 3 1.2 2
assign ( resid 23 and name ha ) ( resid 26 and name ha ) 3 1.2 2
assign ( resid 23 and name Hb* ) ( resid 26 and name ha ) 4.3 2.5 1.7
assign ( resid 50 and name Ha* ) ( resid 53 and name Hb* ) 2.2 0.4 0.8
assign ( resid 50 and name Ha* ) ( resid 53 and name Hb* ) 3 1.2 2
assign ( resid 49 and name Hb* ) ( resid 67 and name He* ) 4.3 2.5 1.7
assign ( resid 48 and name Hb* ) ( resid 67 and name He* ) 4.3 2.5 1.7
assign ( resid 51 and name hb ) ( resid 48 and name Hd* ) 3 1.2 2
assign ( resid 51 and name hb ) ( resid 48 and name ha ) 2.2 0.4 0.8
assign ( resid 51 and name Hd# ) ( resid 48 and name ha ) 2.2 0.4 0.8
assign ( resid 51 and name Hd# ) ( resid 48 and name Hd* ) 2.2 0.4 0.8
assign ( resid 52 and name Hd# ) ( resid 48 and name Hd* ) 2.2 0.4 0.8
assign ( resid 52 and name Hd# ) ( resid 49 and name ha ) 3 1.2 2
assign ( resid 51 and name Hg# ) ( resid 48 and name ha ) 3 1.2 2
assign ( resid 51 and name Hg# ) ( resid 31 and name Hb* ) 3 1.2 2
assign ( resid 52 and name Hg# ) ( resid 48 and name Hd* ) 3 1.2 2
assign ( resid 52 and name Hg# ) ( resid 56 and name Hb* ) 2.2 0.4 0.8
assign ( resid 50 and name Ha* ) ( resid 53 and name Hd* ) 3 1.2 2
assign ( resid 50 and name Ha* ) ( resid 53 and name Hd* ) 3 1.2 2
assign ( resid 86 and name He* ) ( resid 83 and name ha ) 3 1.2 2
assign ( resid 58 and name He* ) ( resid 66 and name Hd* ) 3 1.2 2
assign ( resid 58 and name He* ) ( resid 66 and name Hb* ) 2.2 0.4 0.8
assign ( resid 86 and name He* ) ( resid 83 and name Hd* ) 3 1.2 2
assign ( resid 58 and name Hb* ) ( resid 63 and name Hd# ) 3 1.2 2
assign ( resid 58 and name Hb* ) ( resid 63 and name hg11 ) 3 1.2 2
assign ( resid 59 and name hb ) ( resid 62 and name Hg* ) 3 1.2 2
assign ( resid 59 and name hb ) ( resid 60 and name Hb* ) 3 1.2 2
assign ( resid 59 and name Hg# ) ( resid 62 and name Hg* ) 2.2 0.4 0.8
assign ( resid 59 and name ha ) ( resid 60 and name Hb* ) 3 1.2 2
assign ( resid 59 and name ha ) ( resid 60 and name Hg* ) 3 1.2 2
assign ( resid 44 and name Hb* ) ( resid 77 and name He* ) 3 1.2 2
assign ( resid 44 and name Hb* ) ( resid 77 and name He* ) 3 1.2 2
assign ( resid 44 and name ha ) ( resid 77 and name ha ) 2.2 0.4 0.8
assign ( resid 44 and name ha ) ( resid 77 and name Hd* ) 3 1.2 2
assign ( resid 45 and name ha ) ( resid 48 and name Hd* ) 3 1.2 2
assign ( resid 45 and name hb ) ( resid 48 and name Hd* ) 4.3 2.5 1.7
assign ( resid 78 and name Hd# ) ( resid 45 and name ha ) 4.3 2.5 1.7
assign ( resid 45 and name Hg# ) ( resid 67 and name He* ) 4.3 2.5 1.7
assign ( resid 45 and name Hg# ) ( resid 67 and name ha ) 3 1.2 2
assign ( resid 45 and name Hg# ) ( resid 67 and name He* ) 3 1.2 2
assign ( resid 45 and name Hg# ) ( resid 67 and name Hd* ) 3 1.2 2
assign ( resid 45 and name Hg# ) ( resid 67 and name ha ) 3 1.2 2
assign ( resid 45 and name Hg# ) ( resid 76 and name Ha* ) 4.3 2.5 1.7
assign ( resid 45 and name Hg# ) ( resid 76 and name Ha* ) 3 1.2 2
assign ( resid 46 and name ha ) ( resid 49 and name Hd* ) 3 1.2 2
assign ( resid 46 and name ha ) ( resid 49 and name Hd* ) 4.3 2.5 1.7
assign ( resid 63 and name ha ) ( resid 66 and name Hb* ) 2.2 0.4 0.8
assign ( resid 63 and name ha ) ( resid 67 and name Hb* ) 3 1.2 2
assign ( resid 63 and name ha ) ( resid 66 and name Hd* ) 4.3 2.5 1.7
assign ( resid 63 and name Hg# ) ( resid 67 and name Hd* ) 2.2 0.4 0.8
assign ( resid 63 and name Hg# ) ( resid 67 and name He* ) 2.2 0.4 0.8
assign ( resid 25 and name ha ) ( resid 87 and name Hd# ) 4.3 2.5 1.7
assign ( resid 25 and name Hb* ) ( resid 28 and name Hd# ) 4.3 2.5 1.7
assign ( resid 25 and name Hb* ) ( resid 87 and name Hd# ) 4.3 2.5 1.7
assign ( resid 87 and name Hd# ) ( resid 25 and name Hb* ) 3 1.2 2
assign ( resid 71 and name Hb* ) ( resid 70 and name ha ) 4.3 2.5 1.7
assign ( resid 71 and name Hb* ) ( resid 72 and name Hd* ) 4.3 2.5 1.7
assign ( resid 71 and name Hb* ) ( resid 72 and name Hd* ) 4.3 2.5 1.7
assign ( resid 78 and name Hg# ) ( resid 67 and name He* ) 4.3 2.5 1.7
assign ( resid 78 and name hg12 ) ( resid 67 and name He* ) 3 1.2 2
assign ( resid 31 and name Hb* ) ( resid 51 and name hg21 ) 3 1.2 2
assign ( resid 63 and name hb ) ( resid 60 and name ha ) 2.2 0.4 0.8
assign ( resid 29 and name hb ) ( resid 26 and name ha ) 2.2 0.4 0.8
assign ( resid 44 and name Hb* ) ( resid 77 and name Hd* ) 4.3 2.5 1.7
assign ( resid 44 and name Hb* ) ( resid 47 and name Hb* ) 3 1.2 2
assign ( resid 44 and name Hb* ) ( resid 47 and name Hb* ) 3 1.2 2
assign ( resid 44 and name Hb* ) ( resid 47 and name Hb* ) 4.3 2.5 1.7
assign ( resid 44 and name Hb* ) ( resid 47 and name Hb* ) 3 1.2 2
assign ( resid 81 and name ha ) ( resid 80 and name Hd* ) 3 1.2 2
assign ( resid 81 and name ha ) ( resid 80 and name He* ) 4.3 2.5 1.7
assign ( resid 45 and name ha ) ( resid 48 and name Hb* ) 3 1.2 2
assign ( resid 46 and name ha ) ( resid 45 and name hg11 ) 3 1.2 2
assign ( resid 47 and name Hb* ) ( resid 44 and name ha ) 4.3 2.5 1.7
assign ( resid 47 and name Hb* ) ( resid 43 and name hg21 ) 2.2 0.4 0.8
assign ( resid 47 and name Hb* ) ( resid 43 and name hg21 ) 3 1.2 2
assign ( resid 63 and name hg12 ) ( resid 52 and name Hd# ) 4.3 2.5 1.7
assign ( resid 79 and name ha ) ( resid 42 and name Hd* ) 3 1.2 2
assign ( resid 79 and name ha ) ( resid 42 and name Hb* ) 3 1.2 2
assign ( resid 77 and name ha ) ( resid 45 and name hg11 ) 4.3 2.5 1.7
assign ( resid 48 and name Hb* ) ( resid 52 and name Hd# ) 3 1.2 2
assign ( resid 48 and name Hb* ) ( resid 78 and name Hd# ) 3 1.2 2
assign ( resid 48 and name Hb* ) ( resid 78 and name Hd# ) 3 1.2 2
assign ( resid 48 and name Hb* ) ( resid 51 and name Hd# ) 4.3 2.5 1.7
assign ( resid 48 and name Hb* ) ( resid 51 and name Hd# ) 4.3 2.5 1.7
assign ( resid 78 and name Hd# ) ( resid 48 and name Hb* ) 4.3 2.5 1.7
assign ( resid 64 and name ha ) ( resid 63 and name hg21 ) 3 1.2 2
assign ( resid 64 and name ha ) ( resid 67 and name Hb* ) 3 1.2 2
assign ( resid 64 and name ha ) ( resid 67 and name Hb* ) 3 1.2 2
assign ( resid 64 and name ha ) ( resid 67 and name He* ) 3 1.2 2
assign ( resid 64 and name ha ) ( resid 67 and name Hd* ) 3 1.2 2
assign ( resid 78 and name Hd# ) ( resid 83 and name Hb* ) 4.3 2.5 1.7
assign ( resid 79 and name Hb* ) ( resid 82 and name Hb* ) 3 1.2 2
assign ( resid 79 and name Hb* ) ( resid 82 and name Hb* ) 2.2 0.4 0.8
assign ( resid 79 and name Hb* ) ( resid 42 and name Hd* ) 4.3 2.5 1.7
assign ( resid 79 and name Hb* ) ( resid 42 and name He* ) 3 1.2 2
assign ( resid 79 and name Hb* ) ( resid 42 and name He* ) 4.3 2.5 1.7
assign ( resid 43 and name Hg# ) ( resid 80 and name ha ) 4.3 2.5 1.7
assign ( resid 81 and name He* ) ( resid 80 and name He* ) 4.3 2.5 1.7
assign ( resid 81 and name Hg* ) ( resid 80 and name Hd* ) 4.3 2.5 1.7
assign ( resid 70 and name Hb* ) ( resid 82 and name Hb* ) 2.2 0.4 0.8
assign ( resid 63 and name Hg# ) ( resid 67 and name Hb* ) 3 1.2 2
assign ( resid 63 and name Hg# ) ( resid 67 and name Hb* ) 3 1.2 2
assign ( resid 63 and name Hg# ) ( resid 52 and name Hd# ) 3 1.2 2
assign ( resid 83 and name ha ) ( resid 78 and name Hd# ) 3 1.2 2
assign ( resid 83 and name ha ) ( resid 78 and name hg21 ) 4.3 2.5 1.7
assign ( resid 84 and name ha ) ( resid 28 and name Hd# ) 3 1.2 2
assign ( resid 84 and name Hb* ) ( resid 83 and name Hb* ) 4.3 2.5 1.7
assign ( resid 86 and name Hb* ) ( resid 85 and name Hb* ) 4.3 2.5 1.7
assign ( resid 86 and name Hb* ) ( resid 85 and name Hb* ) 4.3 2.5 1.7
assign ( resid 88 and name Hb* ) ( resid 85 and name ha ) 3 1.2 2
assign ( resid 72 and name Hd* ) ( resid 71 and name ha ) 2.2 0.4 0.8
assign ( resid 72 and name Hd* ) ( resid 71 and name ha ) 2.2 0.4 0.8
assign ( resid 57 and name Hd* ) ( resid 56 and name ha ) 3 1.2 2
assign ( resid 57 and name Hd* ) ( resid 56 and name ha ) 3 1.2 2
assign ( resid 57 and name Hd* ) ( resid 56 and name Hb* ) 3 1.2 2
assign ( resid 57 and name Hd* ) ( resid 56 and name Hb* ) 2.2 0.4 0.8
assign ( resid 57 and name Hd* ) ( resid 56 and name Hb* ) 2.2 0.4 0.8
assign ( resid 56 and name Hb* ) ( resid 57 and name Hd* ) 3 1.2 2
assign ( resid 56 and name Hb* ) ( resid 57 and name Hd* ) 3 1.2 2
assign ( resid 56 and name Hb* ) ( resid 57 and name Hd* ) 4.3 2.5 1.7
assign ( resid 56 and name Hb* ) ( resid 57 and name Hd* ) 3 1.2 2
assign ( resid 56 and name Hb* ) ( resid 52 and name hg21 ) 3 1.2 2
assign ( resid 57 and name ha ) ( resid 52 and name Hd# ) 4.3 2.5 1.7
assign ( resid 57 and name ha ) ( resid 52 and name hg21 ) 4.3 2.5 1.7
assign ( resid 58 and name Hb* ) ( resid 63 and name hg11 ) 2.2 0.4 0.8
assign ( resid 58 and name Hb* ) ( resid 63 and name hg12 ) 2.2 0.4 0.8
assign ( resid 59 and name hb ) ( resid 61 and name Hb* ) 2.2 0.4 0.8
assign ( resid 29 and name Hd# ) ( resid 33 and name He* ) 3 1.2 2
assign ( resid 29 and name Hd# ) ( resid 26 and name ha ) 2.2 0.4 0.8
assign ( resid 29 and name Hd# ) ( resid 25 and name He* ) 3 1.2 2
assign ( resid 29 and name Hd# ) ( resid 26 and name hg21 ) 2.2 0.4 0.8
assign ( resid 29 and name Hd# ) ( resid 33 and name Hd* ) 4.3 2.5 1.7
assign ( resid 34 and name Hb* ) ( resid 31 and name ha ) 4.3 2.5 1.7
assign ( resid 34 and name Hb* ) ( resid 31 and name ha ) 3 1.2 2
assign ( resid 72 and name Hd* ) ( resid 70 and name ha ) 3 1.2 2
assign ( resid 52 and name Hg# ) ( resid 49 and name ha ) 3 1.2 2
assign ( resid 32 and name Hb* ) ( resid 29 and name ha ) 3 1.2 2
assign ( resid 32 and name Hb* ) ( resid 29 and name ha ) 3 1.2 2
assign ( resid 72 and name Hg* ) ( resid 71 and name ha ) 4.3 2.5 1.7
assign ( resid 72 and name Hg* ) ( resid 71 and name ha ) 4.3 2.5 1.7
assign ( resid 28 and name Hd# ) ( resid 52 and name Hd# ) 3 1.2 2
assign ( resid 43 and name Hg# ) ( resid 80 and name He* ) 3 1.2 2
assign ( resid 58 and name He* ) ( resid 66 and name Hb* ) 3 1.2 2
set message off echo off end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1HT      MET   1 -36.534  -6.913 -11.443
    2    H2   MET   1           2HT      MET   1 -38.232  -6.947 -11.693
    3    H3   MET   1           3HT      MET   1 -37.174  -7.564 -12.895
    4    HA   MET   1           HA       MET   1 -38.204  -9.326 -11.700
    5    HB2  MET   1           2HB      MET   1 -35.739  -9.272 -12.504
    6    HB3  MET   1           1HB      MET   1 -35.338  -9.161 -10.796
    7    HG2  MET   1           2HG      MET   1 -35.184 -11.433 -11.336
    8    HG3  MET   1           1HG      MET   1 -36.711 -11.258 -10.472
    9    HE1  MET   1           2HE      MET   1 -39.199 -11.260 -11.885
   10    HE2  MET   1           3HE      MET   1 -38.458 -12.627 -11.054
   11    HE3  MET   1           1HE      MET   1 -39.171 -12.847 -12.652
   12    H    GLY   2           H        GLY   2 -38.695 -10.385  -9.767
   13    HA2  GLY   2           2HA      GLY   2 -39.200  -8.757  -7.524
   14    HA3  GLY   2           1HA      GLY   2 -39.320 -10.509  -7.562
   15    H    SER   3           H        SER   3 -38.055  -8.250  -5.768
   16    HA   SER   3           HA       SER   3 -36.335  -8.073  -4.298
   17    HB2  SER   3           2HB      SER   3 -35.992 -11.023  -4.903
   18    HB3  SER   3           1HB      SER   3 -35.245 -10.169  -3.554
   19    HG   SER   3           HG       SER   3 -37.908 -10.912  -3.945
   20    H    SER   4           H        SER   4 -35.676  -7.001  -6.616
   21    HA   SER   4           HA       SER   4 -33.257  -8.117  -7.719
   22    HB2  SER   4           2HB      SER   4 -34.995  -5.777  -8.300
   23    HB3  SER   4           1HB      SER   4 -33.304  -5.654  -8.786
   24    HG   SER   4           HG       SER   4 -34.433  -6.579 -10.465
   25    H    HIS   5           H        HIS   5 -34.094  -5.628  -5.380
   26    HA   HIS   5           HA       HIS   5 -31.451  -4.511  -5.256
   27    HB2  HIS   5           2HB      HIS   5 -33.973  -3.707  -4.409
   28    HB3  HIS   5           1HB      HIS   5 -33.119  -4.036  -2.907
   29    HD1  HIS   5           1HD      HIS   5 -32.091  -1.986  -2.013
   30    HD2  HIS   5           2HD      HIS   5 -32.073  -2.020  -6.168
   31    HE1  HIS   5           1HE      HIS   5 -30.996   0.171  -2.699
   32    HE2  HIS   5           2HE      HIS   5 -30.928   0.094  -5.216
   33    H    HIS   6           H        HIS   6 -30.533  -6.770  -5.038
   34    HA   HIS   6           HA       HIS   6 -29.471  -7.128  -2.465
   35    HB2  HIS   6           2HB      HIS   6 -31.658  -8.022  -1.870
   36    HB3  HIS   6           1HB      HIS   6 -31.608  -9.129  -3.238
   37    HD1  HIS   6           1HD      HIS   6 -29.386  -8.436  -0.213
   38    HD2  HIS   6           2HD      HIS   6 -30.885 -11.602  -2.449
   39    HE1  HIS   6           1HE      HIS   6 -28.516 -10.517   0.899
   40    HE2  HIS   6           2HE      HIS   6 -29.354 -12.415  -0.529
   41    H    HIS   7           H        HIS   7 -30.497  -9.262  -5.143
   42    HA   HIS   7           HA       HIS   7 -27.720 -10.197  -5.377
   43    HB2  HIS   7           2HB      HIS   7 -29.304 -11.986  -4.972
   44    HB3  HIS   7           1HB      HIS   7 -30.312 -11.447  -6.310
   45    HD1  HIS   7           1HD      HIS   7 -29.538 -12.049  -8.698
   46    HD2  HIS   7           2HD      HIS   7 -27.027 -13.455  -5.700
   47    HE1  HIS   7           1HE      HIS   7 -28.003 -13.692  -9.822
   48    HE2  HIS   7           2HE      HIS   7 -26.430 -14.456  -8.009
   49    H    HIS   8           H        HIS   8 -30.506  -9.199  -7.369
   50    HA   HIS   8           HA       HIS   8 -29.158  -9.202  -9.834
   51    HB2  HIS   8           2HB      HIS   8 -31.565  -9.175  -9.792
   52    HB3  HIS   8           1HB      HIS   8 -31.585  -7.655  -8.907
   53    HD1  HIS   8           1HD      HIS   8 -30.241  -8.871 -12.264
   54    HD2  HIS   8           2HD      HIS   8 -32.063  -5.560 -10.536
   55    HE1  HIS   8           1HE      HIS   8 -30.579  -7.232 -14.141
   56    HE2  HIS   8           2HE      HIS   8 -31.586  -5.197 -13.051
   57    H    HIS   9           H        HIS   9 -30.234  -6.246  -8.128
   58    HA   HIS   9           HA       HIS   9 -27.620  -5.047  -8.374
   59    HB2  HIS   9           2HB      HIS   9 -29.875  -4.308 -10.185
   60    HB3  HIS   9           1HB      HIS   9 -28.832  -3.021  -9.590
   61    HD1  HIS   9           1HD      HIS   9 -29.159  -4.697 -12.523
   62    HD2  HIS   9           2HD      HIS   9 -25.919  -4.324  -9.948
   63    HE1  HIS   9           1HE      HIS   9 -27.127  -5.171 -13.926
   64    HE2  HIS   9           2HE      HIS   9 -25.185  -5.017 -12.329
   65    H    HIS  10           H        HIS  10 -27.299  -3.926  -6.588
   66    HA   HIS  10           HA       HIS  10 -29.569  -3.041  -4.982
   67    HB2  HIS  10           2HB      HIS  10 -26.964  -4.027  -4.418
   68    HB3  HIS  10           1HB      HIS  10 -27.027  -2.378  -3.811
   69    HD1  HIS  10           1HD      HIS  10 -29.328  -1.945  -2.273
   70    HD2  HIS  10           2HD      HIS  10 -27.890  -5.824  -2.641
   71    HE1  HIS  10           1HE      HIS  10 -30.337  -3.219  -0.357
   72    HE2  HIS  10           2HE      HIS  10 -29.544  -5.590  -0.668
   73    H    SER  11           H        SER  11 -28.135  -0.865  -3.664
   74    HA   SER  11           HA       SER  11 -28.979   1.334  -5.074
   75    HB2  SER  11           2HB      SER  11 -27.316   2.649  -3.715
   76    HB3  SER  11           1HB      SER  11 -28.331   1.566  -2.764
   77    HG   SER  11           HG       SER  11 -25.605   1.467  -3.271
   78    H    SER  12           H        SER  12 -25.820  -0.253  -5.225
   79    HA   SER  12           HA       SER  12 -25.134   1.398  -7.568
   80    HB2  SER  12           2HB      SER  12 -23.368  -0.031  -5.568
   81    HB3  SER  12           1HB      SER  12 -22.763   0.640  -7.082
   82    HG   SER  12           HG       SER  12 -23.699   1.947  -4.796
   83    H    GLY  13           H        GLY  13 -24.623   0.395  -9.488
   84    HA2  GLY  13           2HA      GLY  13 -25.591  -2.264  -9.869
   85    HA3  GLY  13           1HA      GLY  13 -24.820  -1.257 -11.084
   86    H    LEU  14           H        LEU  14 -24.209  -3.448  -8.377
   87    HA   LEU  14           HA       LEU  14 -22.410  -4.717  -7.794
   88    HB2  LEU  14           2HB      LEU  14 -23.157  -5.305 -10.405
   89    HB3  LEU  14           1HB      LEU  14 -21.415  -5.138 -10.502
   90    HG   LEU  14           HG       LEU  14 -21.999  -7.456 -10.145
   91   HD11  LEU  14          1HD1      LEU  14 -20.622  -7.943  -8.250
   92   HD12  LEU  14          2HD1      LEU  14 -20.890  -6.334  -7.579
   93   HD13  LEU  14          3HD1      LEU  14 -19.960  -6.526  -9.066
   94   HD21  LEU  14          3HD2      LEU  14 -24.185  -6.992  -9.037
   95   HD22  LEU  14          1HD2      LEU  14 -23.297  -6.615  -7.560
   96   HD23  LEU  14          2HD2      LEU  14 -23.220  -8.238  -8.245
   97    H    VAL  15           H        VAL  15 -21.684  -2.294  -7.268
   98    HA   VAL  15           HA       VAL  15 -19.077  -1.840  -8.562
   99    HB   VAL  15           HB       VAL  15 -20.694   0.174  -6.994
  100   HG11  VAL  15          1HG1      VAL  15 -19.172   1.795  -8.108
  101   HG12  VAL  15          2HG1      VAL  15 -18.240   0.431  -8.726
  102   HG13  VAL  15          3HG1      VAL  15 -18.355   0.705  -6.987
  103   HG21  VAL  15          3HG2      VAL  15 -21.980  -0.301  -8.927
  104   HG22  VAL  15          1HG2      VAL  15 -20.549  -0.338  -9.958
  105   HG23  VAL  15          2HG2      VAL  15 -21.103   1.190  -9.271
  106    HA   PRO  16           HA       PRO  16 -17.791  -3.296  -4.416
  107    HB2  PRO  16           2HB      PRO  16 -15.267  -3.959  -5.195
  108    HB3  PRO  16           1HB      PRO  16 -16.656  -5.031  -5.401
  109    HG2  PRO  16           2HG      PRO  16 -15.337  -3.232  -7.395
  110    HG3  PRO  16           1HG      PRO  16 -15.933  -4.889  -7.604
  111    HD2  PRO  16           2HD      PRO  16 -17.322  -2.727  -8.449
  112    HD3  PRO  16           1HD      PRO  16 -18.117  -4.205  -7.872
  113    H    ARG  17           H        ARG  17 -16.108  -1.134  -6.657
  114    HA   ARG  17           HA       ARG  17 -14.320  -0.003  -4.772
  115    HB2  ARG  17           2HB      ARG  17 -14.041   1.798  -6.468
  116    HB3  ARG  17           1HB      ARG  17 -13.848   0.181  -7.130
  117    HG2  ARG  17           2HG      ARG  17 -15.872   0.273  -8.274
  118    HG3  ARG  17           1HG      ARG  17 -16.480   1.600  -7.283
  119    HD2  ARG  17           2HD      ARG  17 -14.978   3.148  -8.316
  120    HD3  ARG  17           1HD      ARG  17 -14.137   1.849  -9.159
  121    HE   ARG  17           HE       ARG  17 -15.774   1.863 -10.756
  122   HH11  ARG  17          1HH1      ARG  17 -16.932   3.643  -7.969
  123   HH12  ARG  17          2HH1      ARG  17 -18.354   4.215  -8.773
  124   HH21  ARG  17          1HH2      ARG  17 -17.650   2.620 -11.807
  125   HH22  ARG  17          2HH2      ARG  17 -18.763   3.634 -10.951
  126    H    GLY  18           H        GLY  18 -14.379   2.460  -4.340
  127    HA2  GLY  18           2HA      GLY  18 -15.583   4.386  -3.706
  128    HA3  GLY  18           1HA      GLY  18 -17.080   3.479  -3.869
  129    H    SER  19           H        SER  19 -17.185   1.545  -2.261
  130    HA   SER  19           HA       SER  19 -16.489   2.602   0.395
  131    HB2  SER  19           2HB      SER  19 -18.677   0.695  -0.468
  132    HB3  SER  19           1HB      SER  19 -18.317   1.085   1.214
  133    HG   SER  19           HG       SER  19 -19.035   3.110   0.918
  134    H    HIS  20           H        HIS  20 -14.642   1.112  -1.306
  135    HA   HIS  20           HA       HIS  20 -14.418  -1.498  -0.024
  136    HB2  HIS  20           2HB      HIS  20 -13.846  -0.589  -2.579
  137    HB3  HIS  20           1HB      HIS  20 -12.255  -0.719  -1.839
  138    HD1  HIS  20           1HD      HIS  20 -15.327  -2.981  -1.740
  139    HD2  HIS  20           2HD      HIS  20 -11.247  -3.124  -2.514
  140    HE1  HIS  20           1HE      HIS  20 -14.823  -5.392  -2.241
  141    HE2  HIS  20           2HE      HIS  20 -12.333  -5.469  -2.618
  142    H    MET  21           H        MET  21 -11.585  -1.741  -0.093
  143    HA   MET  21           HA       MET  21 -10.940  -0.436   2.386
  144    HB2  MET  21           2HB      MET  21  -9.788  -2.582   0.726
  145    HB3  MET  21           1HB      MET  21  -8.606  -1.615   1.598
  146    HG2  MET  21           2HG      MET  21  -9.098  -3.417   3.003
  147    HG3  MET  21           1HG      MET  21  -9.980  -2.047   3.674
  148    HE1  MET  21           3HE      MET  21 -12.073  -1.736   3.980
  149    HE2  MET  21           1HE      MET  21 -13.270  -3.022   4.133
  150    HE3  MET  21           2HE      MET  21 -13.195  -2.058   2.659
  151    H    SER  22           H        SER  22 -11.140   1.761   1.504
  152    HA   SER  22           HA       SER  22  -8.863   2.628  -0.101
  153    HB2  SER  22           2HB      SER  22 -11.357   4.144   0.686
  154    HB3  SER  22           1HB      SER  22 -10.087   4.753  -0.374
  155    HG   SER  22           HG       SER  22 -10.787   3.512  -1.953
  156    H    ASP  23           H        ASP  23  -9.304   2.109   2.995
  157    HA   ASP  23           HA       ASP  23  -8.150   4.580   3.988
  158    HB2  ASP  23           2HB      ASP  23  -9.098   2.148   5.472
  159    HB3  ASP  23           1HB      ASP  23  -8.515   3.628   6.230
  160    H    GLU  24           H        GLU  24  -7.194   1.565   3.012
  161    HA   GLU  24           HA       GLU  24  -4.971   1.102   4.646
  162    HB2  GLU  24           2HB      GLU  24  -5.620   0.193   1.864
  163    HB3  GLU  24           1HB      GLU  24  -4.127  -0.278   2.665
  164    HG2  GLU  24           2HG      GLU  24  -5.529  -1.211   4.522
  165    HG3  GLU  24           1HG      GLU  24  -6.940  -0.922   3.504
  166    H    LYS  25           H        LYS  25  -5.501   3.324   2.233
  167    HA   LYS  25           HA       LYS  25  -2.694   3.871   1.711
  168    HB2  LYS  25           2HB      LYS  25  -5.034   4.213   0.215
  169    HB3  LYS  25           1HB      LYS  25  -4.554   5.844   0.662
  170    HG2  LYS  25           2HG      LYS  25  -2.454   4.041  -0.402
  171    HG3  LYS  25           1HG      LYS  25  -3.667   4.649  -1.529
  172    HD2  LYS  25           2HD      LYS  25  -1.998   6.258  -1.657
  173    HD3  LYS  25           1HD      LYS  25  -3.125   6.960  -0.495
  174    HE2  LYS  25           2HE      LYS  25  -1.578   6.971   1.106
  175    HE3  LYS  25           1HE      LYS  25  -1.194   5.274   0.829
  176    HZ1  LYS  25           3HZ      LYS  25  -0.028   7.644  -0.510
  177    HZ2  LYS  25           1HZ      LYS  25   0.171   6.074  -1.109
  178    HZ3  LYS  25           2HZ      LYS  25   0.767   6.478   0.421
  179    H    THR  26           H        THR  26  -5.522   5.359   3.261
  180    HA   THR  26           HA       THR  26  -4.198   7.732   4.047
  181    HB   THR  26           HB       THR  26  -6.164   7.658   5.846
  182    HG1  THR  26           1HG      THR  26  -7.102   5.765   5.517
  183   HG21  THR  26          3HG2      THR  26  -7.278   8.061   3.177
  184   HG22  THR  26          1HG2      THR  26  -5.784   8.952   3.487
  185   HG23  THR  26          2HG2      THR  26  -7.179   9.161   4.552
  186    H    GLN  27           H        GLN  27  -4.394   4.547   5.437
  187    HA   GLN  27           HA       GLN  27  -3.481   5.258   8.044
  188    HB2  GLN  27           2HB      GLN  27  -3.530   2.672   6.491
  189    HB3  GLN  27           1HB      GLN  27  -2.799   2.774   8.086
  190    HG2  GLN  27           2HG      GLN  27  -4.814   3.102   9.142
  191    HG3  GLN  27           1HG      GLN  27  -5.588   3.745   7.695
  192   HE21  GLN  27          1HE2      GLN  27  -4.074   0.749   8.867
  193   HE22  GLN  27          2HE2      GLN  27  -5.223  -0.315   8.137
  194    H    LEU  28           H        LEU  28  -1.984   4.557   4.969
  195    HA   LEU  28           HA       LEU  28   0.690   4.472   6.023
  196    HB2  LEU  28           2HB      LEU  28  -0.270   3.199   3.986
  197    HB3  LEU  28           1HB      LEU  28  -0.002   4.711   3.139
  198    HG   LEU  28           HG       LEU  28   2.373   3.943   4.587
  199   HD11  LEU  28          1HD1      LEU  28   0.930   1.780   3.312
  200   HD12  LEU  28          2HD1      LEU  28   2.366   1.736   4.334
  201   HD13  LEU  28          3HD1      LEU  28   2.526   2.023   2.602
  202   HD21  LEU  28          3HD2      LEU  28   3.170   3.922   2.089
  203   HD22  LEU  28          1HD2      LEU  28   2.736   5.433   2.886
  204   HD23  LEU  28          2HD2      LEU  28   1.589   4.648   1.802
  205    H    ILE  29           H        ILE  29  -1.417   6.841   5.197
  206    HA   ILE  29           HA       ILE  29   0.015   8.795   3.916
  207    HB   ILE  29           HB       ILE  29  -2.156   9.007   5.942
  208   HG12  ILE  29          2HG1      ILE  29  -2.517   8.112   3.568
  209   HG13  ILE  29          1HG1      ILE  29  -3.615   9.360   4.144
  210   HG21  ILE  29          1HG2      ILE  29  -0.727  11.255   4.564
  211   HG22  ILE  29          2HG2      ILE  29  -1.119  11.071   6.274
  212   HG23  ILE  29          3HG2      ILE  29  -2.396  11.419   5.110
  213   HD11  ILE  29          3HD1      ILE  29  -3.178  10.151   2.074
  214   HD12  ILE  29          1HD1      ILE  29  -1.549   9.473   2.030
  215   HD13  ILE  29          2HD1      ILE  29  -1.867  10.938   2.958
  216    H    GLU  30           H        GLU  30   0.465   7.636   6.933
  217    HA   GLU  30           HA       GLU  30   1.686   9.832   8.193
  218    HB2  GLU  30           2HB      GLU  30   1.869   6.894   8.803
  219    HB3  GLU  30           1HB      GLU  30   2.585   8.138   9.817
  220    HG2  GLU  30           2HG      GLU  30   0.470   9.021  10.391
  221    HG3  GLU  30           1HG      GLU  30  -0.341   8.072   9.148
  222    H    ALA  31           H        ALA  31   2.724   8.349   5.589
  223    HA   ALA  31           HA       ALA  31   5.507   7.992   6.122
  224    HB1  ALA  31           1HB      ALA  31   4.715   6.741   4.301
  225    HB2  ALA  31           2HB      ALA  31   5.645   8.043   3.559
  226    HB3  ALA  31           3HB      ALA  31   3.884   8.127   3.595
  227    H    PHE  32           H        PHE  32   3.510  10.585   4.760
  228    HA   PHE  32           HA       PHE  32   5.627  12.310   4.040
  229    HB2  PHE  32           2HB      PHE  32   2.820  13.057   4.896
  230    HB3  PHE  32           1HB      PHE  32   3.939  14.084   4.005
  231    HD1  PHE  32           2HD      PHE  32   4.823  13.023   1.745
  232    HD2  PHE  32           1HD      PHE  32   1.228  11.903   3.728
  233    HE1  PHE  32           2HE      PHE  32   3.934  12.139  -0.372
  234    HE2  PHE  32           1HE      PHE  32   0.333  11.017   1.616
  235    HZ   PHE  32           HZ       PHE  32   1.686  11.134  -0.438
  236    H    TYR  33           H        TYR  33   4.046  11.624   7.082
  237    HA   TYR  33           HA       TYR  33   5.732  13.643   8.411
  238    HB2  TYR  33           2HB      TYR  33   3.490  12.567   9.982
  239    HB3  TYR  33           1HB      TYR  33   4.022  14.230   9.773
  240    HD1  TYR  33           2HD      TYR  33   3.358  15.416   7.593
  241    HD2  TYR  33           1HD      TYR  33   1.560  11.793   8.914
  242    HE1  TYR  33           2HE      TYR  33   1.431  15.844   6.128
  243    HE2  TYR  33           1HE      TYR  33  -0.370  12.211   7.453
  244    HH   TYR  33           HH       TYR  33  -0.523  13.864   5.032
  245    H    ASN  34           H        ASN  34   7.429  12.077   8.338
  246    HA   ASN  34           HA       ASN  34   8.649  11.031  10.215
  247    HB2  ASN  34           2HB      ASN  34   6.634  10.252  11.401
  248    HB3  ASN  34           1HB      ASN  34   6.341   9.071  10.130
  249   HD21  ASN  34          1HD2      ASN  34   7.248   7.125  10.306
  250   HD22  ASN  34          2HD2      ASN  34   8.438   6.686  11.476
  251    H    PHE  35           H        PHE  35   8.290  10.956   7.200
  252    HA   PHE  35           HA       PHE  35  10.359   9.173   6.610
  253    HB2  PHE  35           2HB      PHE  35   8.578   7.475   7.021
  254    HB3  PHE  35           1HB      PHE  35   7.643   8.180   5.709
  255    HD1  PHE  35           1HD      PHE  35  11.296   7.496   5.883
  256    HD2  PHE  35           2HD      PHE  35   7.558   6.517   4.099
  257    HE1  PHE  35           1HE      PHE  35  12.450   6.040   4.271
  258    HE2  PHE  35           2HE      PHE  35   8.706   5.058   2.486
  259    HZ   PHE  35           HZ       PHE  35  11.155   4.819   2.571
  260    H    ASP  36           H        ASP  36   9.731  11.857   6.032
  261    HA   ASP  36           HA       ASP  36  10.120  11.858   3.184
  262    HB2  ASP  36           2HB      ASP  36   7.495  12.505   4.339
  263    HB3  ASP  36           1HB      ASP  36   8.118  13.739   3.249
  264    H    GLY  37           H        GLY  37  11.836  12.619   5.187
  265    HA2  GLY  37           2HA      GLY  37  11.694  15.512   5.493
  266    HA3  GLY  37           1HA      GLY  37  12.907  14.446   6.187
  267    H    ASP  38           H        ASP  38  14.309  13.330   4.442
  268    HA   ASP  38           HA       ASP  38  14.791  14.964   2.094
  269    HB2  ASP  38           2HB      ASP  38  16.101  15.860   4.190
  270    HB3  ASP  38           1HB      ASP  38  17.163  14.492   3.868
  271    H    TYR  39           H        TYR  39  13.905  12.721   1.532
  272    HA   TYR  39           HA       TYR  39  16.189  10.936   1.024
  273    HB2  TYR  39           2HB      TYR  39  14.053  10.338   2.709
  274    HB3  TYR  39           1HB      TYR  39  13.651   9.520   1.204
  275    HD1  TYR  39           1HD      TYR  39  16.855  10.082   3.062
  276    HD2  TYR  39           2HD      TYR  39  14.163   7.277   1.331
  277    HE1  TYR  39           1HE      TYR  39  18.387   8.252   3.657
  278    HE2  TYR  39           2HE      TYR  39  15.688   5.443   1.922
  279    HH   TYR  39           HH       TYR  39  18.561   5.519   2.412
  280    H    ASP  40           H        ASP  40  16.304  10.024  -0.982
  281    HA   ASP  40           HA       ASP  40  14.668  11.215  -3.043
  282    HB2  ASP  40           2HB      ASP  40  17.284  10.339  -2.925
  283    HB3  ASP  40           1HB      ASP  40  16.501   9.083  -3.877
  284    H    GLY  41           H        GLY  41  14.624   9.101  -4.942
  285    HA2  GLY  41           2HA      GLY  41  12.314   7.647  -3.955
  286    HA3  GLY  41           1HA      GLY  41  12.907   7.671  -5.608
  287    H    PHE  42           H        PHE  42  14.630   6.800  -2.614
  288    HA   PHE  42           HA       PHE  42  14.572   3.991  -3.263
  289    HB2  PHE  42           2HB      PHE  42  16.575   5.398  -4.460
  290    HB3  PHE  42           1HB      PHE  42  17.350   4.935  -2.949
  291    HD1  PHE  42           2HD      PHE  42  17.143   2.418  -2.299
  292    HD2  PHE  42           1HD      PHE  42  16.594   3.933  -6.238
  293    HE1  PHE  42           2HE      PHE  42  17.600   0.182  -3.218
  294    HE2  PHE  42           1HE      PHE  42  17.049   1.700  -7.164
  295    HZ   PHE  42           HZ       PHE  42  17.554  -0.179  -5.654
  296    H    VAL  43           H        VAL  43  14.418   2.910  -1.418
  297    HA   VAL  43           HA       VAL  43  15.884   3.822   0.942
  298    HB   VAL  43           HB       VAL  43  13.696   4.850   1.218
  299   HG11  VAL  43          1HG1      VAL  43  12.465   3.250  -0.245
  300   HG12  VAL  43          2HG1      VAL  43  11.645   3.620   1.271
  301   HG13  VAL  43          3HG1      VAL  43  12.498   2.089   1.082
  302   HG21  VAL  43          3HG2      VAL  43  14.836   4.000   3.211
  303   HG22  VAL  43          1HG2      VAL  43  14.012   2.450   3.026
  304   HG23  VAL  43          2HG2      VAL  43  13.083   3.907   3.383
  305    H    SER  44           H        SER  44  16.824   2.162   1.973
  306    HA   SER  44           HA       SER  44  16.527  -0.491   0.991
  307    HB2  SER  44           2HB      SER  44  18.305  -1.071   2.394
  308    HB3  SER  44           1HB      SER  44  18.608   0.633   2.064
  309    HG   SER  44           HG       SER  44  17.628   1.112   4.076
  310    H    VAL  45           H        VAL  45  15.790  -2.348   2.078
  311    HA   VAL  45           HA       VAL  45  13.327  -2.153   3.377
  312    HB   VAL  45           HB       VAL  45  15.237  -4.485   3.585
  313   HG11  VAL  45          1HG1      VAL  45  13.513  -5.762   4.288
  314   HG12  VAL  45          2HG1      VAL  45  12.298  -4.802   3.452
  315   HG13  VAL  45          3HG1      VAL  45  12.998  -4.220   4.962
  316   HG21  VAL  45          3HG2      VAL  45  14.581  -5.290   1.540
  317   HG22  VAL  45          1HG2      VAL  45  14.623  -3.557   1.225
  318   HG23  VAL  45          2HG2      VAL  45  13.084  -4.358   1.532
  319    H    GLU  46           H        GLU  46  16.581  -2.652   4.665
  320    HA   GLU  46           HA       GLU  46  16.019  -3.166   7.319
  321    HB2  GLU  46           2HB      GLU  46  18.317  -1.434   6.420
  322    HB3  GLU  46           1HB      GLU  46  18.251  -2.499   7.817
  323    HG2  GLU  46           2HG      GLU  46  18.908  -4.264   6.633
  324    HG3  GLU  46           1HG      GLU  46  17.782  -3.914   5.321
  325    H    GLU  47           H        GLU  47  16.520   0.019   5.792
  326    HA   GLU  47           HA       GLU  47  15.954   1.504   8.155
  327    HB2  GLU  47           2HB      GLU  47  16.274   2.151   5.256
  328    HB3  GLU  47           1HB      GLU  47  15.499   3.341   6.292
  329    HG2  GLU  47           2HG      GLU  47  17.675   4.018   6.411
  330    HG3  GLU  47           1HG      GLU  47  17.585   2.953   7.813
  331    H    PHE  48           H        PHE  48  14.049   0.499   5.356
  332    HA   PHE  48           HA       PHE  48  11.692   1.887   5.832
  333    HB2  PHE  48           2HB      PHE  48  12.560  -0.030   4.024
  334    HB3  PHE  48           1HB      PHE  48  11.237  -0.831   4.862
  335    HD1  PHE  48           1HD      PHE  48   9.678   1.814   5.370
  336    HD2  PHE  48           2HD      PHE  48  11.460   0.070   1.920
  337    HE1  PHE  48           1HE      PHE  48   8.066   3.002   3.942
  338    HE2  PHE  48           2HE      PHE  48   9.851   1.259   0.486
  339    HZ   PHE  48           HZ       PHE  48   8.153   2.727   1.496
  340    H    ARG  49           H        ARG  49  12.740  -1.261   7.104
  341    HA   ARG  49           HA       ARG  49  10.420  -2.061   8.386
  342    HB2  ARG  49           2HB      ARG  49  13.318  -2.486   9.107
  343    HB3  ARG  49           1HB      ARG  49  12.006  -3.246   9.994
  344    HG2  ARG  49           2HG      ARG  49  11.516  -4.692   8.314
  345    HG3  ARG  49           1HG      ARG  49  12.030  -3.573   7.050
  346    HD2  ARG  49           2HD      ARG  49  14.354  -3.992   7.579
  347    HD3  ARG  49           1HD      ARG  49  13.889  -5.029   8.927
  348    HE   ARG  49           HE       ARG  49  12.692  -6.214   6.819
  349   HH11  ARG  49          1HH1      ARG  49  15.985  -5.158   7.376
  350   HH12  ARG  49          2HH1      ARG  49  16.676  -6.373   6.356
  351   HH21  ARG  49          1HH2      ARG  49  13.610  -7.813   5.479
  352   HH22  ARG  49          2HH2      ARG  49  15.329  -7.881   5.280
  353    H    GLY  50           H        GLY  50  13.104  -0.153   9.783
  354    HA2  GLY  50           2HA      GLY  50  11.989   0.234  12.319
  355    HA3  GLY  50           1HA      GLY  50  13.171   1.291  11.563
  356    H    ILE  51           H        ILE  51  11.658   2.195   9.378
  357    HA   ILE  51           HA       ILE  51  10.176   4.290  10.587
  358    HB   ILE  51           HB       ILE  51  10.146   3.456   7.681
  359   HG12  ILE  51          2HG1      ILE  51  11.809   5.729   8.625
  360   HG13  ILE  51          1HG1      ILE  51  12.392   4.115   9.011
  361   HG21  ILE  51          1HG2      ILE  51   8.429   4.964   7.813
  362   HG22  ILE  51          2HG2      ILE  51   9.785   6.057   7.539
  363   HG23  ILE  51          3HG2      ILE  51   9.149   5.835   9.168
  364   HD11  ILE  51          3HD1      ILE  51  13.315   4.085   7.001
  365   HD12  ILE  51          1HD1      ILE  51  12.464   5.552   6.519
  366   HD13  ILE  51          2HD1      ILE  51  11.687   3.980   6.330
  367    H    ILE  52           H        ILE  52   9.199   1.439   8.706
  368    HA   ILE  52           HA       ILE  52   6.428   1.917   8.719
  369    HB   ILE  52           HB       ILE  52   7.921  -0.701   8.528
  370   HG12  ILE  52          2HG1      ILE  52   8.227   1.227   6.783
  371   HG13  ILE  52          1HG1      ILE  52   7.980  -0.424   6.226
  372   HG21  ILE  52          1HG2      ILE  52   5.668  -1.171   9.176
  373   HG22  ILE  52          2HG2      ILE  52   5.843  -1.554   7.465
  374   HG23  ILE  52          3HG2      ILE  52   5.032  -0.068   7.958
  375   HD11  ILE  52          3HD1      ILE  52   5.851   0.010   5.477
  376   HD12  ILE  52          1HD1      ILE  52   6.678   1.529   5.132
  377   HD13  ILE  52          2HD1      ILE  52   5.639   1.393   6.551
  378    H    ARG  53           H        ARG  53   8.517   0.244  11.026
  379    HA   ARG  53           HA       ARG  53   6.748  -1.155  12.566
  380    HB2  ARG  53           2HB      ARG  53   9.306   0.242  13.130
  381    HB3  ARG  53           1HB      ARG  53   8.355  -0.272  14.517
  382    HG2  ARG  53           2HG      ARG  53   8.649  -2.493  14.076
  383    HG3  ARG  53           1HG      ARG  53   8.858  -2.235  12.342
  384    HD2  ARG  53           2HD      ARG  53  11.079  -1.672  12.557
  385    HD3  ARG  53           1HD      ARG  53  10.891  -1.135  14.225
  386    HE   ARG  53           HE       ARG  53  11.318  -3.269  14.926
  387   HH11  ARG  53          1HH1      ARG  53  10.567  -3.363  11.506
  388   HH12  ARG  53          2HH1      ARG  53  11.012  -5.026  11.330
  389   HH21  ARG  53          1HH2      ARG  53  11.901  -5.460  14.686
  390   HH22  ARG  53          2HH2      ARG  53  11.768  -6.217  13.134
  391    H    ASP  54           H        ASP  54   7.713   2.221  13.284
  392    HA   ASP  54           HA       ASP  54   5.190   2.512  14.782
  393    HB2  ASP  54           2HB      ASP  54   7.770   4.060  15.093
  394    HB3  ASP  54           1HB      ASP  54   6.312   4.292  16.053
  395    H    GLY  55           H        GLY  55   5.984   3.049  11.799
  396    HA2  GLY  55           2HA      GLY  55   5.076   5.853  11.704
  397    HA3  GLY  55           1HA      GLY  55   6.019   5.062  10.452
  398    H    LEU  56           H        LEU  56   4.915   3.133   9.416
  399    HA   LEU  56           HA       LEU  56   2.127   3.880   8.871
  400    HB2  LEU  56           2HB      LEU  56   3.709   2.017   7.145
  401    HB3  LEU  56           1HB      LEU  56   2.367   3.057   6.710
  402    HG   LEU  56           HG       LEU  56   5.133   4.055   7.400
  403   HD11  LEU  56          1HD1      LEU  56   4.366   4.472   4.674
  404   HD12  LEU  56          2HD1      LEU  56   4.278   2.754   5.063
  405   HD13  LEU  56          3HD1      LEU  56   5.780   3.641   5.323
  406   HD21  LEU  56          3HD2      LEU  56   3.839   5.952   5.891
  407   HD22  LEU  56          1HD2      LEU  56   4.042   5.988   7.642
  408   HD23  LEU  56          2HD2      LEU  56   2.560   5.341   6.939
  409    HA   PRO  57           HA       PRO  57   1.054   0.128  11.112
  410    HB2  PRO  57           2HB      PRO  57  -1.640   0.374  10.755
  411    HB3  PRO  57           1HB      PRO  57  -0.739   1.268  11.984
  412    HG2  PRO  57           2HG      PRO  57  -1.659   2.164   9.282
  413    HG3  PRO  57           1HG      PRO  57  -1.702   3.037  10.824
  414    HD2  PRO  57           2HD      PRO  57   0.191   3.504   8.960
  415    HD3  PRO  57           1HD      PRO  57   0.527   3.624  10.698
  416    H    MET  58           H        MET  58   1.878  -1.414   9.756
  417    HA   MET  58           HA       MET  58  -0.019  -2.516   7.814
  418    HB2  MET  58           2HB      MET  58   2.421  -1.230   7.132
  419    HB3  MET  58           1HB      MET  58   2.648  -2.951   6.862
  420    HG2  MET  58           2HG      MET  58   0.896  -3.046   5.301
  421    HG3  MET  58           1HG      MET  58   0.276  -1.468   5.781
  422    HE1  MET  58           3HE      MET  58   3.266  -3.382   4.290
  423    HE2  MET  58           1HE      MET  58   3.698  -2.390   2.898
  424    HE3  MET  58           2HE      MET  58   2.137  -3.208   2.948
  425    H    THR  59           H        THR  59   0.008  -4.730   7.629
  426    HA   THR  59           HA       THR  59   1.270  -6.169   9.814
  427    HB   THR  59           HB       THR  59  -0.073  -7.967   8.063
  428    HG1  THR  59           1HG      THR  59  -1.702  -5.734   8.688
  429   HG21  THR  59          3HG2      THR  59   0.004  -8.221  10.477
  430   HG22  THR  59          1HG2      THR  59  -1.657  -8.229   9.884
  431   HG23  THR  59          2HG2      THR  59  -1.007  -6.788  10.667
  432    H    GLU  60           H        GLU  60   2.568  -8.081   9.493
  433    HA   GLU  60           HA       GLU  60   4.751  -7.830   7.864
  434    HB2  GLU  60           2HB      GLU  60   4.902 -10.405   8.023
  435    HB3  GLU  60           1HB      GLU  60   4.965  -9.470   9.508
  436    HG2  GLU  60           2HG      GLU  60   2.542  -9.939   9.824
  437    HG3  GLU  60           1HG      GLU  60   2.609 -10.991   8.411
  438    H    ALA  61           H        ALA  61   1.910  -9.821   7.131
  439    HA   ALA  61           HA       ALA  61   2.596 -10.817   4.675
  440    HB1  ALA  61           1HB      ALA  61   0.167 -10.954   4.240
  441    HB2  ALA  61           2HB      ALA  61  -0.103  -9.958   5.671
  442    HB3  ALA  61           3HB      ALA  61   0.639 -11.549   5.832
  443    H    GLU  62           H        GLU  62   1.857  -7.518   5.435
  444    HA   GLU  62           HA       GLU  62   1.407  -6.852   2.622
  445    HB2  GLU  62           2HB      GLU  62   1.551  -4.632   4.548
  446    HB3  GLU  62           1HB      GLU  62   0.361  -4.961   3.300
  447    HG2  GLU  62           2HG      GLU  62   0.447  -6.426   5.917
  448    HG3  GLU  62           1HG      GLU  62  -0.476  -4.949   5.665
  449    H    ILE  63           H        ILE  63   3.541  -5.953   5.328
  450    HA   ILE  63           HA       ILE  63   5.334  -4.424   3.705
  451    HB   ILE  63           HB       ILE  63   6.247  -5.673   6.266
  452   HG12  ILE  63          2HG1      ILE  63   5.115  -3.214   6.972
  453   HG13  ILE  63          1HG1      ILE  63   3.887  -4.020   5.997
  454   HG21  ILE  63          1HG2      ILE  63   7.618  -4.148   4.708
  455   HG22  ILE  63          2HG2      ILE  63   7.632  -3.817   6.441
  456   HG23  ILE  63          3HG2      ILE  63   6.632  -2.840   5.365
  457   HD11  ILE  63          3HD1      ILE  63   3.374  -4.842   8.044
  458   HD12  ILE  63          1HD1      ILE  63   5.042  -4.792   8.612
  459   HD13  ILE  63          2HD1      ILE  63   4.521  -6.067   7.506
  460    H    THR  64           H        THR  64   5.464  -7.712   5.054
  461    HA   THR  64           HA       THR  64   8.047  -8.322   4.029
  462    HB   THR  64           HB       THR  64   5.778 -10.007   5.035
  463    HG1  THR  64           1HG      THR  64   6.771  -9.079   6.713
  464   HG21  THR  64          3HG2      THR  64   8.476 -10.968   4.147
  465   HG22  THR  64          1HG2      THR  64   6.902 -11.445   3.509
  466   HG23  THR  64          2HG2      THR  64   7.362 -11.897   5.151
  467    H    GLU  65           H        GLU  65   4.741  -9.031   2.922
  468    HA   GLU  65           HA       GLU  65   5.555 -10.487   0.646
  469    HB2  GLU  65           2HB      GLU  65   3.233 -10.455   1.690
  470    HB3  GLU  65           1HB      GLU  65   2.992  -8.941   0.827
  471    HG2  GLU  65           2HG      GLU  65   3.096  -9.989  -1.264
  472    HG3  GLU  65           1HG      GLU  65   3.804 -11.456  -0.588
  473    H    PHE  66           H        PHE  66   5.571  -7.251   1.374
  474    HA   PHE  66           HA       PHE  66   5.760  -6.412  -1.396
  475    HB2  PHE  66           2HB      PHE  66   5.378  -4.926   1.180
  476    HB3  PHE  66           1HB      PHE  66   6.011  -4.081  -0.225
  477    HD1  PHE  66           2HD      PHE  66   3.745  -6.715  -1.083
  478    HD2  PHE  66           1HD      PHE  66   3.954  -2.650   0.164
  479    HE1  PHE  66           2HE      PHE  66   1.452  -6.352  -1.892
  480    HE2  PHE  66           1HE      PHE  66   1.660  -2.283  -0.642
  481    HZ   PHE  66           HZ       PHE  66   0.406  -4.134  -1.672
  482    H    PHE  67           H        PHE  67   7.661  -6.822   1.515
  483    HA   PHE  67           HA       PHE  67   9.964  -5.376   0.751
  484    HB2  PHE  67           2HB      PHE  67   9.366  -7.529   2.735
  485    HB3  PHE  67           1HB      PHE  67  11.051  -7.187   2.365
  486    HD1  PHE  67           2HD      PHE  67   9.655  -4.134   1.873
  487    HD2  PHE  67           1HD      PHE  67  10.392  -6.855   5.058
  488    HE1  PHE  67           2HE      PHE  67   9.650  -2.263   3.462
  489    HE2  PHE  67           1HE      PHE  67  10.376  -4.986   6.658
  490    HZ   PHE  67           HZ       PHE  67  10.010  -2.686   5.860
  491    H    GLU  68           H        GLU  68   8.904  -8.667   0.078
  492    HA   GLU  68           HA       GLU  68  11.399  -9.324  -1.263
  493    HB2  GLU  68           2HB      GLU  68   8.875 -10.978  -1.174
  494    HB3  GLU  68           1HB      GLU  68  10.502 -11.529  -1.543
  495    HG2  GLU  68           2HG      GLU  68   9.412 -10.651   1.114
  496    HG3  GLU  68           1HG      GLU  68   9.976 -12.254   0.649
  497    H    ALA  69           H        ALA  69   8.061  -8.517  -2.072
  498    HA   ALA  69           HA       ALA  69   8.321  -9.069  -4.846
  499    HB1  ALA  69           1HB      ALA  69   6.271  -7.363  -3.477
  500    HB2  ALA  69           2HB      ALA  69   6.157  -9.112  -3.674
  501    HB3  ALA  69           3HB      ALA  69   6.141  -8.062  -5.091
  502    H    ALA  70           H        ALA  70   9.350  -6.565  -2.951
  503    HA   ALA  70           HA       ALA  70   9.393  -4.582  -5.094
  504    HB1  ALA  70           1HB      ALA  70   8.716  -3.733  -2.956
  505    HB2  ALA  70           2HB      ALA  70  10.300  -3.063  -3.345
  506    HB3  ALA  70           3HB      ALA  70  10.162  -4.385  -2.186
  507    H    ASP  71           H        ASP  71  11.593  -6.520  -3.113
  508    HA   ASP  71           HA       ASP  71  13.851  -5.573  -4.744
  509    HB2  ASP  71           2HB      ASP  71  13.909  -5.344  -2.205
  510    HB3  ASP  71           1HB      ASP  71  14.042  -7.096  -2.146
  511    HA   PRO  72           HA       PRO  72  13.348  -9.641  -6.692
  512    HB2  PRO  72           2HB      PRO  72  15.366  -9.224  -8.514
  513    HB3  PRO  72           1HB      PRO  72  13.696  -8.697  -8.742
  514    HG2  PRO  72           2HG      PRO  72  16.066  -7.132  -7.804
  515    HG3  PRO  72           1HG      PRO  72  14.777  -6.652  -8.923
  516    HD2  PRO  72           2HD      PRO  72  14.800  -5.833  -6.366
  517    HD3  PRO  72           1HD      PRO  72  13.283  -6.207  -7.210
  518    H    ASN  73           H        ASN  73  16.448  -8.168  -5.770
  519    HA   ASN  73           HA       ASN  73  17.862 -10.658  -5.681
  520    HB2  ASN  73           2HB      ASN  73  18.597  -7.963  -4.522
  521    HB3  ASN  73           1HB      ASN  73  19.685  -9.338  -4.683
  522   HD21  ASN  73          1HD2      ASN  73  18.106  -6.731  -6.293
  523   HD22  ASN  73          2HD2      ASN  73  18.898  -6.912  -7.818
  524    H    ASN  74           H        ASN  74  16.136  -8.678  -3.357
  525    HA   ASN  74           HA       ASN  74  15.399  -9.075  -1.253
  526    HB2  ASN  74           2HB      ASN  74  16.508 -11.874  -1.556
  527    HB3  ASN  74           1HB      ASN  74  15.353 -11.322  -0.348
  528   HD21  ASN  74          1HD2      ASN  74  13.299 -10.402  -1.246
  529   HD22  ASN  74          2HD2      ASN  74  12.615 -11.197  -2.620
  530    H    THR  75           H        THR  75  18.143  -8.216  -1.992
  531    HA   THR  75           HA       THR  75  19.971  -9.190  -0.068
  532    HB   THR  75           HB       THR  75  20.865  -8.159  -2.014
  533    HG1  THR  75           1HG      THR  75  22.343  -7.428  -0.739
  534   HG21  THR  75          3HG2      THR  75  19.105  -5.838  -1.354
  535   HG22  THR  75          1HG2      THR  75  19.270  -6.721  -2.874
  536   HG23  THR  75          2HG2      THR  75  20.557  -5.637  -2.336
  537    H    GLY  76           H        GLY  76  17.320  -7.057   0.144
  538    HA2  GLY  76           2HA      GLY  76  16.528  -6.502   2.364
  539    HA3  GLY  76           1HA      GLY  76  18.198  -6.193   2.822
  540    H    PHE  77           H        PHE  77  17.259  -5.084  -0.297
  541    HA   PHE  77           HA       PHE  77  17.003  -2.345   0.750
  542    HB2  PHE  77           2HB      PHE  77  18.495  -3.444  -1.592
  543    HB3  PHE  77           1HB      PHE  77  17.796  -1.834  -1.736
  544    HD1  PHE  77           2HD      PHE  77  19.977  -3.878   0.480
  545    HD2  PHE  77           1HD      PHE  77  18.958   0.001  -0.945
  546    HE1  PHE  77           2HE      PHE  77  21.908  -2.935   1.676
  547    HE2  PHE  77           1HE      PHE  77  20.889   0.950   0.248
  548    HZ   PHE  77           HZ       PHE  77  22.367  -0.518   1.561
  549    H    ILE  78           H        ILE  78  15.721  -0.872  -0.741
  550    HA   ILE  78           HA       ILE  78  13.693  -2.322  -2.284
  551    HB   ILE  78           HB       ILE  78  13.172  -0.678   0.159
  552   HG12  ILE  78          2HG1      ILE  78  11.893  -3.143  -1.014
  553   HG13  ILE  78          1HG1      ILE  78  13.050  -3.103   0.317
  554   HG21  ILE  78          1HG2      ILE  78  11.041  -1.068  -1.923
  555   HG22  ILE  78          2HG2      ILE  78  12.001   0.412  -1.824
  556   HG23  ILE  78          3HG2      ILE  78  10.985  -0.072  -0.469
  557   HD11  ILE  78          3HD1      ILE  78  11.449  -2.664   1.794
  558   HD12  ILE  78          1HD1      ILE  78  10.312  -3.079   0.513
  559   HD13  ILE  78          2HD1      ILE  78  10.753  -1.395   0.780
  560    H    ASP  79           H        ASP  79  12.643  -1.161  -3.843
  561    HA   ASP  79           HA       ASP  79  13.892   1.380  -4.590
  562    HB2  ASP  79           2HB      ASP  79  12.245  -0.664  -6.079
  563    HB3  ASP  79           1HB      ASP  79  12.441   0.968  -6.711
  564    H    TYR  80           H        TYR  80  12.915   2.925  -3.381
  565    HA   TYR  80           HA       TYR  80  10.539   3.064  -2.172
  566    HB2  TYR  80           2HB      TYR  80  12.263   4.857  -2.160
  567    HB3  TYR  80           1HB      TYR  80  11.684   5.383  -3.736
  568    HD1  TYR  80           2HD      TYR  80  10.874   5.189  -0.151
  569    HD2  TYR  80           1HD      TYR  80   9.647   6.631  -3.962
  570    HE1  TYR  80           2HE      TYR  80   9.211   6.637   0.937
  571    HE2  TYR  80           1HE      TYR  80   7.983   8.083  -2.884
  572    HH   TYR  80           HH       TYR  80   7.957   9.115  -0.112
  573    H    LYS  81           H        LYS  81  10.985   3.683  -5.643
  574    HA   LYS  81           HA       LYS  81   8.343   4.532  -6.165
  575    HB2  LYS  81           2HB      LYS  81  10.203   3.127  -8.092
  576    HB3  LYS  81           1HB      LYS  81   8.853   4.176  -8.503
  577    HG2  LYS  81           2HG      LYS  81  10.070   6.039  -7.350
  578    HG3  LYS  81           1HG      LYS  81  11.459   4.958  -7.221
  579    HD2  LYS  81           2HD      LYS  81  12.051   5.371  -9.327
  580    HD3  LYS  81           1HD      LYS  81  10.437   4.960  -9.911
  581    HE2  LYS  81           2HE      LYS  81  10.344   7.121 -10.510
  582    HE3  LYS  81           1HE      LYS  81   9.990   7.398  -8.805
  583    HZ1  LYS  81           3HZ      LYS  81  11.745   8.855  -9.590
  584    HZ2  LYS  81           1HZ      LYS  81  12.683   7.525 -10.055
  585    HZ3  LYS  81           2HZ      LYS  81  12.344   7.791  -8.420
  586    H    ALA  82           H        ALA  82   9.881   1.329  -6.464
  587    HA   ALA  82           HA       ALA  82   7.707  -0.119  -7.424
  588    HB1  ALA  82           1HB      ALA  82  10.235  -0.774  -6.723
  589    HB2  ALA  82           2HB      ALA  82   8.968  -1.960  -7.036
  590    HB3  ALA  82           3HB      ALA  82   9.341  -1.486  -5.378
  591    H    PHE  83           H        PHE  83   8.529   0.856  -4.140
  592    HA   PHE  83           HA       PHE  83   6.375  -0.560  -2.893
  593    HB2  PHE  83           2HB      PHE  83   8.690   0.858  -2.056
  594    HB3  PHE  83           1HB      PHE  83   7.302   1.606  -1.269
  595    HD1  PHE  83           2HD      PHE  83   8.579  -1.805  -2.051
  596    HD2  PHE  83           1HD      PHE  83   6.685   0.749   0.775
  597    HE1  PHE  83           2HE      PHE  83   8.539  -3.642  -0.427
  598    HE2  PHE  83           1HE      PHE  83   6.639  -1.090   2.410
  599    HZ   PHE  83           HZ       PHE  83   7.566  -3.292   1.810
  600    H    ALA  84           H        ALA  84   6.946   2.773  -3.950
  601    HA   ALA  84           HA       ALA  84   4.588   3.898  -2.877
  602    HB1  ALA  84           1HB      ALA  84   6.210   4.811  -5.249
  603    HB2  ALA  84           2HB      ALA  84   6.499   5.252  -3.566
  604    HB3  ALA  84           3HB      ALA  84   5.021   5.776  -4.373
  605    H    ALA  85           H        ALA  85   5.254   2.208  -5.888
  606    HA   ALA  85           HA       ALA  85   2.891   2.921  -7.239
  607    HB1  ALA  85           1HB      ALA  85   3.430   1.157  -8.798
  608    HB2  ALA  85           2HB      ALA  85   4.570   0.472  -7.639
  609    HB3  ALA  85           3HB      ALA  85   4.892   2.047  -8.366
  610    H    MET  86           H        MET  86   3.328   0.958  -4.637
  611    HA   MET  86           HA       MET  86   1.247  -0.956  -5.124
  612    HB2  MET  86           2HB      MET  86   2.554  -0.219  -2.495
  613    HB3  MET  86           1HB      MET  86   1.597  -1.658  -2.817
  614    HG2  MET  86           2HG      MET  86   4.040  -1.138  -4.441
  615    HG3  MET  86           1HG      MET  86   4.204  -1.757  -2.800
  616    HE1  MET  86           3HE      MET  86   5.494  -3.935  -4.612
  617    HE2  MET  86           1HE      MET  86   4.603  -5.246  -3.838
  618    HE3  MET  86           2HE      MET  86   5.105  -3.844  -2.894
  619    H    LEU  87           H        LEU  87   1.594   1.980  -3.151
  620    HA   LEU  87           HA       LEU  87  -1.201   1.925  -2.445
  621    HB2  LEU  87           2HB      LEU  87   0.950   3.894  -1.784
  622    HB3  LEU  87           1HB      LEU  87  -0.677   3.953  -1.134
  623    HG   LEU  87           HG       LEU  87   0.317   1.372  -0.560
  624   HD11  LEU  87          1HD1      LEU  87   2.331   1.827   0.697
  625   HD12  LEU  87          2HD1      LEU  87   2.273   3.526   0.227
  626   HD13  LEU  87          3HD1      LEU  87   2.561   2.283  -0.991
  627   HD21  LEU  87          3HD2      LEU  87   0.053   3.740   1.286
  628   HD22  LEU  87          1HD2      LEU  87  -0.030   2.032   1.717
  629   HD23  LEU  87          2HD2      LEU  87  -1.300   2.755   0.731
  630    H    TYR  88           H        TYR  88   0.548   3.027  -4.904
  631    HA   TYR  88           HA       TYR  88  -1.425   5.070  -5.649
  632    HB2  TYR  88           2HB      TYR  88   1.489   4.898  -6.443
  633    HB3  TYR  88           1HB      TYR  88   0.347   6.072  -7.086
  634    HD1  TYR  88           2HD      TYR  88  -1.125   6.888  -4.672
  635    HD2  TYR  88           1HD      TYR  88   3.028   6.138  -5.217
  636    HE1  TYR  88           2HE      TYR  88  -0.611   8.409  -2.810
  637    HE2  TYR  88           1HE      TYR  88   3.553   7.657  -3.357
  638    HH   TYR  88           HH       TYR  88   1.998   8.467  -1.143
  639    H    SER  89           H        SER  89  -1.356   2.089  -6.103
  640    HA   SER  89           HA       SER  89  -0.994   1.791  -8.953
  641    HB2  SER  89           2HB      SER  89  -0.890   0.039  -6.846
  642    HB3  SER  89           1HB      SER  89  -2.468  -0.331  -7.538
  643    HG   SER  89           HG       SER  89   0.071  -0.701  -8.592
  644    H    VAL  90           H        VAL  90  -2.654   3.756  -8.973
  645    HA   VAL  90           HA       VAL  90  -5.279   2.582  -9.604
  646    HB   VAL  90           HB       VAL  90  -5.095   5.397  -8.585
  647   HG11  VAL  90          1HG1      VAL  90  -7.427   4.671  -7.753
  648   HG12  VAL  90          2HG1      VAL  90  -7.227   3.311  -8.857
  649   HG13  VAL  90          3HG1      VAL  90  -7.196   4.962  -9.477
  650   HG21  VAL  90          3HG2      VAL  90  -5.214   2.908  -6.890
  651   HG22  VAL  90          1HG2      VAL  90  -5.694   4.504  -6.314
  652   HG23  VAL  90          2HG2      VAL  90  -4.029   4.212  -6.814
  653    H    ASP  91           H        ASP  91  -2.903   3.252 -11.258
  654    HA   ASP  91           HA       ASP  91  -4.289   4.912 -13.225
  655    HB2  ASP  91           2HB      ASP  91  -1.373   5.350 -12.545
  656    HB3  ASP  91           1HB      ASP  91  -2.356   6.281 -13.671
  657    H    GLU  92           H        GLU  92  -4.642   3.190 -14.568
  658    HA   GLU  92           HA       GLU  92  -2.448   1.425 -15.284
  659    HB2  GLU  92           2HB      GLU  92  -5.232   1.417 -16.445
  660    HB3  GLU  92           1HB      GLU  92  -4.065   0.103 -16.438
  661    HG2  GLU  92           2HG      GLU  92  -5.702   1.166 -14.164
  662    HG3  GLU  92           1HG      GLU  92  -5.644  -0.470 -14.815
  663    H    SER  93           H        SER  93  -1.340   1.427 -17.152
  664    HA   SER  93           HA       SER  93  -0.571   2.018 -19.205
  665    HB2  SER  93           2HB      SER  93  -3.202   3.452 -19.643
  666    HB3  SER  93           1HB      SER  93  -2.047   2.951 -20.876
  667    HG   SER  93           HG       SER  93  -3.937   1.470 -19.508
  Start of MODEL    2
    1    H1   MET   1           1HT      MET   1 -13.312 -22.534  -3.277
    2    H2   MET   1           2HT      MET   1 -12.675 -21.000  -2.840
    3    H3   MET   1           3HT      MET   1 -11.691 -22.138  -3.669
    4    HA   MET   1           HA       MET   1 -14.110 -20.828  -4.720
    5    HB2  MET   1           2HB      MET   1 -11.152 -20.370  -5.037
    6    HB3  MET   1           1HB      MET   1 -12.284 -19.869  -6.286
    7    HG2  MET   1           2HG      MET   1 -13.079 -18.149  -5.071
    8    HG3  MET   1           1HG      MET   1 -12.939 -19.019  -3.545
    9    HE1  MET   1           2HE      MET   1 -10.871 -15.572  -3.473
   10    HE2  MET   1           3HE      MET   1 -11.853 -16.526  -2.361
   11    HE3  MET   1           1HE      MET   1 -12.492 -16.082  -3.944
   12    H    GLY   2           H        GLY   2 -11.114 -22.254  -6.012
   13    HA2  GLY   2           2HA      GLY   2 -12.780 -23.804  -7.882
   14    HA3  GLY   2           1HA      GLY   2 -11.110 -23.336  -8.163
   15    H    SER   3           H        SER   3 -10.409 -25.420  -8.591
   16    HA   SER   3           HA       SER   3  -9.995 -27.057  -6.217
   17    HB2  SER   3           2HB      SER   3 -11.401 -28.019  -8.710
   18    HB3  SER   3           1HB      SER   3 -10.618 -29.125  -7.581
   19    HG   SER   3           HG       SER   3 -12.925 -27.596  -7.275
   20    H    SER   4           H        SER   4  -9.564 -27.348  -9.749
   21    HA   SER   4           HA       SER   4  -6.714 -27.093  -9.541
   22    HB2  SER   4           2HB      SER   4  -7.306 -29.515  -8.835
   23    HB3  SER   4           1HB      SER   4  -7.663 -29.767 -10.544
   24    HG   SER   4           HG       SER   4  -5.603 -30.005 -10.803
   25    H    HIS   5           H        HIS   5  -8.838 -25.813 -10.980
   26    HA   HIS   5           HA       HIS   5  -8.015 -26.440 -13.740
   27    HB2  HIS   5           2HB      HIS   5 -10.724 -25.799 -12.628
   28    HB3  HIS   5           1HB      HIS   5 -10.339 -25.363 -14.289
   29    HD1  HIS   5           1HD      HIS   5 -12.482 -27.517 -13.468
   30    HD2  HIS   5           2HD      HIS   5  -8.586 -28.312 -14.675
   31    HE1  HIS   5           1HE      HIS   5 -12.515 -29.877 -14.334
   32    HE2  HIS   5           2HE      HIS   5 -10.166 -30.306 -15.138
   33    H    HIS   6           H        HIS   6  -7.277 -24.788 -14.949
   34    HA   HIS   6           HA       HIS   6  -6.769 -22.273 -13.654
   35    HB2  HIS   6           2HB      HIS   6  -6.219 -23.095 -16.513
   36    HB3  HIS   6           1HB      HIS   6  -5.534 -21.704 -15.679
   37    HD1  HIS   6           1HD      HIS   6  -4.205 -22.561 -13.319
   38    HD2  HIS   6           2HD      HIS   6  -4.490 -25.157 -16.549
   39    HE1  HIS   6           1HE      HIS   6  -2.384 -24.259 -12.977
   40    HE2  HIS   6           2HE      HIS   6  -2.632 -25.870 -14.899
   41    H    HIS   7           H        HIS   7  -8.986 -21.604 -13.343
   42    HA   HIS   7           HA       HIS   7  -9.960 -20.089 -15.635
   43    HB2  HIS   7           2HB      HIS   7 -11.617 -22.118 -14.134
   44    HB3  HIS   7           1HB      HIS   7 -12.321 -20.854 -15.135
   45    HD1  HIS   7           1HD      HIS   7  -9.864 -23.734 -15.511
   46    HD2  HIS   7           2HD      HIS   7 -12.642 -21.577 -17.725
   47    HE1  HIS   7           1HE      HIS   7  -9.973 -24.875 -17.749
   48    HE2  HIS   7           2HE      HIS   7 -11.594 -23.502 -19.100
   49    H    HIS   8           H        HIS   8 -11.725 -18.559 -14.977
   50    HA   HIS   8           HA       HIS   8 -12.266 -17.959 -12.288
   51    HB2  HIS   8           2HB      HIS   8  -9.699 -17.339 -12.739
   52    HB3  HIS   8           1HB      HIS   8 -10.440 -15.852 -13.323
   53    HD1  HIS   8           1HD      HIS   8  -9.488 -17.622 -10.255
   54    HD2  HIS   8           2HD      HIS   8 -11.963 -14.452 -11.300
   55    HE1  HIS   8           1HE      HIS   8  -9.981 -16.417  -8.104
   56    HE2  HIS   8           2HE      HIS   8 -11.549 -14.554  -8.749
   57    H    HIS   9           H        HIS   9 -13.699 -16.228 -12.061
   58    HA   HIS   9           HA       HIS   9 -15.290 -15.627 -14.287
   59    HB2  HIS   9           2HB      HIS   9 -15.085 -14.363 -11.556
   60    HB3  HIS   9           1HB      HIS   9 -16.266 -13.838 -12.752
   61    HD1  HIS   9           1HD      HIS   9 -15.449 -17.469 -12.389
   62    HD2  HIS   9           2HD      HIS   9 -18.406 -14.794 -11.224
   63    HE1  HIS   9           1HE      HIS   9 -17.333 -18.888 -11.516
   64    HE2  HIS   9           2HE      HIS   9 -19.076 -17.243 -10.737
   65    H    HIS  10           H        HIS  10 -13.230 -13.381 -12.425
   66    HA   HIS  10           HA       HIS  10 -12.129 -11.481 -13.018
   67    HB2  HIS  10           2HB      HIS  10 -11.367 -13.315 -14.834
   68    HB3  HIS  10           1HB      HIS  10 -12.121 -12.145 -15.911
   69    HD1  HIS  10           1HD      HIS  10 -11.097  -9.667 -15.803
   70    HD2  HIS  10           2HD      HIS  10  -8.849 -12.658 -13.995
   71    HE1  HIS  10           1HE      HIS  10  -8.795  -8.698 -15.519
   72    HE2  HIS  10           2HE      HIS  10  -7.431 -10.555 -14.502
   73    H    SER  11           H        SER  11 -12.323  -9.440 -14.223
   74    HA   SER  11           HA       SER  11 -13.502  -7.696 -15.084
   75    HB2  SER  11           2HB      SER  11 -15.702  -9.304 -16.221
   76    HB3  SER  11           1HB      SER  11 -14.683  -8.084 -16.984
   77    HG   SER  11           HG       SER  11 -14.517 -10.587 -17.417
   78    H    SER  12           H        SER  12 -16.099 -10.046 -14.419
   79    HA   SER  12           HA       SER  12 -17.008  -8.386 -12.194
   80    HB2  SER  12           2HB      SER  12 -18.454  -8.793 -14.757
   81    HB3  SER  12           1HB      SER  12 -19.415  -8.897 -13.281
   82    HG   SER  12           HG       SER  12 -19.445  -6.788 -13.628
   83    H    GLY  13           H        GLY  13 -16.689  -9.915 -10.656
   84    HA2  GLY  13           2HA      GLY  13 -17.152 -12.676 -10.978
   85    HA3  GLY  13           1HA      GLY  13 -16.999 -11.837  -9.441
   86    H    LEU  14           H        LEU  14 -18.678 -12.225  -8.176
   87    HA   LEU  14           HA       LEU  14 -21.373 -12.007  -9.298
   88    HB2  LEU  14           2HB      LEU  14 -21.978 -14.002  -7.776
   89    HB3  LEU  14           1HB      LEU  14 -21.237 -14.316  -9.333
   90    HG   LEU  14           HG       LEU  14 -19.029 -14.524  -8.151
   91   HD11  LEU  14          1HD1      LEU  14 -20.826 -14.204  -5.774
   92   HD12  LEU  14          2HD1      LEU  14 -19.305 -13.387  -6.134
   93   HD13  LEU  14          3HD1      LEU  14 -19.303 -15.089  -5.667
   94   HD21  LEU  14          3HD2      LEU  14 -19.404 -16.774  -7.467
   95   HD22  LEU  14          1HD2      LEU  14 -20.489 -16.448  -8.819
   96   HD23  LEU  14          2HD2      LEU  14 -21.115 -16.461  -7.169
   97    H    VAL  15           H        VAL  15 -19.740 -10.262  -7.637
   98    HA   VAL  15           HA       VAL  15 -21.684  -9.748  -5.576
   99    HB   VAL  15           HB       VAL  15 -19.898  -9.640  -3.768
  100   HG11  VAL  15          1HG1      VAL  15 -21.697 -11.505  -4.285
  101   HG12  VAL  15          2HG1      VAL  15 -20.505 -11.704  -3.001
  102   HG13  VAL  15          3HG1      VAL  15 -20.255 -12.482  -4.563
  103   HG21  VAL  15          3HG2      VAL  15 -18.137 -10.099  -5.737
  104   HG22  VAL  15          1HG2      VAL  15 -18.391 -11.753  -5.180
  105   HG23  VAL  15          2HG2      VAL  15 -17.831 -10.519  -4.051
  106    HA   PRO  16           HA       PRO  16 -19.794  -6.003  -7.621
  107    HB2  PRO  16           2HB      PRO  16 -22.459  -5.037  -6.699
  108    HB3  PRO  16           1HB      PRO  16 -21.630  -4.759  -8.235
  109    HG2  PRO  16           2HG      PRO  16 -23.656  -6.476  -8.081
  110    HG3  PRO  16           1HG      PRO  16 -22.243  -6.827  -9.090
  111    HD2  PRO  16           2HD      PRO  16 -23.000  -7.949  -6.431
  112    HD3  PRO  16           1HD      PRO  16 -22.199  -8.739  -7.804
  113    H    ARG  17           H        ARG  17 -19.366  -3.880  -6.693
  114    HA   ARG  17           HA       ARG  17 -19.839  -3.547  -3.847
  115    HB2  ARG  17           2HB      ARG  17 -17.607  -4.883  -4.432
  116    HB3  ARG  17           1HB      ARG  17 -16.995  -3.253  -4.675
  117    HG2  ARG  17           2HG      ARG  17 -16.505  -3.903  -2.439
  118    HG3  ARG  17           1HG      ARG  17 -17.783  -2.688  -2.382
  119    HD2  ARG  17           2HD      ARG  17 -18.222  -4.538  -0.839
  120    HD3  ARG  17           1HD      ARG  17 -19.454  -4.429  -2.095
  121    HE   ARG  17           HE       ARG  17 -18.797  -6.481  -2.877
  122   HH11  ARG  17          1HH1      ARG  17 -16.372  -5.271  -0.678
  123   HH12  ARG  17          2HH1      ARG  17 -15.490  -6.761  -0.634
  124   HH21  ARG  17          1HH2      ARG  17 -17.637  -8.441  -2.821
  125   HH22  ARG  17          2HH2      ARG  17 -16.206  -8.559  -1.852
  126    H    GLY  18           H        GLY  18 -17.593  -2.218  -6.284
  127    HA2  GLY  18           2HA      GLY  18 -17.289  -0.075  -7.046
  128    HA3  GLY  18           1HA      GLY  18 -19.009   0.149  -6.764
  129    H    SER  19           H        SER  19 -19.064   2.125  -5.845
  130    HA   SER  19           HA       SER  19 -18.824   3.768  -4.291
  131    HB2  SER  19           2HB      SER  19 -18.870   3.132  -2.038
  132    HB3  SER  19           1HB      SER  19 -19.536   1.722  -2.859
  133    HG   SER  19           HG       SER  19 -17.750   1.471  -1.205
  134    H    HIS  20           H        HIS  20 -17.081   4.286  -2.275
  135    HA   HIS  20           HA       HIS  20 -14.592   4.647  -3.745
  136    HB2  HIS  20           2HB      HIS  20 -14.015   6.225  -1.934
  137    HB3  HIS  20           1HB      HIS  20 -15.562   6.612  -2.682
  138    HD1  HIS  20           1HD      HIS  20 -17.662   6.426  -1.227
  139    HD2  HIS  20           2HD      HIS  20 -14.171   5.310   0.732
  140    HE1  HIS  20           1HE      HIS  20 -18.282   6.252   1.204
  141    HE2  HIS  20           2HE      HIS  20 -16.175   5.489   2.357
  142    H    MET  21           H        MET  21 -12.952   3.295  -3.493
  143    HA   MET  21           HA       MET  21 -12.562   2.018  -0.871
  144    HB2  MET  21           2HB      MET  21 -13.540   0.454  -2.590
  145    HB3  MET  21           1HB      MET  21 -12.061   0.656  -3.519
  146    HG2  MET  21           2HG      MET  21 -11.380  -1.155  -2.410
  147    HG3  MET  21           1HG      MET  21 -11.056  -0.022  -1.099
  148    HE1  MET  21           3HE      MET  21 -13.235  -3.654  -1.146
  149    HE2  MET  21           1HE      MET  21 -12.006  -3.361   0.083
  150    HE3  MET  21           2HE      MET  21 -11.645  -3.052  -1.614
  151    H    SER  22           H        SER  22 -11.334   4.398  -1.910
  152    HA   SER  22           HA       SER  22  -8.605   3.517  -2.471
  153    HB2  SER  22           2HB      SER  22 -10.100   6.043  -2.998
  154    HB3  SER  22           1HB      SER  22  -8.350   6.127  -2.810
  155    HG   SER  22           HG       SER  22  -9.141   5.779  -5.005
  156    H    ASP  23           H        ASP  23 -10.313   3.993   0.140
  157    HA   ASP  23           HA       ASP  23  -8.707   5.780   1.654
  158    HB2  ASP  23           2HB      ASP  23 -10.641   3.678   2.587
  159    HB3  ASP  23           1HB      ASP  23  -9.979   4.965   3.593
  160    H    GLU  24           H        GLU  24  -8.337   2.665   0.679
  161    HA   GLU  24           HA       GLU  24  -6.906   1.547   2.821
  162    HB2  GLU  24           2HB      GLU  24  -7.928   0.303   0.860
  163    HB3  GLU  24           1HB      GLU  24  -6.523   0.820  -0.064
  164    HG2  GLU  24           2HG      GLU  24  -5.607  -1.094   0.605
  165    HG3  GLU  24           1HG      GLU  24  -5.373  -0.280   2.152
  166    H    LYS  25           H        LYS  25  -6.120   3.876   0.626
  167    HA   LYS  25           HA       LYS  25  -3.240   3.505   0.808
  168    HB2  LYS  25           2HB      LYS  25  -4.697   4.354  -1.257
  169    HB3  LYS  25           1HB      LYS  25  -4.422   5.910  -0.487
  170    HG2  LYS  25           2HG      LYS  25  -1.915   4.875  -0.476
  171    HG3  LYS  25           1HG      LYS  25  -2.573   4.176  -1.957
  172    HD2  LYS  25           2HD      LYS  25  -2.072   6.113  -2.948
  173    HD3  LYS  25           1HD      LYS  25  -3.411   6.815  -2.039
  174    HE2  LYS  25           2HE      LYS  25  -1.479   6.912  -0.170
  175    HE3  LYS  25           1HE      LYS  25  -0.499   7.061  -1.628
  176    HZ1  LYS  25           3HZ      LYS  25  -1.740   8.969  -2.292
  177    HZ2  LYS  25           1HZ      LYS  25  -1.249   9.208  -0.690
  178    HZ3  LYS  25           2HZ      LYS  25  -2.848   8.772  -1.029
  179    H    THR  26           H        THR  26  -5.788   5.497   2.098
  180    HA   THR  26           HA       THR  26  -4.263   7.626   3.073
  181    HB   THR  26           HB       THR  26  -6.387   7.114   4.899
  182    HG1  THR  26           1HG      THR  26  -7.189   6.905   2.193
  183   HG21  THR  26          3HG2      THR  26  -7.334   8.964   3.105
  184   HG22  THR  26          1HG2      THR  26  -5.580   9.154   2.995
  185   HG23  THR  26          2HG2      THR  26  -6.394   9.307   4.556
  186    H    GLN  27           H        GLN  27  -4.674   4.384   4.250
  187    HA   GLN  27           HA       GLN  27  -3.819   4.774   6.906
  188    HB2  GLN  27           2HB      GLN  27  -4.709   2.631   5.525
  189    HB3  GLN  27           1HB      GLN  27  -2.986   2.282   5.529
  190    HG2  GLN  27           2HG      GLN  27  -3.391   1.302   7.487
  191    HG3  GLN  27           1HG      GLN  27  -3.410   2.942   8.131
  192   HE21  GLN  27          1HE2      GLN  27  -5.729   1.058   6.217
  193   HE22  GLN  27          2HE2      GLN  27  -7.052   1.255   7.311
  194    H    LEU  28           H        LEU  28  -2.181   4.791   3.886
  195    HA   LEU  28           HA       LEU  28   0.452   4.485   5.025
  196    HB2  LEU  28           2HB      LEU  28  -0.148   3.515   2.825
  197    HB3  LEU  28           1HB      LEU  28  -0.396   5.142   2.221
  198    HG   LEU  28           HG       LEU  28   1.824   3.889   1.695
  199   HD11  LEU  28          1HD1      LEU  28   2.513   5.883   0.994
  200   HD12  LEU  28          2HD1      LEU  28   2.614   6.517   2.636
  201   HD13  LEU  28          3HD1      LEU  28   1.076   6.544   1.773
  202   HD21  LEU  28          3HD2      LEU  28   2.412   3.227   3.933
  203   HD22  LEU  28          1HD2      LEU  28   2.358   4.902   4.484
  204   HD23  LEU  28          2HD2      LEU  28   3.601   4.388   3.344
  205    H    ILE  29           H        ILE  29  -1.709   6.889   4.559
  206    HA   ILE  29           HA       ILE  29  -0.096   9.083   3.904
  207    HB   ILE  29           HB       ILE  29  -2.696   8.988   5.373
  208   HG12  ILE  29          2HG1      ILE  29  -2.538   8.137   2.978
  209   HG13  ILE  29          1HG1      ILE  29  -3.767   9.349   3.321
  210   HG21  ILE  29          1HG2      ILE  29  -1.691  11.082   5.921
  211   HG22  ILE  29          2HG2      ILE  29  -2.919  11.396   4.695
  212   HG23  ILE  29          3HG2      ILE  29  -1.214  11.357   4.245
  213   HD11  ILE  29          3HD1      ILE  29  -1.831   9.396   1.331
  214   HD12  ILE  29          1HD1      ILE  29  -1.337  10.613   2.508
  215   HD13  ILE  29          2HD1      ILE  29  -2.949  10.681   1.787
  216    H    GLU  30           H        GLU  30  -0.343   7.328   6.602
  217    HA   GLU  30           HA       GLU  30   0.370   9.314   8.519
  218    HB2  GLU  30           2HB      GLU  30  -0.935   7.226   9.069
  219    HB3  GLU  30           1HB      GLU  30   0.569   6.334   8.885
  220    HG2  GLU  30           2HG      GLU  30   0.042   6.824  11.226
  221    HG3  GLU  30           1HG      GLU  30   1.564   7.549  10.712
  222    H    ALA  31           H        ALA  31   2.035   8.136   6.124
  223    HA   ALA  31           HA       ALA  31   4.576   7.762   7.509
  224    HB1  ALA  31           1HB      ALA  31   5.366   6.732   5.627
  225    HB2  ALA  31           2HB      ALA  31   4.385   7.719   4.540
  226    HB3  ALA  31           3HB      ALA  31   3.642   6.404   5.449
  227    H    PHE  32           H        PHE  32   2.888  10.080   5.526
  228    HA   PHE  32           HA       PHE  32   5.000  11.661   4.646
  229    HB2  PHE  32           2HB      PHE  32   2.109  12.130   5.181
  230    HB3  PHE  32           1HB      PHE  32   3.137  13.541   4.954
  231    HD1  PHE  32           1HD      PHE  32   4.821  13.226   2.860
  232    HD2  PHE  32           2HD      PHE  32   1.021  11.368   3.324
  233    HE1  PHE  32           1HE      PHE  32   4.663  12.949   0.420
  234    HE2  PHE  32           2HE      PHE  32   0.855  11.087   0.884
  235    HZ   PHE  32           HZ       PHE  32   2.679  11.878  -0.570
  236    H    TYR  33           H        TYR  33   3.707  11.277   7.821
  237    HA   TYR  33           HA       TYR  33   5.035  13.700   8.782
  238    HB2  TYR  33           2HB      TYR  33   3.287  11.743  10.285
  239    HB3  TYR  33           1HB      TYR  33   3.876  13.288  10.891
  240    HD1  TYR  33           2HD      TYR  33   1.811  11.827   8.150
  241    HD2  TYR  33           1HD      TYR  33   2.569  15.195  10.637
  242    HE1  TYR  33           2HE      TYR  33  -0.189  12.935   7.249
  243    HE2  TYR  33           1HE      TYR  33   0.569  16.312   9.744
  244    HH   TYR  33           HH       TYR  33  -1.822  15.049   8.451
  245    H    ASN  34           H        ASN  34   6.545  11.368   7.843
  246    HA   ASN  34           HA       ASN  34   8.533  11.283   9.804
  247    HB2  ASN  34           2HB      ASN  34   8.300   8.823  10.420
  248    HB3  ASN  34           1HB      ASN  34   7.159   9.928  11.181
  249   HD21  ASN  34          1HD2      ASN  34   7.569   7.254   9.086
  250   HD22  ASN  34          2HD2      ASN  34   5.896   6.955   8.774
  251    H    PHE  35           H        PHE  35   8.343  11.630   7.014
  252    HA   PHE  35           HA       PHE  35  10.328   9.705   6.166
  253    HB2  PHE  35           2HB      PHE  35   7.549   9.715   5.109
  254    HB3  PHE  35           1HB      PHE  35   8.850   9.521   3.938
  255    HD1  PHE  35           1HD      PHE  35   7.143   8.031   6.814
  256    HD2  PHE  35           2HD      PHE  35  10.200   7.534   3.896
  257    HE1  PHE  35           1HE      PHE  35   7.283   5.639   7.374
  258    HE2  PHE  35           2HE      PHE  35  10.346   5.141   4.450
  259    HZ   PHE  35           HZ       PHE  35   8.887   4.191   6.191
  260    H    ASP  36           H        ASP  36  10.217  12.561   6.676
  261    HA   ASP  36           HA       ASP  36  10.657  13.637   3.973
  262    HB2  ASP  36           2HB      ASP  36  10.002  15.000   6.586
  263    HB3  ASP  36           1HB      ASP  36  10.529  15.881   5.154
  264    H    GLY  37           H        GLY  37  12.569  11.975   5.411
  265    HA2  GLY  37           2HA      GLY  37  14.897  13.551   4.981
  266    HA3  GLY  37           1HA      GLY  37  14.595  13.352   6.700
  267    H    ASP  38           H        ASP  38  14.666  11.361   3.742
  268    HA   ASP  38           HA       ASP  38  16.369   9.447   5.171
  269    HB2  ASP  38           2HB      ASP  38  15.064   7.587   4.055
  270    HB3  ASP  38           1HB      ASP  38  14.219   8.435   5.347
  271    H    TYR  39           H        TYR  39  16.939  11.490   3.178
  272    HA   TYR  39           HA       TYR  39  18.187  11.767   1.297
  273    HB2  TYR  39           2HB      TYR  39  18.824   8.996   2.163
  274    HB3  TYR  39           1HB      TYR  39  19.303   9.452   0.531
  275    HD1  TYR  39           2HD      TYR  39  19.565  10.581   4.074
  276    HD2  TYR  39           1HD      TYR  39  21.307  10.588   0.192
  277    HE1  TYR  39           2HE      TYR  39  21.568  11.687   4.980
  278    HE2  TYR  39           1HE      TYR  39  23.313  11.693   1.087
  279    HH   TYR  39           HH       TYR  39  23.630  13.320   3.424
  280    H    ASP  40           H        ASP  40  16.300  12.236   0.069
  281    HA   ASP  40           HA       ASP  40  14.926  12.037  -1.732
  282    HB2  ASP  40           2HB      ASP  40  16.624   9.667  -2.523
  283    HB3  ASP  40           1HB      ASP  40  15.657  10.691  -3.580
  284    H    GLY  41           H        GLY  41  13.842   9.975  -3.121
  285    HA2  GLY  41           2HA      GLY  41  12.052   8.848  -1.173
  286    HA3  GLY  41           1HA      GLY  41  11.972   8.628  -2.914
  287    H    PHE  42           H        PHE  42  14.807   7.712  -2.979
  288    HA   PHE  42           HA       PHE  42  14.354   4.955  -2.854
  289    HB2  PHE  42           2HB      PHE  42  16.883   6.589  -2.960
  290    HB3  PHE  42           1HB      PHE  42  16.912   4.829  -2.942
  291    HD1  PHE  42           2HD      PHE  42  15.494   3.643  -4.756
  292    HD2  PHE  42           1HD      PHE  42  16.718   7.712  -4.969
  293    HE1  PHE  42           2HE      PHE  42  15.165   3.609  -7.193
  294    HE2  PHE  42           1HE      PHE  42  16.389   7.687  -7.408
  295    HZ   PHE  42           HZ       PHE  42  15.613   5.634  -8.523
  296    H    VAL  43           H        VAL  43  14.268   3.591  -1.207
  297    HA   VAL  43           HA       VAL  43  15.871   4.087   1.184
  298    HB   VAL  43           HB       VAL  43  13.711   5.113   1.695
  299   HG11  VAL  43          1HG1      VAL  43  12.358   3.772   0.130
  300   HG12  VAL  43          2HG1      VAL  43  11.661   3.835   1.749
  301   HG13  VAL  43          3HG1      VAL  43  12.514   2.389   1.212
  302   HG21  VAL  43          3HG2      VAL  43  15.048   3.806   3.411
  303   HG22  VAL  43          1HG2      VAL  43  13.871   2.510   3.195
  304   HG23  VAL  43          2HG2      VAL  43  13.348   4.086   3.788
  305    H    SER  44           H        SER  44  16.560   2.251   2.191
  306    HA   SER  44           HA       SER  44  16.083  -0.244   0.780
  307    HB2  SER  44           2HB      SER  44  17.840  -0.230   3.161
  308    HB3  SER  44           1HB      SER  44  18.107  -0.927   1.564
  309    HG   SER  44           HG       SER  44  19.479   0.869   1.997
  310    H    VAL  45           H        VAL  45  15.540  -2.211   1.876
  311    HA   VAL  45           HA       VAL  45  13.299  -2.036   3.528
  312    HB   VAL  45           HB       VAL  45  15.168  -4.381   3.150
  313   HG11  VAL  45          1HG1      VAL  45  13.362  -5.778   3.902
  314   HG12  VAL  45          2HG1      VAL  45  12.318  -4.376   4.125
  315   HG13  VAL  45          3HG1      VAL  45  13.737  -4.592   5.149
  316   HG21  VAL  45          3HG2      VAL  45  13.441  -5.133   1.526
  317   HG22  VAL  45          1HG2      VAL  45  14.282  -3.661   1.039
  318   HG23  VAL  45          2HG2      VAL  45  12.653  -3.565   1.705
  319    H    GLU  46           H        GLU  46  16.587  -3.117   4.389
  320    HA   GLU  46           HA       GLU  46  16.282  -3.552   7.068
  321    HB2  GLU  46           2HB      GLU  46  18.683  -2.144   5.906
  322    HB3  GLU  46           1HB      GLU  46  18.634  -3.198   7.313
  323    HG2  GLU  46           2HG      GLU  46  17.631  -4.655   5.099
  324    HG3  GLU  46           1HG      GLU  46  19.129  -3.868   4.603
  325    H    GLU  47           H        GLU  47  16.414  -0.487   5.412
  326    HA   GLU  47           HA       GLU  47  16.525   1.002   7.914
  327    HB2  GLU  47           2HB      GLU  47  17.636   1.586   5.567
  328    HB3  GLU  47           1HB      GLU  47  16.074   2.343   5.289
  329    HG2  GLU  47           2HG      GLU  47  16.975   4.132   6.256
  330    HG3  GLU  47           1HG      GLU  47  16.717   3.271   7.772
  331    H    PHE  48           H        PHE  48  14.272   0.008   5.463
  332    HA   PHE  48           HA       PHE  48  12.175   1.813   6.091
  333    HB2  PHE  48           2HB      PHE  48  12.640  -0.105   4.143
  334    HB3  PHE  48           1HB      PHE  48  11.308  -0.784   5.069
  335    HD1  PHE  48           1HD      PHE  48   9.842   1.655   5.839
  336    HD2  PHE  48           2HD      PHE  48  11.678   0.576   2.155
  337    HE1  PHE  48           1HE      PHE  48   8.265   3.109   4.631
  338    HE2  PHE  48           2HE      PHE  48  10.106   2.029   0.941
  339    HZ   PHE  48           HZ       PHE  48   8.397   3.299   2.180
  340    H    ARG  49           H        ARG  49  13.062  -1.400   7.237
  341    HA   ARG  49           HA       ARG  49  10.761  -2.023   8.680
  342    HB2  ARG  49           2HB      ARG  49  13.650  -2.779   9.052
  343    HB3  ARG  49           1HB      ARG  49  12.397  -3.376  10.130
  344    HG2  ARG  49           2HG      ARG  49  11.550  -4.790   8.587
  345    HG3  ARG  49           1HG      ARG  49  11.904  -3.707   7.239
  346    HD2  ARG  49           2HD      ARG  49  13.322  -5.581   6.974
  347    HD3  ARG  49           1HD      ARG  49  14.337  -4.275   7.580
  348    HE   ARG  49           HE       ARG  49  13.460  -5.691   9.792
  349   HH11  ARG  49          1HH1      ARG  49  15.386  -6.304   6.946
  350   HH12  ARG  49          2HH1      ARG  49  16.356  -7.516   7.711
  351   HH21  ARG  49          1HH2      ARG  49  14.736  -7.285  10.800
  352   HH22  ARG  49          2HH2      ARG  49  15.988  -8.074   9.899
  353    H    GLY  50           H        GLY  50  13.727  -0.386   9.787
  354    HA2  GLY  50           2HA      GLY  50  12.976   0.024  12.441
  355    HA3  GLY  50           1HA      GLY  50  14.091   1.044  11.546
  356    H    ILE  51           H        ILE  51  11.931   1.656   9.560
  357    HA   ILE  51           HA       ILE  51  10.835   3.920  10.989
  358    HB   ILE  51           HB       ILE  51  10.383   3.132   8.109
  359   HG12  ILE  51          2HG1      ILE  51  12.364   5.179   9.095
  360   HG13  ILE  51          1HG1      ILE  51  12.815   3.491   8.867
  361   HG21  ILE  51          1HG2      ILE  51   8.770   4.710   8.540
  362   HG22  ILE  51          2HG2      ILE  51  10.114   5.733   8.030
  363   HG23  ILE  51          3HG2      ILE  51   9.753   5.543   9.746
  364   HD11  ILE  51          3HD1      ILE  51  13.460   4.555   6.899
  365   HD12  ILE  51          1HD1      ILE  51  11.971   5.495   6.811
  366   HD13  ILE  51          2HD1      ILE  51  11.938   3.761   6.489
  367    H    ILE  52           H        ILE  52   9.606   1.045   9.318
  368    HA   ILE  52           HA       ILE  52   6.860   1.627   9.765
  369    HB   ILE  52           HB       ILE  52   8.190  -1.022   9.177
  370   HG12  ILE  52          2HG1      ILE  52   8.520   0.774   7.468
  371   HG13  ILE  52          1HG1      ILE  52   7.620  -0.616   6.871
  372   HG21  ILE  52          1HG2      ILE  52   6.090  -1.577  10.034
  373   HG22  ILE  52          2HG2      ILE  52   5.846  -1.550   8.288
  374   HG23  ILE  52          3HG2      ILE  52   5.310  -0.189   9.274
  375   HD11  ILE  52          3HD1      ILE  52   5.735   1.221   7.883
  376   HD12  ILE  52          1HD1      ILE  52   6.015   0.746   6.208
  377   HD13  ILE  52          2HD1      ILE  52   6.878   2.126   6.887
  378    H    ARG  53           H        ARG  53   9.339   0.051  11.643
  379    HA   ARG  53           HA       ARG  53   7.892  -1.509  13.390
  380    HB2  ARG  53           2HB      ARG  53  10.410   0.076  13.656
  381    HB3  ARG  53           1HB      ARG  53   9.714  -0.650  15.099
  382    HG2  ARG  53           2HG      ARG  53   9.655  -2.794  13.553
  383    HG3  ARG  53           1HG      ARG  53  10.962  -1.937  12.736
  384    HD2  ARG  53           2HD      ARG  53  10.856  -2.604  15.676
  385    HD3  ARG  53           1HD      ARG  53  11.809  -3.457  14.461
  386    HE   ARG  53           HE       ARG  53  12.429  -0.693  14.462
  387   HH11  ARG  53          1HH1      ARG  53  12.945  -3.622  16.288
  388   HH12  ARG  53          2HH1      ARG  53  14.453  -3.091  16.952
  389   HH21  ARG  53          1HH2      ARG  53  14.412   0.008  15.335
  390   HH22  ARG  53          2HH2      ARG  53  15.285  -1.030  16.414
  391    H    ASP  54           H        ASP  54   8.789   1.902  13.940
  392    HA   ASP  54           HA       ASP  54   6.507   2.103  15.791
  393    HB2  ASP  54           2HB      ASP  54   9.066   3.713  15.697
  394    HB3  ASP  54           1HB      ASP  54   7.727   4.026  16.795
  395    H    GLY  55           H        GLY  55   6.860   2.582  12.724
  396    HA2  GLY  55           2HA      GLY  55   5.987   5.380  12.625
  397    HA3  GLY  55           1HA      GLY  55   6.495   4.412  11.250
  398    H    LEU  56           H        LEU  56   5.031   2.881  10.361
  399    HA   LEU  56           HA       LEU  56   2.230   3.579  10.891
  400    HB2  LEU  56           2HB      LEU  56   3.633   2.459   8.478
  401    HB3  LEU  56           1HB      LEU  56   1.887   2.421   8.632
  402    HG   LEU  56           HG       LEU  56   1.993   4.945   8.930
  403   HD11  LEU  56          1HD1      LEU  56   4.128   5.793   7.640
  404   HD12  LEU  56          2HD1      LEU  56   4.835   4.325   8.316
  405   HD13  LEU  56          3HD1      LEU  56   4.149   5.547   9.387
  406   HD21  LEU  56          3HD2      LEU  56   1.556   3.476   6.773
  407   HD22  LEU  56          1HD2      LEU  56   3.044   4.257   6.239
  408   HD23  LEU  56          2HD2      LEU  56   1.649   5.235   6.696
  409    HA   PRO  57           HA       PRO  57   1.502  -0.483  12.494
  410    HB2  PRO  57           2HB      PRO  57  -1.174  -0.616  12.265
  411    HB3  PRO  57           1HB      PRO  57  -0.390   0.466  13.422
  412    HG2  PRO  57           2HG      PRO  57  -1.543   1.087  10.731
  413    HG3  PRO  57           1HG      PRO  57  -1.675   2.003  12.245
  414    HD2  PRO  57           2HD      PRO  57   0.082   2.631  10.246
  415    HD3  PRO  57           1HD      PRO  57   0.366   3.009  11.957
  416    H    MET  58           H        MET  58   2.199  -2.160  11.333
  417    HA   MET  58           HA       MET  58   0.465  -3.290   9.318
  418    HB2  MET  58           2HB      MET  58   2.640  -1.662   8.527
  419    HB3  MET  58           1HB      MET  58   3.113  -3.321   8.196
  420    HG2  MET  58           2HG      MET  58   1.328  -3.657   6.725
  421    HG3  MET  58           1HG      MET  58   0.466  -2.236   7.308
  422    HE1  MET  58           3HE      MET  58   4.296  -2.630   5.252
  423    HE2  MET  58           1HE      MET  58   3.148  -2.815   3.926
  424    HE3  MET  58           2HE      MET  58   3.021  -3.843   5.353
  425    H    THR  59           H        THR  59   0.633  -5.474   9.219
  426    HA   THR  59           HA       THR  59   2.244  -6.773  11.222
  427    HB   THR  59           HB       THR  59   1.152  -8.812   9.749
  428    HG1  THR  59           1HG      THR  59  -0.781  -6.749   9.711
  429   HG21  THR  59          3HG2      THR  59  -0.714  -7.524  11.634
  430   HG22  THR  59          1HG2      THR  59   0.869  -7.979  12.266
  431   HG23  THR  59          2HG2      THR  59  -0.169  -9.199  11.529
  432    H    GLU  60           H        GLU  60   3.888  -8.278  10.881
  433    HA   GLU  60           HA       GLU  60   5.886  -7.782   9.126
  434    HB2  GLU  60           2HB      GLU  60   6.460 -10.273   9.344
  435    HB3  GLU  60           1HB      GLU  60   6.353  -9.335  10.827
  436    HG2  GLU  60           2HG      GLU  60   3.798 -10.265  10.545
  437    HG3  GLU  60           1HG      GLU  60   4.755 -11.598   9.906
  438    H    ALA  61           H        ALA  61   3.370 -10.205   8.609
  439    HA   ALA  61           HA       ALA  61   4.032 -11.185   6.161
  440    HB1  ALA  61           1HB      ALA  61   2.091 -12.233   6.402
  441    HB2  ALA  61           2HB      ALA  61   1.198 -10.722   6.241
  442    HB3  ALA  61           3HB      ALA  61   1.787 -11.235   7.824
  443    H    GLU  62           H        GLU  62   1.982  -8.322   6.746
  444    HA   GLU  62           HA       GLU  62   1.602  -7.613   4.074
  445    HB2  GLU  62           2HB      GLU  62   1.951  -5.349   5.938
  446    HB3  GLU  62           1HB      GLU  62   0.624  -5.712   4.847
  447    HG2  GLU  62           2HG      GLU  62   0.123  -7.606   6.577
  448    HG3  GLU  62           1HG      GLU  62   1.072  -6.580   7.651
  449    H    ILE  63           H        ILE  63   3.935  -6.177   6.350
  450    HA   ILE  63           HA       ILE  63   5.394  -4.732   4.434
  451    HB   ILE  63           HB       ILE  63   6.716  -5.871   6.877
  452   HG12  ILE  63          2HG1      ILE  63   5.658  -3.414   7.642
  453   HG13  ILE  63          1HG1      ILE  63   4.328  -4.212   6.803
  454   HG21  ILE  63          1HG2      ILE  63   7.785  -4.348   5.039
  455   HG22  ILE  63          2HG2      ILE  63   8.125  -4.056   6.745
  456   HG23  ILE  63          3HG2      ILE  63   6.942  -3.058   5.900
  457   HD11  ILE  63          3HD1      ILE  63   5.639  -4.883   9.348
  458   HD12  ILE  63          1HD1      ILE  63   5.175  -6.237   8.317
  459   HD13  ILE  63          2HD1      ILE  63   3.962  -5.071   8.838
  460    H    THR  64           H        THR  64   6.363  -7.748   6.050
  461    HA   THR  64           HA       THR  64   8.610  -8.330   4.569
  462    HB   THR  64           HB       THR  64   6.570 -10.195   5.763
  463    HG1  THR  64           1HG      THR  64   7.581  -8.922   7.296
  464   HG21  THR  64          3HG2      THR  64   9.362 -10.833   4.859
  465   HG22  THR  64          1HG2      THR  64   7.862 -11.465   4.180
  466   HG23  THR  64          2HG2      THR  64   8.334 -11.888   5.826
  467    H    GLU  65           H        GLU  65   5.271  -9.416   3.927
  468    HA   GLU  65           HA       GLU  65   5.945 -10.725   1.515
  469    HB2  GLU  65           2HB      GLU  65   3.847 -11.111   2.883
  470    HB3  GLU  65           1HB      GLU  65   3.238  -9.614   2.187
  471    HG2  GLU  65           2HG      GLU  65   3.892 -10.864  -0.068
  472    HG3  GLU  65           1HG      GLU  65   3.606 -12.274   0.950
  473    H    PHE  66           H        PHE  66   5.653  -7.561   2.330
  474    HA   PHE  66           HA       PHE  66   5.135  -6.656  -0.379
  475    HB2  PHE  66           2HB      PHE  66   5.104  -5.320   2.295
  476    HB3  PHE  66           1HB      PHE  66   5.383  -4.339   0.864
  477    HD1  PHE  66           2HD      PHE  66   3.221  -7.304   0.799
  478    HD2  PHE  66           1HD      PHE  66   3.372  -3.062   1.115
  479    HE1  PHE  66           2HE      PHE  66   0.796  -7.192   0.399
  480    HE2  PHE  66           1HE      PHE  66   0.947  -2.943   0.715
  481    HZ   PHE  66           HZ       PHE  66  -0.343  -5.009   0.356
  482    H    PHE  67           H        PHE  67   7.676  -7.041   1.931
  483    HA   PHE  67           HA       PHE  67   9.533  -5.230   0.719
  484    HB2  PHE  67           2HB      PHE  67   9.643  -7.333   2.830
  485    HB3  PHE  67           1HB      PHE  67  11.159  -6.828   2.093
  486    HD1  PHE  67           2HD      PHE  67  10.286  -3.879   1.691
  487    HD2  PHE  67           1HD      PHE  67  10.123  -6.552   5.004
  488    HE1  PHE  67           2HE      PHE  67  10.371  -1.968   3.238
  489    HE2  PHE  67           1HE      PHE  67  10.211  -4.643   6.552
  490    HZ   PHE  67           HZ       PHE  67  10.336  -2.351   5.671
  491    H    GLU  68           H        GLU  68   9.075  -8.745   0.624
  492    HA   GLU  68           HA       GLU  68  11.220  -9.163  -1.229
  493    HB2  GLU  68           2HB      GLU  68  10.200 -11.478  -1.399
  494    HB3  GLU  68           1HB      GLU  68  10.724 -10.982   0.203
  495    HG2  GLU  68           2HG      GLU  68   8.657 -11.070   1.045
  496    HG3  GLU  68           1HG      GLU  68   7.934 -10.346  -0.390
  497    H    ALA  69           H        ALA  69   7.830  -8.464  -1.482
  498    HA   ALA  69           HA       ALA  69   7.523  -9.344  -4.169
  499    HB1  ALA  69           1HB      ALA  69   5.362  -8.263  -4.093
  500    HB2  ALA  69           2HB      ALA  69   5.835  -7.410  -2.622
  501    HB3  ALA  69           3HB      ALA  69   5.637  -9.163  -2.600
  502    H    ALA  70           H        ALA  70   9.021  -6.773  -2.822
  503    HA   ALA  70           HA       ALA  70   8.636  -4.979  -5.095
  504    HB1  ALA  70           1HB      ALA  70   9.660  -4.641  -2.325
  505    HB2  ALA  70           2HB      ALA  70   8.515  -3.658  -3.238
  506    HB3  ALA  70           3HB      ALA  70  10.243  -3.539  -3.573
  507    H    ASP  71           H        ASP  71  11.325  -6.446  -3.270
  508    HA   ASP  71           HA       ASP  71  13.055  -5.994  -5.599
  509    HB2  ASP  71           2HB      ASP  71  14.941  -6.245  -4.089
  510    HB3  ASP  71           1HB      ASP  71  13.822  -5.052  -3.439
  511    HA   PRO  72           HA       PRO  72  12.578 -10.399  -6.324
  512    HB2  PRO  72           2HB      PRO  72  14.207 -10.533  -8.493
  513    HB3  PRO  72           1HB      PRO  72  12.553  -9.914  -8.568
  514    HG2  PRO  72           2HG      PRO  72  15.134  -8.405  -8.401
  515    HG3  PRO  72           1HG      PRO  72  13.714  -8.084  -9.414
  516    HD2  PRO  72           2HD      PRO  72  14.199  -6.721  -7.131
  517    HD3  PRO  72           1HD      PRO  72  12.553  -7.081  -7.691
  518    H    ASN  73           H        ASN  73  15.712  -8.755  -6.256
  519    HA   ASN  73           HA       ASN  73  17.271 -11.099  -5.912
  520    HB2  ASN  73           2HB      ASN  73  17.950  -8.262  -5.108
  521    HB3  ASN  73           1HB      ASN  73  19.090  -9.584  -5.342
  522   HD21  ASN  73          1HD2      ASN  73  18.396  -6.869  -6.670
  523   HD22  ASN  73          2HD2      ASN  73  18.470  -7.242  -8.356
  524    H    ASN  74           H        ASN  74  15.616  -8.944  -3.713
  525    HA   ASN  74           HA       ASN  74  15.061  -9.164  -1.518
  526    HB2  ASN  74           2HB      ASN  74  16.479 -11.827  -1.477
  527    HB3  ASN  74           1HB      ASN  74  15.193 -11.264  -0.414
  528   HD21  ASN  74          1HD2      ASN  74  14.744 -13.615  -1.424
  529   HD22  ASN  74          2HD2      ASN  74  13.608 -13.576  -2.724
  530    H    THR  75           H        THR  75  17.321  -7.784  -2.308
  531    HA   THR  75           HA       THR  75  19.429  -8.472  -0.432
  532    HB   THR  75           HB       THR  75  20.280  -7.819  -2.530
  533    HG1  THR  75           1HG      THR  75  21.575  -6.776  -1.187
  534   HG21  THR  75          3HG2      THR  75  18.294  -5.591  -2.431
  535   HG22  THR  75          1HG2      THR  75  18.570  -6.789  -3.697
  536   HG23  THR  75          2HG2      THR  75  19.736  -5.488  -3.442
  537    H    GLY  76           H        GLY  76  16.808  -7.603   0.532
  538    HA2  GLY  76           2HA      GLY  76  15.907  -6.225   2.115
  539    HA3  GLY  76           1HA      GLY  76  17.565  -5.958   2.635
  540    H    PHE  77           H        PHE  77  16.544  -5.113  -0.579
  541    HA   PHE  77           HA       PHE  77  16.548  -2.273   0.197
  542    HB2  PHE  77           2HB      PHE  77  18.147  -3.693  -1.816
  543    HB3  PHE  77           1HB      PHE  77  17.354  -2.248  -2.432
  544    HD1  PHE  77           1HD      PHE  77  19.782  -3.536   0.001
  545    HD2  PHE  77           2HD      PHE  77  18.028  -0.069  -1.733
  546    HE1  PHE  77           1HE      PHE  77  21.551  -2.149   1.001
  547    HE2  PHE  77           2HE      PHE  77  19.793   1.326  -0.737
  548    HZ   PHE  77           HZ       PHE  77  21.558   0.286   0.631
  549    H    ILE  78           H        ILE  78  15.374  -0.854  -1.322
  550    HA   ILE  78           HA       ILE  78  13.289  -2.229  -2.863
  551    HB   ILE  78           HB       ILE  78  12.762  -0.088  -0.796
  552   HG12  ILE  78          2HG1      ILE  78  11.836  -2.956  -0.999
  553   HG13  ILE  78          1HG1      ILE  78  12.964  -2.304   0.191
  554   HG21  ILE  78          1HG2      ILE  78  10.798  -1.391  -2.679
  555   HG22  ILE  78          2HG2      ILE  78  11.423   0.251  -2.843
  556   HG23  ILE  78          3HG2      ILE  78  10.435  -0.181  -1.451
  557   HD11  ILE  78          3HD1      ILE  78  11.275  -1.774   1.517
  558   HD12  ILE  78          1HD1      ILE  78  10.161  -2.488   0.351
  559   HD13  ILE  78          2HD1      ILE  78  10.562  -0.772   0.248
  560    H    ASP  79           H        ASP  79  12.377  -1.043  -4.515
  561    HA   ASP  79           HA       ASP  79  13.895   1.330  -5.329
  562    HB2  ASP  79           2HB      ASP  79  13.142  -0.889  -6.782
  563    HB3  ASP  79           1HB      ASP  79  11.876   0.264  -7.191
  564    H    TYR  80           H        TYR  80  12.960   2.936  -4.144
  565    HA   TYR  80           HA       TYR  80  10.616   3.401  -3.088
  566    HB2  TYR  80           2HB      TYR  80  12.421   5.093  -3.261
  567    HB3  TYR  80           1HB      TYR  80  11.889   5.462  -4.898
  568    HD1  TYR  80           2HD      TYR  80  10.265   5.086  -1.545
  569    HD2  TYR  80           1HD      TYR  80  10.688   7.412  -5.083
  570    HE1  TYR  80           2HE      TYR  80   8.665   6.727  -0.651
  571    HE2  TYR  80           1HE      TYR  80   9.091   9.059  -4.199
  572    HH   TYR  80           HH       TYR  80   8.319   9.448  -1.203
  573    H    LYS  81           H        LYS  81  11.089   3.614  -6.598
  574    HA   LYS  81           HA       LYS  81   8.471   4.510  -7.185
  575    HB2  LYS  81           2HB      LYS  81  10.642   3.201  -8.794
  576    HB3  LYS  81           1HB      LYS  81   9.048   3.438  -9.493
  577    HG2  LYS  81           2HG      LYS  81   9.257   5.717  -9.553
  578    HG3  LYS  81           1HG      LYS  81  10.409   5.754  -8.216
  579    HD2  LYS  81           2HD      LYS  81  11.185   4.431 -10.777
  580    HD3  LYS  81           1HD      LYS  81  11.203   6.193 -10.677
  581    HE2  LYS  81           2HE      LYS  81  13.285   5.917  -9.886
  582    HE3  LYS  81           1HE      LYS  81  12.478   5.506  -8.374
  583    HZ1  LYS  81           3HZ      LYS  81  12.468   3.145  -9.602
  584    HZ2  LYS  81           1HZ      LYS  81  13.711   3.653  -8.571
  585    HZ3  LYS  81           2HZ      LYS  81  13.891   3.797 -10.246
  586    H    ALA  82           H        ALA  82   9.927   1.258  -7.430
  587    HA   ALA  82           HA       ALA  82   7.652  -0.154  -8.147
  588    HB1  ALA  82           1HB      ALA  82   9.335  -1.578  -6.224
  589    HB2  ALA  82           2HB      ALA  82  10.238  -0.818  -7.538
  590    HB3  ALA  82           3HB      ALA  82   8.950  -1.965  -7.902
  591    H    PHE  83           H        PHE  83   8.554   1.223  -5.100
  592    HA   PHE  83           HA       PHE  83   6.489  -0.214  -3.643
  593    HB2  PHE  83           2HB      PHE  83   8.956   0.986  -2.956
  594    HB3  PHE  83           1HB      PHE  83   7.702   1.889  -2.110
  595    HD1  PHE  83           2HD      PHE  83   8.392  -1.685  -2.924
  596    HD2  PHE  83           1HD      PHE  83   7.308   1.175   0.033
  597    HE1  PHE  83           2HE      PHE  83   8.258  -3.476  -1.249
  598    HE2  PHE  83           1HE      PHE  83   7.173  -0.612   1.718
  599    HZ   PHE  83           HZ       PHE  83   7.647  -2.943   1.079
  600    H    ALA  84           H        ALA  84   7.126   2.939  -5.004
  601    HA   ALA  84           HA       ALA  84   4.844   4.175  -3.732
  602    HB1  ALA  84           1HB      ALA  84   5.514   6.177  -4.771
  603    HB2  ALA  84           2HB      ALA  84   6.453   5.322  -5.994
  604    HB3  ALA  84           3HB      ALA  84   7.007   5.355  -4.319
  605    H    ALA  85           H        ALA  85   5.468   2.419  -6.622
  606    HA   ALA  85           HA       ALA  85   3.359   3.504  -8.180
  607    HB1  ALA  85           1HB      ALA  85   4.735   0.858  -8.500
  608    HB2  ALA  85           2HB      ALA  85   5.319   2.381  -9.168
  609    HB3  ALA  85           3HB      ALA  85   3.790   1.701  -9.728
  610    H    MET  86           H        MET  86   3.389   1.516  -5.586
  611    HA   MET  86           HA       MET  86   1.134  -0.141  -6.228
  612    HB2  MET  86           2HB      MET  86   3.084  -0.528  -4.495
  613    HB3  MET  86           1HB      MET  86   2.010   0.343  -3.410
  614    HG2  MET  86           2HG      MET  86   1.594  -1.953  -3.084
  615    HG3  MET  86           1HG      MET  86   0.228  -1.318  -3.998
  616    HE1  MET  86           3HE      MET  86   2.838  -3.855  -3.605
  617    HE2  MET  86           1HE      MET  86   3.862  -3.012  -4.768
  618    HE3  MET  86           2HE      MET  86   3.143  -4.567  -5.190
  619    H    LEU  87           H        LEU  87   1.699   2.869  -4.522
  620    HA   LEU  87           HA       LEU  87  -1.113   3.072  -3.827
  621    HB2  LEU  87           2HB      LEU  87   1.281   4.704  -3.103
  622    HB3  LEU  87           1HB      LEU  87  -0.346   5.177  -2.655
  623    HG   LEU  87           HG       LEU  87  -0.502   2.905  -1.476
  624   HD11  LEU  87          1HD1      LEU  87   2.009   2.402  -0.692
  625   HD12  LEU  87          2HD1      LEU  87   2.318   2.935  -2.344
  626   HD13  LEU  87          3HD1      LEU  87   1.234   1.577  -2.044
  627   HD21  LEU  87          3HD2      LEU  87   0.029   5.326  -0.548
  628   HD22  LEU  87          1HD2      LEU  87   1.574   4.570  -0.160
  629   HD23  LEU  87          2HD2      LEU  87   0.076   3.900   0.490
  630    H    TYR  88           H        TYR  88   0.810   3.803  -6.250
  631    HA   TYR  88           HA       TYR  88  -0.875   6.022  -7.184
  632    HB2  TYR  88           2HB      TYR  88   2.046   5.569  -7.825
  633    HB3  TYR  88           1HB      TYR  88   1.048   6.872  -8.462
  634    HD1  TYR  88           1HD      TYR  88  -0.415   7.753  -6.075
  635    HD2  TYR  88           2HD      TYR  88   3.660   6.607  -6.511
  636    HE1  TYR  88           1HE      TYR  88   0.181   9.156  -4.144
  637    HE2  TYR  88           2HE      TYR  88   4.266   8.005  -4.581
  638    HH   TYR  88           HH       TYR  88   2.010   9.252  -2.431
  639    H    SER  89           H        SER  89  -0.995   3.029  -7.534
  640    HA   SER  89           HA       SER  89  -0.628   2.792 -10.426
  641    HB2  SER  89           2HB      SER  89  -1.557   0.363  -9.706
  642    HB3  SER  89           1HB      SER  89   0.148   0.807  -9.621
  643    HG   SER  89           HG       SER  89  -1.751   0.639  -7.551
  644    H    VAL  90           H        VAL  90  -2.739   4.470  -9.266
  645    HA   VAL  90           HA       VAL  90  -5.009   3.211 -10.625
  646    HB   VAL  90           HB       VAL  90  -5.324   2.867  -8.198
  647   HG11  VAL  90          1HG1      VAL  90  -4.113   5.142  -7.727
  648   HG12  VAL  90          2HG1      VAL  90  -5.360   4.546  -6.632
  649   HG13  VAL  90          3HG1      VAL  90  -5.749   5.792  -7.818
  650   HG21  VAL  90          3HG2      VAL  90  -7.550   3.177  -8.358
  651   HG22  VAL  90          1HG2      VAL  90  -7.162   3.642 -10.015
  652   HG23  VAL  90          2HG2      VAL  90  -7.390   4.882  -8.782
  653    H    ASP  91           H        ASP  91  -3.203   5.193 -11.568
  654    HA   ASP  91           HA       ASP  91  -5.111   7.242 -12.273
  655    HB2  ASP  91           2HB      ASP  91  -3.845   7.918 -10.085
  656    HB3  ASP  91           1HB      ASP  91  -2.506   8.251 -11.181
  657    H    GLU  92           H        GLU  92  -3.787   5.193 -13.719
  658    HA   GLU  92           HA       GLU  92  -2.147   6.822 -15.543
  659    HB2  GLU  92           2HB      GLU  92  -1.742   3.978 -14.643
  660    HB3  GLU  92           1HB      GLU  92  -1.040   4.580 -16.138
  661    HG2  GLU  92           2HG      GLU  92  -0.578   6.089 -13.614
  662    HG3  GLU  92           1HG      GLU  92   0.319   4.599 -13.906
  663    H    SER  93           H        SER  93  -2.628   6.714 -17.681
  664    HA   SER  93           HA       SER  93  -5.167   5.772 -18.463
  665    HB2  SER  93           2HB      SER  93  -3.138   6.214 -20.580
  666    HB3  SER  93           1HB      SER  93  -4.773   6.860 -20.430
  667    HG   SER  93           HG       SER  93  -3.632   8.602 -19.968
  Start of MODEL    3
    1    H1   MET   1           1HT      MET   1 -31.786  -5.109  -0.897
    2    H2   MET   1           2HT      MET   1 -33.324  -4.697  -1.537
    3    H3   MET   1           3HT      MET   1 -32.952  -6.333  -1.175
    4    HA   MET   1           HA       MET   1 -34.403  -5.130   0.425
    5    HB2  MET   1           2HB      MET   1 -31.919  -6.685   0.972
    6    HB3  MET   1           1HB      MET   1 -32.787  -6.019   2.349
    7    HG2  MET   1           2HG      MET   1 -34.597  -7.376   2.045
    8    HG3  MET   1           1HG      MET   1 -34.323  -7.538   0.310
    9    HE1  MET   1           2HE      MET   1 -31.899 -10.321  -0.142
   10    HE2  MET   1           3HE      MET   1 -31.171  -8.735   0.118
   11    HE3  MET   1           1HE      MET   1 -32.680  -8.875  -0.784
   12    H    GLY   2           H        GLY   2 -33.002  -2.918  -0.681
   13    HA2  GLY   2           2HA      GLY   2 -32.847  -0.742   0.252
   14    HA3  GLY   2           1HA      GLY   2 -32.438  -1.464   1.801
   15    H    SER   3           H        SER   3 -30.976  -2.167  -1.340
   16    HA   SER   3           HA       SER   3 -28.347  -2.035  -0.350
   17    HB2  SER   3           2HB      SER   3 -27.637  -2.436  -2.566
   18    HB3  SER   3           1HB      SER   3 -29.212  -3.223  -2.461
   19    HG   SER   3           HG       SER   3 -29.989  -1.848  -3.858
   20    H    SER   4           H        SER   4 -26.765  -0.577  -1.892
   21    HA   SER   4           HA       SER   4 -27.178   2.086  -0.923
   22    HB2  SER   4           2HB      SER   4 -25.060   1.326  -2.919
   23    HB3  SER   4           1HB      SER   4 -24.988   2.535  -1.638
   24    HG   SER   4           HG       SER   4 -24.160   1.038  -0.441
   25    H    HIS   5           H        HIS   5 -26.530   0.928  -4.236
   26    HA   HIS   5           HA       HIS   5 -28.740   2.246  -5.394
   27    HB2  HIS   5           2HB      HIS   5 -27.382   3.974  -6.672
   28    HB3  HIS   5           1HB      HIS   5 -27.664   4.318  -4.970
   29    HD1  HIS   5           1HD      HIS   5 -25.499   5.913  -5.420
   30    HD2  HIS   5           2HD      HIS   5 -24.838   1.812  -5.333
   31    HE1  HIS   5           1HE      HIS   5 -23.024   5.638  -5.064
   32    HE2  HIS   5           2HE      HIS   5 -22.662   3.148  -4.927
   33    H    HIS   6           H        HIS   6 -28.178   2.596  -7.911
   34    HA   HIS   6           HA       HIS   6 -26.454   0.424  -8.843
   35    HB2  HIS   6           2HB      HIS   6 -29.412   0.562  -9.116
   36    HB3  HIS   6           1HB      HIS   6 -28.502   0.008 -10.518
   37    HD1  HIS   6           1HD      HIS   6 -26.867  -2.106 -10.013
   38    HD2  HIS   6           2HD      HIS   6 -29.872  -1.354  -7.245
   39    HE1  HIS   6           1HE      HIS   6 -27.106  -4.229  -8.689
   40    HE2  HIS   6           2HE      HIS   6 -28.869  -3.721  -6.961
   41    H    HIS   7           H        HIS   7 -26.274   0.465 -11.286
   42    HA   HIS   7           HA       HIS   7 -25.649   1.564 -13.176
   43    HB2  HIS   7           2HB      HIS   7 -28.203   2.319 -12.746
   44    HB3  HIS   7           1HB      HIS   7 -27.414   3.891 -12.668
   45    HD1  HIS   7           1HD      HIS   7 -27.564   5.013 -14.855
   46    HD2  HIS   7           2HD      HIS   7 -27.046   0.911 -15.269
   47    HE1  HIS   7           1HE      HIS   7 -27.468   4.595 -17.333
   48    HE2  HIS   7           2HE      HIS   7 -27.066   2.118 -17.556
   49    H    HIS   8           H        HIS   8 -25.172   4.075 -13.915
   50    HA   HIS   8           HA       HIS   8 -23.605   5.303 -11.751
   51    HB2  HIS   8           2HB      HIS   8 -21.759   5.710 -13.339
   52    HB3  HIS   8           1HB      HIS   8 -22.057   3.990 -13.104
   53    HD1  HIS   8           1HD      HIS   8 -22.250   6.697 -15.665
   54    HD2  HIS   8           2HD      HIS   8 -23.032   2.628 -15.358
   55    HE1  HIS   8           1HE      HIS   8 -22.567   5.894 -18.028
   56    HE2  HIS   8           2HE      HIS   8 -23.125   3.447 -17.811
   57    H    HIS   9           H        HIS   9 -22.595   7.468 -12.870
   58    HA   HIS   9           HA       HIS   9 -23.057   9.598 -13.515
   59    HB2  HIS   9           2HB      HIS   9 -23.577   8.196 -15.672
   60    HB3  HIS   9           1HB      HIS   9 -25.248   8.619 -15.311
   61    HD1  HIS   9           1HD      HIS   9 -25.775  11.246 -15.252
   62    HD2  HIS   9           2HD      HIS   9 -22.129  10.153 -16.919
   63    HE1  HIS   9           1HE      HIS   9 -25.001  13.255 -16.550
   64    HE2  HIS   9           2HE      HIS   9 -22.836  12.541 -17.620
   65    H    HIS  10           H        HIS  10 -23.948  10.777 -11.952
   66    HA   HIS  10           HA       HIS  10 -26.693  11.354 -11.886
   67    HB2  HIS  10           2HB      HIS  10 -26.860   9.097 -10.899
   68    HB3  HIS  10           1HB      HIS  10 -25.754   9.585  -9.619
   69    HD1  HIS  10           1HD      HIS  10 -27.891  12.376 -10.238
   70    HD2  HIS  10           2HD      HIS  10 -28.274   8.792  -8.169
   71    HE1  HIS  10           1HE      HIS  10 -29.818  12.714  -8.659
   72    HE2  HIS  10           2HE      HIS  10 -29.975  10.563  -7.358
   73    H    SER  11           H        SER  11 -23.712  11.176  -9.997
   74    HA   SER  11           HA       SER  11 -24.030  13.999  -9.320
   75    HB2  SER  11           2HB      SER  11 -23.751  11.756  -7.335
   76    HB3  SER  11           1HB      SER  11 -23.182  13.380  -6.952
   77    HG   SER  11           HG       SER  11 -25.230  14.139  -7.076
   78    H    SER  12           H        SER  12 -21.938  11.138  -9.074
   79    HA   SER  12           HA       SER  12 -19.707  12.728 -10.070
   80    HB2  SER  12           2HB      SER  12 -19.853  11.514  -7.348
   81    HB3  SER  12           1HB      SER  12 -18.309  11.466  -8.198
   82    HG   SER  12           HG       SER  12 -19.811  13.845  -7.908
   83    H    GLY  13           H        GLY  13 -19.033  11.629 -11.787
   84    HA2  GLY  13           2HA      GLY  13 -19.374   8.741 -11.907
   85    HA3  GLY  13           1HA      GLY  13 -18.866   9.787 -13.224
   86    H    LEU  14           H        LEU  14 -16.698  11.070 -12.151
   87    HA   LEU  14           HA       LEU  14 -14.713   9.007 -12.299
   88    HB2  LEU  14           2HB      LEU  14 -14.520  11.982 -11.851
   89    HB3  LEU  14           1HB      LEU  14 -13.122  10.932 -11.968
   90    HG   LEU  14           HG       LEU  14 -13.443  11.999 -14.088
   91   HD11  LEU  14          1HD1      LEU  14 -12.760   9.629 -14.099
   92   HD12  LEU  14          2HD1      LEU  14 -13.650  10.089 -15.551
   93   HD13  LEU  14          3HD1      LEU  14 -14.452   9.164 -14.280
   94   HD21  LEU  14          3HD2      LEU  14 -16.174  10.791 -14.344
   95   HD22  LEU  14          1HD2      LEU  14 -15.444  12.098 -15.276
   96   HD23  LEU  14          2HD2      LEU  14 -15.943  12.377 -13.608
   97    H    VAL  15           H        VAL  15 -15.204   7.763 -10.422
   98    HA   VAL  15           HA       VAL  15 -14.873   7.074  -8.278
   99    HB   VAL  15           HB       VAL  15 -12.965   9.398  -8.028
  100   HG11  VAL  15          1HG1      VAL  15 -11.865   8.024  -6.362
  101   HG12  VAL  15          2HG1      VAL  15 -13.023   6.724  -6.636
  102   HG13  VAL  15          3HG1      VAL  15 -13.561   8.250  -5.935
  103   HG21  VAL  15          3HG2      VAL  15 -12.618   6.704  -9.305
  104   HG22  VAL  15          1HG2      VAL  15 -11.248   7.603  -8.652
  105   HG23  VAL  15          2HG2      VAL  15 -12.218   8.294  -9.954
  106    HA   PRO  16           HA       PRO  16 -18.070  10.060  -6.783
  107    HB2  PRO  16           2HB      PRO  16 -18.621   7.596  -5.196
  108    HB3  PRO  16           1HB      PRO  16 -19.748   8.672  -6.032
  109    HG2  PRO  16           2HG      PRO  16 -19.126   6.299  -7.062
  110    HG3  PRO  16           1HG      PRO  16 -19.328   7.719  -8.105
  111    HD2  PRO  16           2HD      PRO  16 -16.826   6.354  -7.220
  112    HD3  PRO  16           1HD      PRO  16 -17.200   7.136  -8.770
  113    H    ARG  17           H        ARG  17 -18.770  10.336  -4.346
  114    HA   ARG  17           HA       ARG  17 -16.518  11.237  -2.937
  115    HB2  ARG  17           2HB      ARG  17 -19.157  11.724  -2.744
  116    HB3  ARG  17           1HB      ARG  17 -18.971  10.620  -1.388
  117    HG2  ARG  17           2HG      ARG  17 -18.734  12.818  -0.543
  118    HG3  ARG  17           1HG      ARG  17 -17.125  12.093  -0.556
  119    HD2  ARG  17           2HD      ARG  17 -16.856  14.281  -1.398
  120    HD3  ARG  17           1HD      ARG  17 -16.784  13.212  -2.798
  121    HE   ARG  17           HE       ARG  17 -18.702  14.179  -3.594
  122   HH11  ARG  17          1HH1      ARG  17 -18.312  15.039  -0.234
  123   HH12  ARG  17          2HH1      ARG  17 -19.611  16.185  -0.248
  124   HH21  ARG  17          1HH2      ARG  17 -20.409  15.685  -3.614
  125   HH22  ARG  17          2HH2      ARG  17 -20.801  16.552  -2.166
  126    H    GLY  18           H        GLY  18 -18.767   8.686  -1.847
  127    HA2  GLY  18           2HA      GLY  18 -18.409   6.783  -0.617
  128    HA3  GLY  18           1HA      GLY  18 -16.837   6.711  -1.401
  129    H    SER  19           H        SER  19 -16.877   5.757   1.057
  130    HA   SER  19           HA       SER  19 -15.160   7.563   2.485
  131    HB2  SER  19           2HB      SER  19 -17.760   7.939   3.088
  132    HB3  SER  19           1HB      SER  19 -17.386   6.632   4.211
  133    HG   SER  19           HG       SER  19 -16.534   8.126   5.403
  134    H    HIS  20           H        HIS  20 -15.034   4.917   1.287
  135    HA   HIS  20           HA       HIS  20 -13.558   3.581   3.265
  136    HB2  HIS  20           2HB      HIS  20 -16.160   3.211   3.814
  137    HB3  HIS  20           1HB      HIS  20 -15.935   1.904   2.658
  138    HD1  HIS  20           1HD      HIS  20 -16.584   0.825   5.249
  139    HD2  HIS  20           2HD      HIS  20 -12.688   1.985   4.386
  140    HE1  HIS  20           1HE      HIS  20 -15.136  -0.410   6.893
  141    HE2  HIS  20           2HE      HIS  20 -12.776   0.242   6.296
  142    H    MET  21           H        MET  21 -13.266   4.341   0.552
  143    HA   MET  21           HA       MET  21 -12.964   1.702  -0.726
  144    HB2  MET  21           2HB      MET  21 -13.956   4.290  -1.795
  145    HB3  MET  21           1HB      MET  21 -12.942   3.326  -2.860
  146    HG2  MET  21           2HG      MET  21 -15.321   2.895  -3.203
  147    HG3  MET  21           1HG      MET  21 -14.455   1.455  -2.670
  148    HE1  MET  21           3HE      MET  21 -16.593   0.120  -0.133
  149    HE2  MET  21           1HE      MET  21 -15.451  -0.035  -1.468
  150    HE3  MET  21           2HE      MET  21 -17.146   0.331  -1.794
  151    H    SER  22           H        SER  22 -11.705   5.032  -1.014
  152    HA   SER  22           HA       SER  22  -9.064   3.906  -1.552
  153    HB2  SER  22           2HB      SER  22 -10.265   5.713  -3.036
  154    HB3  SER  22           1HB      SER  22  -9.646   6.825  -1.817
  155    HG   SER  22           HG       SER  22  -8.112   6.649  -3.416
  156    H    ASP  23           H        ASP  23 -10.661   4.703   1.051
  157    HA   ASP  23           HA       ASP  23  -8.889   6.472   2.391
  158    HB2  ASP  23           2HB      ASP  23 -10.929   4.586   3.536
  159    HB3  ASP  23           1HB      ASP  23 -10.162   5.913   4.409
  160    H    GLU  24           H        GLU  24  -8.769   3.274   1.645
  161    HA   GLU  24           HA       GLU  24  -7.358   2.221   3.834
  162    HB2  GLU  24           2HB      GLU  24  -8.523   0.898   2.016
  163    HB3  GLU  24           1HB      GLU  24  -7.130   1.250   1.002
  164    HG2  GLU  24           2HG      GLU  24  -6.443   0.127   3.609
  165    HG3  GLU  24           1HG      GLU  24  -7.418  -0.941   2.600
  166    H    LYS  25           H        LYS  25  -6.482   4.304   1.436
  167    HA   LYS  25           HA       LYS  25  -3.628   3.749   1.580
  168    HB2  LYS  25           2HB      LYS  25  -4.586   4.269  -0.612
  169    HB3  LYS  25           1HB      LYS  25  -5.156   5.818  -0.011
  170    HG2  LYS  25           2HG      LYS  25  -2.252   5.188   0.158
  171    HG3  LYS  25           1HG      LYS  25  -2.948   5.643  -1.399
  172    HD2  LYS  25           2HD      LYS  25  -4.014   7.549   0.192
  173    HD3  LYS  25           1HD      LYS  25  -2.481   7.264   1.019
  174    HE2  LYS  25           2HE      LYS  25  -2.942   8.150  -1.816
  175    HE3  LYS  25           1HE      LYS  25  -2.063   8.987  -0.537
  176    HZ1  LYS  25           3HZ      LYS  25  -0.670   6.730  -0.691
  177    HZ2  LYS  25           1HZ      LYS  25  -0.302   8.110  -1.602
  178    HZ3  LYS  25           2HZ      LYS  25  -1.188   6.848  -2.297
  179    H    THR  26           H        THR  26  -5.997   5.994   2.779
  180    HA   THR  26           HA       THR  26  -4.277   8.079   3.534
  181    HB   THR  26           HB       THR  26  -6.383   8.002   5.406
  182    HG1  THR  26           1HG      THR  26  -7.933   7.006   4.438
  183   HG21  THR  26          3HG2      THR  26  -7.227   9.567   3.258
  184   HG22  THR  26          1HG2      THR  26  -5.463   9.675   3.260
  185   HG23  THR  26          2HG2      THR  26  -6.380  10.100   4.710
  186    H    GLN  27           H        GLN  27  -5.006   5.015   5.011
  187    HA   GLN  27           HA       GLN  27  -4.089   5.556   7.616
  188    HB2  GLN  27           2HB      GLN  27  -4.348   3.074   5.956
  189    HB3  GLN  27           1HB      GLN  27  -3.481   2.999   7.482
  190    HG2  GLN  27           2HG      GLN  27  -5.516   3.974   8.575
  191    HG3  GLN  27           1HG      GLN  27  -6.355   3.754   7.040
  192   HE21  GLN  27          1HE2      GLN  27  -7.720   2.136   7.357
  193   HE22  GLN  27          2HE2      GLN  27  -7.314   0.587   8.006
  194    H    LEU  28           H        LEU  28  -2.476   5.124   4.608
  195    HA   LEU  28           HA       LEU  28   0.121   4.678   5.783
  196    HB2  LEU  28           2HB      LEU  28  -0.697   3.619   3.637
  197    HB3  LEU  28           1HB      LEU  28  -0.544   5.208   2.912
  198    HG   LEU  28           HG       LEU  28   1.878   4.220   4.277
  199   HD11  LEU  28          1HD1      LEU  28   0.634   2.293   2.907
  200   HD12  LEU  28          2HD1      LEU  28   2.390   2.459   2.954
  201   HD13  LEU  28          3HD1      LEU  28   1.481   3.086   1.578
  202   HD21  LEU  28          3HD2      LEU  28   2.662   4.983   1.849
  203   HD22  LEU  28          1HD2      LEU  28   2.349   6.133   3.150
  204   HD23  LEU  28          2HD2      LEU  28   1.122   5.839   1.916
  205    H    ILE  29           H        ILE  29  -1.792   7.230   5.071
  206    HA   ILE  29           HA       ILE  29   0.008   9.169   4.178
  207    HB   ILE  29           HB       ILE  29  -2.544   9.470   5.698
  208   HG12  ILE  29          2HG1      ILE  29  -2.524   8.422   3.377
  209   HG13  ILE  29          1HG1      ILE  29  -3.620   9.774   3.638
  210   HG21  ILE  29          1HG2      ILE  29  -1.625  11.538   6.098
  211   HG22  ILE  29          2HG2      ILE  29  -2.423  11.835   4.554
  212   HG23  ILE  29          3HG2      ILE  29  -0.687  11.530   4.604
  213   HD11  ILE  29          3HD1      ILE  29  -1.712   9.467   1.632
  214   HD12  ILE  29          1HD1      ILE  29  -1.108  10.739   2.693
  215   HD13  ILE  29          2HD1      ILE  29  -2.718  10.875   1.975
  216    H    GLU  30           H        GLU  30  -0.315   7.734   7.053
  217    HA   GLU  30           HA       GLU  30   0.655   9.820   8.733
  218    HB2  GLU  30           2HB      GLU  30  -0.007   6.951   9.137
  219    HB3  GLU  30           1HB      GLU  30   1.039   7.728  10.315
  220    HG2  GLU  30           2HG      GLU  30  -0.630   9.293  10.907
  221    HG3  GLU  30           1HG      GLU  30  -1.635   8.842   9.529
  222    H    ALA  31           H        ALA  31   2.114   8.251   6.428
  223    HA   ALA  31           HA       ALA  31   4.668   7.802   7.766
  224    HB1  ALA  31           1HB      ALA  31   5.306   6.530   5.965
  225    HB2  ALA  31           2HB      ALA  31   4.318   7.447   4.828
  226    HB3  ALA  31           3HB      ALA  31   3.559   6.294   5.927
  227    H    PHE  32           H        PHE  32   3.090  10.045   5.627
  228    HA   PHE  32           HA       PHE  32   5.290  11.327   4.493
  229    HB2  PHE  32           2HB      PHE  32   2.464  12.063   5.036
  230    HB3  PHE  32           1HB      PHE  32   3.578  13.379   4.683
  231    HD1  PHE  32           1HD      PHE  32   4.852  13.344   2.525
  232    HD2  PHE  32           2HD      PHE  32   1.643  10.672   3.335
  233    HE1  PHE  32           1HE      PHE  32   4.632  12.886   0.118
  234    HE2  PHE  32           2HE      PHE  32   1.416  10.207   0.930
  235    HZ   PHE  32           HZ       PHE  32   2.913  11.315  -0.682
  236    H    TYR  33           H        TYR  33   4.153  11.363   7.742
  237    HA   TYR  33           HA       TYR  33   5.612  13.804   8.385
  238    HB2  TYR  33           2HB      TYR  33   3.961  12.006  10.170
  239    HB3  TYR  33           1HB      TYR  33   4.633  13.570  10.619
  240    HD1  TYR  33           2HD      TYR  33   2.308  11.979   8.179
  241    HD2  TYR  33           1HD      TYR  33   3.371  15.502  10.314
  242    HE1  TYR  33           2HE      TYR  33   0.265  13.081   7.366
  243    HE2  TYR  33           1HE      TYR  33   1.332  16.614   9.508
  244    HH   TYR  33           HH       TYR  33  -1.234  15.009   8.175
  245    H    ASN  34           H        ASN  34   6.913  11.216   7.582
  246    HA   ASN  34           HA       ASN  34   9.118  11.331   9.312
  247    HB2  ASN  34           2HB      ASN  34   7.519  10.199  10.862
  248    HB3  ASN  34           1HB      ASN  34   7.408   8.867   9.715
  249   HD21  ASN  34          1HD2      ASN  34  10.056  10.806  11.072
  250   HD22  ASN  34          2HD2      ASN  34  11.010   9.456  11.576
  251    H    PHE  35           H        PHE  35   8.508  11.249   6.503
  252    HA   PHE  35           HA       PHE  35  10.582   9.638   5.566
  253    HB2  PHE  35           2HB      PHE  35   9.109   7.748   6.089
  254    HB3  PHE  35           1HB      PHE  35   7.837   8.451   5.095
  255    HD1  PHE  35           1HD      PHE  35  11.477   8.133   4.409
  256    HD2  PHE  35           2HD      PHE  35   7.526   6.948   3.363
  257    HE1  PHE  35           1HE      PHE  35  12.359   6.939   2.446
  258    HE2  PHE  35           2HE      PHE  35   8.400   5.751   1.400
  259    HZ   PHE  35           HZ       PHE  35  10.820   5.745   0.939
  260    H    ASP  36           H        ASP  36  10.767  11.826   4.692
  261    HA   ASP  36           HA       ASP  36   8.957  12.416   2.466
  262    HB2  ASP  36           2HB      ASP  36   9.577  14.154   4.234
  263    HB3  ASP  36           1HB      ASP  36  11.173  14.189   3.487
  264    H    GLY  37           H        GLY  37  11.103  10.315   2.457
  265    HA2  GLY  37           2HA      GLY  37  12.216   9.492   0.549
  266    HA3  GLY  37           1HA      GLY  37  12.283  11.126  -0.090
  267    H    ASP  38           H        ASP  38  13.299  12.078   2.594
  268    HA   ASP  38           HA       ASP  38  15.301  12.521   3.576
  269    HB2  ASP  38           2HB      ASP  38  15.104   9.901   3.801
  270    HB3  ASP  38           1HB      ASP  38  16.432   9.912   2.645
  271    H    TYR  39           H        TYR  39  14.822  13.107   0.718
  272    HA   TYR  39           HA       TYR  39  15.925  13.953  -1.082
  273    HB2  TYR  39           2HB      TYR  39  17.817  14.348   1.181
  274    HB3  TYR  39           1HB      TYR  39  18.436  14.602  -0.447
  275    HD1  TYR  39           2HD      TYR  39  15.747  15.658   1.892
  276    HD2  TYR  39           1HD      TYR  39  18.013  16.610  -1.582
  277    HE1  TYR  39           2HE      TYR  39  14.773  17.916   1.882
  278    HE2  TYR  39           1HE      TYR  39  17.045  18.870  -1.601
  279    HH   TYR  39           HH       TYR  39  14.946  19.983  -0.738
  280    H    ASP  40           H        ASP  40  15.735  11.714  -1.933
  281    HA   ASP  40           HA       ASP  40  18.105  10.912  -3.193
  282    HB2  ASP  40           2HB      ASP  40  17.549   9.639  -0.598
  283    HB3  ASP  40           1HB      ASP  40  17.855   8.508  -1.912
  284    H    GLY  41           H        GLY  41  14.960   9.847  -1.975
  285    HA2  GLY  41           2HA      GLY  41  13.150   9.038  -3.174
  286    HA3  GLY  41           1HA      GLY  41  14.106   9.176  -4.641
  287    H    PHE  42           H        PHE  42  15.291   7.415  -1.880
  288    HA   PHE  42           HA       PHE  42  14.415   4.856  -2.919
  289    HB2  PHE  42           2HB      PHE  42  17.295   5.736  -2.985
  290    HB3  PHE  42           1HB      PHE  42  16.844   4.035  -2.935
  291    HD1  PHE  42           2HD      PHE  42  15.364   3.138  -4.785
  292    HD2  PHE  42           1HD      PHE  42  17.316   6.913  -4.998
  293    HE1  PHE  42           2HE      PHE  42  15.089   3.137  -7.231
  294    HE2  PHE  42           1HE      PHE  42  17.045   6.920  -7.443
  295    HZ   PHE  42           HZ       PHE  42  15.931   5.030  -8.562
  296    H    VAL  43           H        VAL  43  13.925   3.606  -1.249
  297    HA   VAL  43           HA       VAL  43  15.370   4.017   1.289
  298    HB   VAL  43           HB       VAL  43  13.078   4.875   1.454
  299   HG11  VAL  43          1HG1      VAL  43  11.248   3.806   0.723
  300   HG12  VAL  43          2HG1      VAL  43  11.796   2.245   1.334
  301   HG13  VAL  43          3HG1      VAL  43  12.387   2.841  -0.217
  302   HG21  VAL  43          3HG2      VAL  43  14.142   3.892   3.429
  303   HG22  VAL  43          1HG2      VAL  43  13.478   2.314   3.004
  304   HG23  VAL  43          2HG2      VAL  43  12.397   3.638   3.444
  305    H    SER  44           H        SER  44  16.391   2.279   2.031
  306    HA   SER  44           HA       SER  44  16.249  -0.220   0.678
  307    HB2  SER  44           2HB      SER  44  17.799  -0.994   2.488
  308    HB3  SER  44           1HB      SER  44  18.343   0.470   1.666
  309    HG   SER  44           HG       SER  44  18.096   1.571   3.455
  310    H    VAL  45           H        VAL  45  15.966  -2.300   1.947
  311    HA   VAL  45           HA       VAL  45  13.322  -2.351   3.019
  312    HB   VAL  45           HB       VAL  45  15.373  -4.567   3.010
  313   HG11  VAL  45          1HG1      VAL  45  13.823  -5.670   4.157
  314   HG12  VAL  45          2HG1      VAL  45  12.828  -5.630   2.704
  315   HG13  VAL  45          3HG1      VAL  45  12.639  -4.383   3.938
  316   HG21  VAL  45          3HG2      VAL  45  14.830  -5.113   0.864
  317   HG22  VAL  45          1HG2      VAL  45  14.619  -3.365   0.777
  318   HG23  VAL  45          2HG2      VAL  45  13.215  -4.414   0.976
  319    H    GLU  46           H        GLU  46  16.537  -2.296   4.355
  320    HA   GLU  46           HA       GLU  46  15.791  -3.137   6.986
  321    HB2  GLU  46           2HB      GLU  46  18.248  -1.543   6.271
  322    HB3  GLU  46           1HB      GLU  46  18.034  -2.667   7.606
  323    HG2  GLU  46           2HG      GLU  46  17.870  -4.516   5.991
  324    HG3  GLU  46           1HG      GLU  46  18.166  -3.372   4.682
  325    H    GLU  47           H        GLU  47  16.691   0.015   5.583
  326    HA   GLU  47           HA       GLU  47  16.228   1.561   7.864
  327    HB2  GLU  47           2HB      GLU  47  17.301   2.184   5.571
  328    HB3  GLU  47           1HB      GLU  47  15.657   2.607   5.109
  329    HG2  GLU  47           2HG      GLU  47  15.645   4.470   6.355
  330    HG3  GLU  47           1HG      GLU  47  16.549   3.722   7.672
  331    H    PHE  48           H        PHE  48  14.049   0.320   5.434
  332    HA   PHE  48           HA       PHE  48  11.799   1.900   5.951
  333    HB2  PHE  48           2HB      PHE  48  12.418  -0.237   4.288
  334    HB3  PHE  48           1HB      PHE  48  11.152  -0.876   5.329
  335    HD1  PHE  48           1HD      PHE  48   9.566   1.625   5.750
  336    HD2  PHE  48           2HD      PHE  48  11.322  -0.039   2.249
  337    HE1  PHE  48           1HE      PHE  48   7.868   2.750   4.369
  338    HE2  PHE  48           2HE      PHE  48   9.629   1.085   0.861
  339    HZ   PHE  48           HZ       PHE  48   7.899   2.481   1.921
  340    H    ARG  49           H        ARG  49  13.045  -0.968   7.554
  341    HA   ARG  49           HA       ARG  49  10.832  -1.636   9.112
  342    HB2  ARG  49           2HB      ARG  49  13.400  -2.579   8.839
  343    HB3  ARG  49           1HB      ARG  49  13.412  -1.938  10.477
  344    HG2  ARG  49           2HG      ARG  49  12.567  -3.899  11.093
  345    HG3  ARG  49           1HG      ARG  49  11.051  -3.344  10.383
  346    HD2  ARG  49           2HD      ARG  49  11.565  -4.417   8.300
  347    HD3  ARG  49           1HD      ARG  49  13.187  -4.820   8.856
  348    HE   ARG  49           HE       ARG  49  12.318  -6.658   9.883
  349   HH11  ARG  49          1HH1      ARG  49   9.726  -4.389   9.318
  350   HH12  ARG  49          2HH1      ARG  49   8.491  -5.470   9.870
  351   HH21  ARG  49          1HH2      ARG  49  10.695  -8.081  10.610
  352   HH22  ARG  49          2HH2      ARG  49   9.041  -7.567  10.604
  353    H    GLY  50           H        GLY  50  13.583   0.484   9.925
  354    HA2  GLY  50           2HA      GLY  50  12.783   1.224  12.483
  355    HA3  GLY  50           1HA      GLY  50  13.750   2.227  11.411
  356    H    ILE  51           H        ILE  51  11.508   2.211   9.411
  357    HA   ILE  51           HA       ILE  51  10.064   4.460  10.564
  358    HB   ILE  51           HB       ILE  51   9.903   3.387   7.747
  359   HG12  ILE  51          2HG1      ILE  51  11.521   5.771   8.624
  360   HG13  ILE  51          1HG1      ILE  51  12.215   4.153   8.593
  361   HG21  ILE  51          1HG2      ILE  51   8.894   5.452   7.173
  362   HG22  ILE  51          2HG2      ILE  51   9.258   6.149   8.752
  363   HG23  ILE  51          3HG2      ILE  51   8.054   4.867   8.607
  364   HD11  ILE  51          3HD1      ILE  51  12.837   4.922   6.541
  365   HD12  ILE  51          1HD1      ILE  51  11.387   5.908   6.346
  366   HD13  ILE  51          2HD1      ILE  51  11.299   4.159   6.135
  367    H    ILE  52           H        ILE  52   9.435   1.261   9.208
  368    HA   ILE  52           HA       ILE  52   6.592   1.454   9.432
  369    HB   ILE  52           HB       ILE  52   8.380  -0.954   9.072
  370   HG12  ILE  52          2HG1      ILE  52   8.404   0.723   7.234
  371   HG13  ILE  52          1HG1      ILE  52   7.738  -0.831   6.738
  372   HG21  ILE  52          1HG2      ILE  52   6.407  -1.832   9.970
  373   HG22  ILE  52          2HG2      ILE  52   6.204  -1.994   8.226
  374   HG23  ILE  52          3HG2      ILE  52   5.391  -0.689   9.091
  375   HD11  ILE  52          3HD1      ILE  52   5.520   0.567   7.564
  376   HD12  ILE  52          1HD1      ILE  52   6.051   0.340   5.898
  377   HD13  ILE  52          2HD1      ILE  52   6.513   1.796   6.779
  378    H    ARG  53           H        ARG  53   9.174   0.473  11.549
  379    HA   ARG  53           HA       ARG  53   7.913  -1.189  13.343
  380    HB2  ARG  53           2HB      ARG  53  10.338  -0.426  13.337
  381    HB3  ARG  53           1HB      ARG  53   9.793   1.015  14.183
  382    HG2  ARG  53           2HG      ARG  53   9.457  -0.085  16.129
  383    HG3  ARG  53           1HG      ARG  53   8.968  -1.579  15.329
  384    HD2  ARG  53           2HD      ARG  53  11.103  -2.347  15.152
  385    HD3  ARG  53           1HD      ARG  53  11.789  -0.729  15.013
  386    HE   ARG  53           HE       ARG  53  12.057  -0.687  17.284
  387   HH11  ARG  53          1HH1      ARG  53   9.846  -3.261  16.463
  388   HH12  ARG  53          2HH1      ARG  53   9.796  -3.899  18.071
  389   HH21  ARG  53          1HH2      ARG  53  11.992  -1.526  19.400
  390   HH22  ARG  53          2HH2      ARG  53  11.015  -2.914  19.739
  391    H    ASP  54           H        ASP  54   8.169   2.355  13.669
  392    HA   ASP  54           HA       ASP  54   5.766   2.274  15.368
  393    HB2  ASP  54           2HB      ASP  54   8.023   4.286  15.299
  394    HB3  ASP  54           1HB      ASP  54   6.570   4.454  16.277
  395    H    GLY  55           H        GLY  55   6.233   2.606  12.297
  396    HA2  GLY  55           2HA      GLY  55   4.930   5.207  11.934
  397    HA3  GLY  55           1HA      GLY  55   5.648   4.228  10.665
  398    H    LEU  56           H        LEU  56   4.486   2.414   9.861
  399    HA   LEU  56           HA       LEU  56   1.590   2.735  10.173
  400    HB2  LEU  56           2HB      LEU  56   2.989   1.127   8.052
  401    HB3  LEU  56           1HB      LEU  56   1.344   1.735   8.037
  402    HG   LEU  56           HG       LEU  56   3.722   3.579   8.023
  403   HD11  LEU  56          1HD1      LEU  56   3.728   3.632   5.679
  404   HD12  LEU  56          2HD1      LEU  56   2.217   2.726   5.570
  405   HD13  LEU  56          3HD1      LEU  56   3.694   1.918   6.093
  406   HD21  LEU  56          3HD2      LEU  56   1.798   4.770   8.595
  407   HD22  LEU  56          1HD2      LEU  56   0.784   3.849   7.484
  408   HD23  LEU  56          2HD2      LEU  56   1.947   5.017   6.854
  409    HA   PRO  57           HA       PRO  57   1.492  -1.157  12.324
  410    HB2  PRO  57           2HB      PRO  57  -1.166  -1.460  12.516
  411    HB3  PRO  57           1HB      PRO  57  -0.312  -0.209  13.427
  412    HG2  PRO  57           2HG      PRO  57  -1.883   0.033  10.892
  413    HG3  PRO  57           1HG      PRO  57  -1.859   1.109  12.301
  414    HD2  PRO  57           2HD      PRO  57  -0.455   1.574   9.988
  415    HD3  PRO  57           1HD      PRO  57   0.013   2.208  11.578
  416    H    MET  58           H        MET  58   2.289  -1.702   9.874
  417    HA   MET  58           HA       MET  58   0.330  -3.339   8.490
  418    HB2  MET  58           2HB      MET  58   2.733  -1.971   7.773
  419    HB3  MET  58           1HB      MET  58   2.938  -3.675   7.395
  420    HG2  MET  58           2HG      MET  58   1.109  -3.681   5.927
  421    HG3  MET  58           1HG      MET  58   0.516  -2.135   6.532
  422    HE1  MET  58           3HE      MET  58   2.285  -3.803   3.644
  423    HE2  MET  58           1HE      MET  58   3.583  -3.860   4.835
  424    HE3  MET  58           2HE      MET  58   3.752  -2.859   3.393
  425    H    THR  59           H        THR  59   0.374  -5.546   8.340
  426    HA   THR  59           HA       THR  59   1.698  -6.954  10.468
  427    HB   THR  59           HB       THR  59   0.617  -8.897   8.838
  428    HG1  THR  59           1HG      THR  59  -1.166  -6.706   8.742
  429   HG21  THR  59          3HG2      THR  59   0.241  -8.463  11.306
  430   HG22  THR  59          1HG2      THR  59  -1.123  -9.097  10.386
  431   HG23  THR  59          2HG2      THR  59  -1.062  -7.386  10.806
  432    H    GLU  60           H        GLU  60   3.240  -8.592  10.277
  433    HA   GLU  60           HA       GLU  60   5.457  -8.252   8.790
  434    HB2  GLU  60           2HB      GLU  60   5.627 -10.881   8.880
  435    HB3  GLU  60           1HB      GLU  60   5.727  -9.924  10.350
  436    HG2  GLU  60           2HG      GLU  60   3.428 -10.412  10.874
  437    HG3  GLU  60           1HG      GLU  60   3.216 -11.242   9.331
  438    H    ALA  61           H        ALA  61   2.726 -10.261   7.820
  439    HA   ALA  61           HA       ALA  61   3.622 -11.242   5.422
  440    HB1  ALA  61           1HB      ALA  61   1.539 -12.027   5.232
  441    HB2  ALA  61           2HB      ALA  61   0.828 -10.416   5.329
  442    HB3  ALA  61           3HB      ALA  61   1.257 -11.282   6.806
  443    H    GLU  62           H        GLU  62   1.809  -8.209   5.938
  444    HA   GLU  62           HA       GLU  62   1.814  -7.332   3.291
  445    HB2  GLU  62           2HB      GLU  62   2.212  -5.223   5.331
  446    HB3  GLU  62           1HB      GLU  62   1.004  -5.346   4.063
  447    HG2  GLU  62           2HG      GLU  62   0.990  -6.661   6.755
  448    HG3  GLU  62           1HG      GLU  62  -0.116  -5.435   6.145
  449    H    ILE  63           H        ILE  63   4.011  -6.272   5.879
  450    HA   ILE  63           HA       ILE  63   5.832  -4.912   4.244
  451    HB   ILE  63           HB       ILE  63   6.686  -6.369   6.735
  452   HG12  ILE  63          2HG1      ILE  63   5.951  -3.860   7.588
  453   HG13  ILE  63          1HG1      ILE  63   4.661  -4.268   6.459
  454   HG21  ILE  63          1HG2      ILE  63   8.116  -4.836   5.062
  455   HG22  ILE  63          2HG2      ILE  63   8.432  -4.937   6.795
  456   HG23  ILE  63          3HG2      ILE  63   7.496  -3.591   6.145
  457   HD11  ILE  63          3HD1      ILE  63   3.729  -5.331   8.161
  458   HD12  ILE  63          1HD1      ILE  63   5.213  -5.298   9.111
  459   HD13  ILE  63          2HD1      ILE  63   4.956  -6.570   7.913
  460    H    THR  64           H        THR  64   6.292  -8.116   5.722
  461    HA   THR  64           HA       THR  64   8.608  -8.855   4.419
  462    HB   THR  64           HB       THR  64   6.294 -10.579   5.283
  463    HG1  THR  64           1HG      THR  64   7.175  -9.473   7.004
  464   HG21  THR  64          3HG2      THR  64   9.115 -11.368   4.632
  465   HG22  THR  64          1HG2      THR  64   7.636 -11.912   3.842
  466   HG23  THR  64          2HG2      THR  64   7.970 -12.382   5.510
  467    H    GLU  65           H        GLU  65   5.260  -9.601   3.432
  468    HA   GLU  65           HA       GLU  65   6.014 -10.867   1.033
  469    HB2  GLU  65           2HB      GLU  65   3.762 -11.042   2.188
  470    HB3  GLU  65           1HB      GLU  65   3.395  -9.473   1.485
  471    HG2  GLU  65           2HG      GLU  65   2.554 -10.632  -0.218
  472    HG3  GLU  65           1HG      GLU  65   4.232 -10.890  -0.693
  473    H    PHE  66           H        PHE  66   5.992  -7.715   1.956
  474    HA   PHE  66           HA       PHE  66   5.834  -6.673  -0.745
  475    HB2  PHE  66           2HB      PHE  66   5.730  -5.428   1.968
  476    HB3  PHE  66           1HB      PHE  66   6.254  -4.443   0.611
  477    HD1  PHE  66           1HD      PHE  66   3.758  -7.116   0.258
  478    HD2  PHE  66           2HD      PHE  66   4.406  -2.934   0.717
  479    HE1  PHE  66           1HE      PHE  66   1.411  -6.689  -0.344
  480    HE2  PHE  66           2HE      PHE  66   2.060  -2.500   0.115
  481    HZ   PHE  66           HZ       PHE  66   0.559  -4.380  -0.415
  482    H    PHE  67           H        PHE  67   8.097  -7.344   1.801
  483    HA   PHE  67           HA       PHE  67  10.258  -5.830   0.630
  484    HB2  PHE  67           2HB      PHE  67  10.028  -7.744   2.937
  485    HB3  PHE  67           1HB      PHE  67  11.602  -7.206   2.365
  486    HD1  PHE  67           2HD      PHE  67   9.858  -4.415   1.677
  487    HD2  PHE  67           1HD      PHE  67  10.985  -6.715   5.083
  488    HE1  PHE  67           2HE      PHE  67   9.671  -2.414   3.091
  489    HE2  PHE  67           1HE      PHE  67  10.798  -4.711   6.497
  490    HZ   PHE  67           HZ       PHE  67  10.143  -2.560   5.501
  491    H    GLU  68           H        GLU  68   8.963  -9.020   0.336
  492    HA   GLU  68           HA       GLU  68  11.367 -10.019  -0.983
  493    HB2  GLU  68           2HB      GLU  68   8.765 -11.481  -0.533
  494    HB3  GLU  68           1HB      GLU  68  10.329 -12.179  -0.931
  495    HG2  GLU  68           2HG      GLU  68  10.023 -10.601   1.578
  496    HG3  GLU  68           1HG      GLU  68   9.427 -12.259   1.507
  497    H    ALA  69           H        ALA  69   8.174  -8.849  -1.700
  498    HA   ALA  69           HA       ALA  69   8.283  -9.769  -4.442
  499    HB1  ALA  69           1HB      ALA  69   6.205  -8.086  -3.086
  500    HB2  ALA  69           2HB      ALA  69   6.161  -9.847  -3.197
  501    HB3  ALA  69           3HB      ALA  69   6.050  -8.866  -4.661
  502    H    ALA  70           H        ALA  70   9.309  -7.187  -2.720
  503    HA   ALA  70           HA       ALA  70   9.169  -5.292  -4.943
  504    HB1  ALA  70           1HB      ALA  70  10.129  -4.827  -2.121
  505    HB2  ALA  70           2HB      ALA  70   8.500  -4.498  -2.711
  506    HB3  ALA  70           3HB      ALA  70   9.871  -3.599  -3.360
  507    H    ASP  71           H        ASP  71  11.401  -7.285  -3.183
  508    HA   ASP  71           HA       ASP  71  13.600  -6.250  -4.847
  509    HB2  ASP  71           2HB      ASP  71  13.664  -5.923  -2.258
  510    HB3  ASP  71           1HB      ASP  71  14.082  -7.633  -2.229
  511    HA   PRO  72           HA       PRO  72  13.005 -10.553  -6.291
  512    HB2  PRO  72           2HB      PRO  72  14.483 -10.181  -8.571
  513    HB3  PRO  72           1HB      PRO  72  12.758  -9.823  -8.444
  514    HG2  PRO  72           2HG      PRO  72  15.099  -7.969  -8.255
  515    HG3  PRO  72           1HG      PRO  72  13.545  -7.734  -9.077
  516    HD2  PRO  72           2HD      PRO  72  14.069  -6.622  -6.684
  517    HD3  PRO  72           1HD      PRO  72  12.444  -7.197  -7.113
  518    H    ASN  73           H        ASN  73  15.940  -8.643  -6.008
  519    HA   ASN  73           HA       ASN  73  17.668 -10.958  -6.092
  520    HB2  ASN  73           2HB      ASN  73  18.382  -8.136  -5.283
  521    HB3  ASN  73           1HB      ASN  73  19.484  -9.407  -5.805
  522   HD21  ASN  73          1HD2      ASN  73  19.803  -7.196  -7.109
  523   HD22  ASN  73          2HD2      ASN  73  19.092  -7.233  -8.683
  524    H    ASN  74           H        ASN  74  16.063  -9.020  -3.706
  525    HA   ASN  74           HA       ASN  74  15.751  -9.333  -1.475
  526    HB2  ASN  74           2HB      ASN  74  17.571 -11.736  -1.583
  527    HB3  ASN  74           1HB      ASN  74  16.297 -11.383  -0.417
  528   HD21  ASN  74          1HD2      ASN  74  17.086 -12.802  -3.413
  529   HD22  ASN  74          2HD2      ASN  74  15.500 -13.333  -3.843
  530    H    THR  75           H        THR  75  17.688  -7.624  -2.466
  531    HA   THR  75           HA       THR  75  20.037  -7.961  -0.788
  532    HB   THR  75           HB       THR  75  20.619  -7.205  -2.934
  533    HG1  THR  75           1HG      THR  75  21.599  -5.951  -1.288
  534   HG21  THR  75          3HG2      THR  75  18.333  -5.281  -2.713
  535   HG22  THR  75          1HG2      THR  75  18.613  -6.528  -3.930
  536   HG23  THR  75          2HG2      THR  75  19.629  -5.086  -3.892
  537    H    GLY  76           H        GLY  76  17.382  -7.480   0.380
  538    HA2  GLY  76           2HA      GLY  76  16.341  -6.150   1.933
  539    HA3  GLY  76           1HA      GLY  76  17.980  -5.857   2.497
  540    H    PHE  77           H        PHE  77  16.808  -4.908  -0.651
  541    HA   PHE  77           HA       PHE  77  16.663  -2.114   0.225
  542    HB2  PHE  77           2HB      PHE  77  18.726  -1.903  -0.730
  543    HB3  PHE  77           1HB      PHE  77  18.516  -3.321  -1.749
  544    HD1  PHE  77           2HD      PHE  77  17.306   0.186  -1.398
  545    HD2  PHE  77           1HD      PHE  77  18.236  -3.044  -4.010
  546    HE1  PHE  77           2HE      PHE  77  16.902   1.644  -3.339
  547    HE2  PHE  77           1HE      PHE  77  17.835  -1.589  -5.957
  548    HZ   PHE  77           HZ       PHE  77  17.166   0.758  -5.622
  549    H    ILE  78           H        ILE  78  14.916  -1.084  -0.505
  550    HA   ILE  78           HA       ILE  78  13.252  -2.441  -2.511
  551    HB   ILE  78           HB       ILE  78  12.546  -0.286  -0.511
  552   HG12  ILE  78          2HG1      ILE  78  11.698  -3.178  -0.697
  553   HG13  ILE  78          1HG1      ILE  78  12.818  -2.510   0.491
  554   HG21  ILE  78          1HG2      ILE  78  10.749  -1.691  -2.484
  555   HG22  ILE  78          2HG2      ILE  78  11.265  -0.006  -2.579
  556   HG23  ILE  78          3HG2      ILE  78  10.239  -0.540  -1.250
  557   HD11  ILE  78          3HD1      ILE  78  10.023  -2.728   0.659
  558   HD12  ILE  78          1HD1      ILE  78  10.390  -1.006   0.520
  559   HD13  ILE  78          2HD1      ILE  78  11.125  -1.966   1.808
  560    H    ASP  79           H        ASP  79  12.309  -1.301  -4.206
  561    HA   ASP  79           HA       ASP  79  13.806   1.063  -5.060
  562    HB2  ASP  79           2HB      ASP  79  12.281  -1.080  -6.433
  563    HB3  ASP  79           1HB      ASP  79  12.122   0.530  -7.129
  564    H    TYR  80           H        TYR  80  12.923   2.689  -3.858
  565    HA   TYR  80           HA       TYR  80  10.589   3.194  -2.780
  566    HB2  TYR  80           2HB      TYR  80  12.422   4.848  -2.929
  567    HB3  TYR  80           1HB      TYR  80  11.931   5.227  -4.577
  568    HD1  TYR  80           2HD      TYR  80  10.244   4.913  -1.248
  569    HD2  TYR  80           1HD      TYR  80  10.776   7.201  -4.795
  570    HE1  TYR  80           2HE      TYR  80   8.674   6.599  -0.388
  571    HE2  TYR  80           1HE      TYR  80   9.209   8.894  -3.943
  572    HH   TYR  80           HH       TYR  80   7.209   8.850  -2.219
  573    H    LYS  81           H        LYS  81  11.068   3.415  -6.286
  574    HA   LYS  81           HA       LYS  81   8.475   4.377  -6.877
  575    HB2  LYS  81           2HB      LYS  81  10.704   3.162  -8.428
  576    HB3  LYS  81           1HB      LYS  81   9.107   3.131  -9.163
  577    HG2  LYS  81           2HG      LYS  81   8.958   5.474  -9.200
  578    HG3  LYS  81           1HG      LYS  81  10.316   5.656  -8.085
  579    HD2  LYS  81           2HD      LYS  81  10.901   4.209 -10.586
  580    HD3  LYS  81           1HD      LYS  81  10.514   5.922 -10.767
  581    HE2  LYS  81           2HE      LYS  81  12.312   6.585  -9.417
  582    HE3  LYS  81           1HE      LYS  81  12.514   4.969  -8.742
  583    HZ1  LYS  81           3HZ      LYS  81  14.222   5.594 -10.401
  584    HZ2  LYS  81           1HZ      LYS  81  13.016   5.650 -11.587
  585    HZ3  LYS  81           2HZ      LYS  81  13.372   4.190 -10.810
  586    H    ALA  82           H        ALA  82   9.849   1.093  -7.138
  587    HA   ALA  82           HA       ALA  82   7.544  -0.265  -7.859
  588    HB1  ALA  82           1HB      ALA  82   8.816  -2.095  -7.636
  589    HB2  ALA  82           2HB      ALA  82   9.175  -1.748  -5.944
  590    HB3  ALA  82           3HB      ALA  82  10.119  -0.982  -7.222
  591    H    PHE  83           H        PHE  83   8.491   1.053  -4.795
  592    HA   PHE  83           HA       PHE  83   6.389  -0.334  -3.347
  593    HB2  PHE  83           2HB      PHE  83   8.878   0.822  -2.661
  594    HB3  PHE  83           1HB      PHE  83   7.640   1.746  -1.812
  595    HD1  PHE  83           2HD      PHE  83   8.270  -1.836  -2.634
  596    HD2  PHE  83           1HD      PHE  83   7.235   1.037   0.329
  597    HE1  PHE  83           2HE      PHE  83   8.111  -3.627  -0.962
  598    HE2  PHE  83           1HE      PHE  83   7.073  -0.753   2.012
  599    HZ   PHE  83           HZ       PHE  83   7.511  -3.090   1.367
  600    H    ALA  84           H        ALA  84   7.102   2.823  -4.674
  601    HA   ALA  84           HA       ALA  84   4.884   4.134  -3.399
  602    HB1  ALA  84           1HB      ALA  84   6.786   4.959  -5.576
  603    HB2  ALA  84           2HB      ALA  84   6.729   5.517  -3.903
  604    HB3  ALA  84           3HB      ALA  84   5.456   5.982  -5.033
  605    H    ALA  85           H        ALA  85   5.381   2.326  -6.309
  606    HA   ALA  85           HA       ALA  85   3.148   3.345  -7.732
  607    HB1  ALA  85           1HB      ALA  85   5.061   2.266  -8.846
  608    HB2  ALA  85           2HB      ALA  85   3.518   1.535  -9.289
  609    HB3  ALA  85           3HB      ALA  85   4.572   0.733  -8.122
  610    H    MET  86           H        MET  86   3.409   1.379  -5.132
  611    HA   MET  86           HA       MET  86   1.192  -0.371  -5.588
  612    HB2  MET  86           2HB      MET  86   2.576   0.363  -3.001
  613    HB3  MET  86           1HB      MET  86   1.438  -0.960  -3.212
  614    HG2  MET  86           2HG      MET  86   3.129  -1.725  -5.052
  615    HG3  MET  86           1HG      MET  86   4.251  -0.710  -4.149
  616    HE1  MET  86           3HE      MET  86   3.778  -4.730  -3.996
  617    HE2  MET  86           1HE      MET  86   2.594  -3.686  -4.782
  618    HE3  MET  86           2HE      MET  86   2.183  -4.508  -3.277
  619    H    LEU  87           H        LEU  87   1.681   2.709  -3.950
  620    HA   LEU  87           HA       LEU  87  -1.067   2.799  -3.079
  621    HB2  LEU  87           2HB      LEU  87   1.163   4.779  -2.834
  622    HB3  LEU  87           1HB      LEU  87  -0.428   5.009  -2.133
  623    HG   LEU  87           HG       LEU  87   0.966   2.519  -1.359
  624   HD11  LEU  87          1HD1      LEU  87   2.601   3.433  -0.034
  625   HD12  LEU  87          2HD1      LEU  87   1.813   5.010   0.040
  626   HD13  LEU  87          3HD1      LEU  87   2.656   4.514  -1.427
  627   HD21  LEU  87          3HD2      LEU  87  -1.292   3.575  -0.551
  628   HD22  LEU  87          1HD2      LEU  87  -0.233   4.519   0.497
  629   HD23  LEU  87          2HD2      LEU  87  -0.224   2.757   0.590
  630    H    TYR  88           H        TYR  88   0.528   3.439  -5.760
  631    HA   TYR  88           HA       TYR  88  -1.499   5.333  -6.733
  632    HB2  TYR  88           2HB      TYR  88   1.459   5.290  -7.332
  633    HB3  TYR  88           1HB      TYR  88   0.302   6.175  -8.321
  634    HD1  TYR  88           1HD      TYR  88  -1.308   7.769  -6.905
  635    HD2  TYR  88           2HD      TYR  88   2.539   6.449  -5.659
  636    HE1  TYR  88           1HE      TYR  88  -1.150   9.690  -5.377
  637    HE2  TYR  88           2HE      TYR  88   2.708   8.365  -4.126
  638    HH   TYR  88           HH       TYR  88   1.525  10.841  -4.140
  639    H    SER  89           H        SER  89  -1.196   2.337  -6.831
  640    HA   SER  89           HA       SER  89  -0.659   1.651  -9.550
  641    HB2  SER  89           2HB      SER  89  -0.725   0.192  -7.306
  642    HB3  SER  89           1HB      SER  89  -2.362  -0.126  -7.878
  643    HG   SER  89           HG       SER  89  -1.502  -1.476  -9.221
  644    H    VAL  90           H        VAL  90  -1.927   2.734 -10.985
  645    HA   VAL  90           HA       VAL  90  -4.696   1.903 -11.151
  646    HB   VAL  90           HB       VAL  90  -4.846   3.917  -9.749
  647   HG11  VAL  90          1HG1      VAL  90  -3.867   5.549 -12.064
  648   HG12  VAL  90          2HG1      VAL  90  -2.750   4.937 -10.843
  649   HG13  VAL  90          3HG1      VAL  90  -4.063   6.019 -10.375
  650   HG21  VAL  90          3HG2      VAL  90  -5.929   4.936 -12.288
  651   HG22  VAL  90          1HG2      VAL  90  -6.740   4.607 -10.758
  652   HG23  VAL  90          2HG2      VAL  90  -6.390   3.286 -11.873
  653    H    ASP  91           H        ASP  91  -2.734   1.130 -12.817
  654    HA   ASP  91           HA       ASP  91  -3.659   2.019 -15.345
  655    HB2  ASP  91           2HB      ASP  91  -1.912   3.805 -14.432
  656    HB3  ASP  91           1HB      ASP  91  -0.753   2.632 -15.053
  657    H    GLU  92           H        GLU  92  -2.746   0.813 -17.107
  658    HA   GLU  92           HA       GLU  92  -0.724  -1.143 -16.709
  659    HB2  GLU  92           2HB      GLU  92  -2.350  -3.104 -17.114
  660    HB3  GLU  92           1HB      GLU  92  -2.220  -2.453 -15.487
  661    HG2  GLU  92           2HG      GLU  92  -4.241  -0.990 -16.180
  662    HG3  GLU  92           1HG      GLU  92  -4.446  -2.188 -17.458
  663    H    SER  93           H        SER  93  -3.746  -0.685 -18.550
  664    HA   SER  93           HA       SER  93  -2.309  -1.360 -21.006
  665    HB2  SER  93           2HB      SER  93  -4.833  -1.017 -21.859
  666    HB3  SER  93           1HB      SER  93  -4.266  -2.533 -21.158
  667    HG   SER  93           HG       SER  93  -6.120  -1.996 -20.087
  Start of MODEL    4
    1    H1   MET   1           1HT      MET   1  -4.621   7.072 -36.842
    2    H2   MET   1           2HT      MET   1  -4.024   8.206 -37.985
    3    H3   MET   1           3HT      MET   1  -5.706   8.123 -37.651
    4    HA   MET   1           HA       MET   1  -3.526   9.142 -35.984
    5    HB2  MET   1           2HB      MET   1  -4.963  11.106 -35.909
    6    HB3  MET   1           1HB      MET   1  -4.678  10.634 -37.578
    7    HG2  MET   1           2HG      MET   1  -6.853  10.567 -37.932
    8    HG3  MET   1           1HG      MET   1  -7.016   9.303 -36.715
    9    HE1  MET   1           2HE      MET   1  -7.670  13.058 -37.591
   10    HE2  MET   1           3HE      MET   1  -9.115  13.108 -36.581
   11    HE3  MET   1           1HE      MET   1  -8.917  11.825 -37.775
   12    H    GLY   2           H        GLY   2  -6.609   7.510 -35.946
   13    HA2  GLY   2           2HA      GLY   2  -7.815   6.592 -34.222
   14    HA3  GLY   2           1HA      GLY   2  -6.372   6.771 -33.234
   15    H    SER   3           H        SER   3  -9.402   7.329 -32.938
   16    HA   SER   3           HA       SER   3  -9.278  10.145 -32.152
   17    HB2  SER   3           2HB      SER   3 -11.729   9.945 -31.857
   18    HB3  SER   3           1HB      SER   3 -11.219   9.478 -33.479
   19    HG   SER   3           HG       SER   3 -12.063   7.840 -31.346
   20    H    SER   4           H        SER   4 -10.904  10.417 -30.094
   21    HA   SER   4           HA       SER   4  -9.597   8.870 -27.968
   22    HB2  SER   4           2HB      SER   4 -10.301  10.739 -26.475
   23    HB3  SER   4           1HB      SER   4  -9.239  11.262 -27.782
   24    HG   SER   4           HG       SER   4 -11.047  12.648 -27.522
   25    H    HIS   5           H        HIS   5 -12.694  10.611 -28.099
   26    HA   HIS   5           HA       HIS   5 -14.804  10.015 -27.495
   27    HB2  HIS   5           2HB      HIS   5 -13.687   7.524 -28.673
   28    HB3  HIS   5           1HB      HIS   5 -15.182   7.378 -27.756
   29    HD1  HIS   5           1HD      HIS   5 -14.047   7.927 -31.075
   30    HD2  HIS   5           2HD      HIS   5 -17.166   9.433 -28.781
   31    HE1  HIS   5           1HE      HIS   5 -15.699   8.866 -32.721
   32    HE2  HIS   5           2HE      HIS   5 -17.618   9.692 -31.314
   33    H    HIS   6           H        HIS   6 -15.235  10.269 -25.406
   34    HA   HIS   6           HA       HIS   6 -14.452   8.122 -23.555
   35    HB2  HIS   6           2HB      HIS   6 -14.025   9.816 -21.809
   36    HB3  HIS   6           1HB      HIS   6 -12.932   9.989 -23.179
   37    HD1  HIS   6           1HD      HIS   6 -14.809  11.997 -20.987
   38    HD2  HIS   6           2HD      HIS   6 -14.178  12.046 -25.093
   39    HE1  HIS   6           1HE      HIS   6 -15.375  14.333 -21.725
   40    HE2  HIS   6           2HE      HIS   6 -15.068  14.314 -24.225
   41    H    HIS   7           H        HIS   7 -15.662   8.716 -21.312
   42    HA   HIS   7           HA       HIS   7 -18.241   9.865 -21.520
   43    HB2  HIS   7           2HB      HIS   7 -19.497   7.670 -21.195
   44    HB3  HIS   7           1HB      HIS   7 -18.904   8.000 -22.820
   45    HD1  HIS   7           1HD      HIS   7 -18.729   5.556 -23.517
   46    HD2  HIS   7           2HD      HIS   7 -16.556   6.450 -20.090
   47    HE1  HIS   7           1HE      HIS   7 -17.291   3.538 -23.087
   48    HE2  HIS   7           2HE      HIS   7 -16.050   4.067 -20.960
   49    H    HIS   8           H        HIS   8 -16.001   9.936 -19.750
   50    HA   HIS   8           HA       HIS   8 -17.328   9.060 -17.277
   51    HB2  HIS   8           2HB      HIS   8 -14.978   8.688 -16.352
   52    HB3  HIS   8           1HB      HIS   8 -15.574   7.489 -17.495
   53    HD1  HIS   8           1HD      HIS   8 -13.277  10.502 -17.394
   54    HD2  HIS   8           2HD      HIS   8 -13.974   7.095 -19.670
   55    HE1  HIS   8           1HE      HIS   8 -11.398  10.412 -19.064
   56    HE2  HIS   8           2HE      HIS   8 -11.890   8.391 -20.486
   57    H    HIS   9           H        HIS   9 -17.463  11.614 -18.518
   58    HA   HIS   9           HA       HIS   9 -17.367  13.816 -17.968
   59    HB2  HIS   9           2HB      HIS   9 -16.846  12.444 -15.397
   60    HB3  HIS   9           1HB      HIS   9 -16.361  14.134 -15.474
   61    HD1  HIS   9           1HD      HIS   9 -19.475  12.277 -16.664
   62    HD2  HIS   9           2HD      HIS   9 -18.365  15.616 -14.452
   63    HE1  HIS   9           1HE      HIS   9 -21.630  13.374 -15.973
   64    HE2  HIS   9           2HE      HIS   9 -20.932  15.438 -14.711
   65    H    HIS  10           H        HIS  10 -14.585  12.794 -16.016
   66    HA   HIS  10           HA       HIS  10 -12.772  13.994 -17.975
   67    HB2  HIS  10           2HB      HIS  10 -13.227  14.932 -15.176
   68    HB3  HIS  10           1HB      HIS  10 -11.593  14.995 -15.826
   69    HD1  HIS  10           1HD      HIS  10 -15.057  16.108 -16.966
   70    HD2  HIS  10           2HD      HIS  10 -11.093  17.348 -17.043
   71    HE1  HIS  10           1HE      HIS  10 -15.079  18.359 -18.085
   72    HE2  HIS  10           2HE      HIS  10 -12.680  19.130 -18.038
   73    H    SER  11           H        SER  11 -12.345  12.943 -14.607
   74    HA   SER  11           HA       SER  11 -11.320  10.392 -15.168
   75    HB2  SER  11           2HB      SER  11  -9.357  12.642 -15.222
   76    HB3  SER  11           1HB      SER  11  -8.867  11.128 -14.460
   77    HG   SER  11           HG       SER  11  -8.393  11.244 -16.730
   78    H    SER  12           H        SER  12 -13.022  11.627 -13.270
   79    HA   SER  12           HA       SER  12 -13.511  11.584 -11.049
   80    HB2  SER  12           2HB      SER  12 -12.220   9.259 -11.527
   81    HB3  SER  12           1HB      SER  12 -11.139   9.962 -10.326
   82    HG   SER  12           HG       SER  12 -13.774   9.099 -10.068
   83    H    GLY  13           H        GLY  13 -12.062  11.598  -8.749
   84    HA2  GLY  13           2HA      GLY  13  -9.845  12.775  -8.140
   85    HA3  GLY  13           1HA      GLY  13 -10.562  14.114  -9.023
   86    H    LEU  14           H        LEU  14 -12.443  15.136  -8.167
   87    HA   LEU  14           HA       LEU  14 -12.360  15.556  -5.399
   88    HB2  LEU  14           2HB      LEU  14 -13.444  16.893  -7.452
   89    HB3  LEU  14           1HB      LEU  14 -14.892  16.118  -6.838
   90    HG   LEU  14           HG       LEU  14 -14.555  17.148  -4.654
   91   HD11  LEU  14          1HD1      LEU  14 -12.737  19.069  -4.757
   92   HD12  LEU  14          2HD1      LEU  14 -11.970  17.943  -5.877
   93   HD13  LEU  14          3HD1      LEU  14 -12.338  17.434  -4.228
   94   HD21  LEU  14          3HD2      LEU  14 -14.926  19.490  -5.304
   95   HD22  LEU  14          1HD2      LEU  14 -15.861  18.368  -6.293
   96   HD23  LEU  14          2HD2      LEU  14 -14.396  19.106  -6.941
   97    H    VAL  15           H        VAL  15 -15.106  14.167  -7.207
   98    HA   VAL  15           HA       VAL  15 -15.500  12.259  -5.007
   99    HB   VAL  15           HB       VAL  15 -17.998  12.591  -5.321
  100   HG11  VAL  15          1HG1      VAL  15 -16.646  13.425  -3.389
  101   HG12  VAL  15          2HG1      VAL  15 -18.104  14.360  -3.722
  102   HG13  VAL  15          3HG1      VAL  15 -16.528  14.978  -4.217
  103   HG21  VAL  15          3HG2      VAL  15 -17.536  15.357  -6.213
  104   HG22  VAL  15          1HG2      VAL  15 -18.849  14.245  -6.593
  105   HG23  VAL  15          2HG2      VAL  15 -17.309  14.115  -7.443
  106    HA   PRO  16           HA       PRO  16 -15.250   9.941  -8.997
  107    HB2  PRO  16           2HB      PRO  16 -15.070   7.797  -6.931
  108    HB3  PRO  16           1HB      PRO  16 -14.113   8.028  -8.399
  109    HG2  PRO  16           2HG      PRO  16 -13.092   8.609  -6.011
  110    HG3  PRO  16           1HG      PRO  16 -12.755   9.634  -7.418
  111    HD2  PRO  16           2HD      PRO  16 -14.598  10.111  -5.120
  112    HD3  PRO  16           1HD      PRO  16 -13.605  11.267  -6.031
  113    H    ARG  17           H        ARG  17 -16.802   8.426  -6.160
  114    HA   ARG  17           HA       ARG  17 -19.438   8.674  -7.097
  115    HB2  ARG  17           2HB      ARG  17 -18.066   6.789  -8.558
  116    HB3  ARG  17           1HB      ARG  17 -18.853   5.811  -7.326
  117    HG2  ARG  17           2HG      ARG  17 -20.217   7.729  -9.207
  118    HG3  ARG  17           1HG      ARG  17 -20.218   5.967  -9.326
  119    HD2  ARG  17           2HD      ARG  17 -21.679   5.715  -7.593
  120    HD3  ARG  17           1HD      ARG  17 -21.129   7.174  -6.773
  121    HE   ARG  17           HE       ARG  17 -22.361   8.091  -9.023
  122   HH11  ARG  17          1HH1      ARG  17 -23.318   6.021  -6.382
  123   HH12  ARG  17          2HH1      ARG  17 -24.986   6.475  -6.465
  124   HH21  ARG  17          1HH2      ARG  17 -24.556   8.691  -9.135
  125   HH22  ARG  17          2HH2      ARG  17 -25.689   7.991  -8.029
  126    H    GLY  18           H        GLY  18 -18.012   8.938  -4.656
  127    HA2  GLY  18           2HA      GLY  18 -18.350   8.520  -2.423
  128    HA3  GLY  18           1HA      GLY  18 -19.800   7.643  -2.892
  129    H    SER  19           H        SER  19 -16.287   7.159  -3.293
  130    HA   SER  19           HA       SER  19 -16.621   4.319  -2.801
  131    HB2  SER  19           2HB      SER  19 -15.099   4.783  -4.552
  132    HB3  SER  19           1HB      SER  19 -14.278   6.034  -3.617
  133    HG   SER  19           HG       SER  19 -12.987   4.261  -3.509
  134    H    HIS  20           H        HIS  20 -16.133   3.272  -0.966
  135    HA   HIS  20           HA       HIS  20 -14.727   4.755   1.150
  136    HB2  HIS  20           2HB      HIS  20 -17.380   3.420   1.230
  137    HB3  HIS  20           1HB      HIS  20 -16.346   3.220   2.642
  138    HD1  HIS  20           1HD      HIS  20 -18.619   4.658   3.506
  139    HD2  HIS  20           2HD      HIS  20 -15.640   6.663   1.416
  140    HE1  HIS  20           1HE      HIS  20 -18.936   7.092   4.054
  141    HE2  HIS  20           2HE      HIS  20 -17.070   8.276   2.845
  142    H    MET  21           H        MET  21 -13.729   2.799  -0.755
  143    HA   MET  21           HA       MET  21 -12.925   0.691   1.141
  144    HB2  MET  21           2HB      MET  21 -12.765  -0.875  -0.717
  145    HB3  MET  21           1HB      MET  21 -14.391  -0.216  -0.610
  146    HG2  MET  21           2HG      MET  21 -13.866   1.344  -2.426
  147    HG3  MET  21           1HG      MET  21 -12.253   0.643  -2.546
  148    HE1  MET  21           3HE      MET  21 -15.852   0.395  -2.749
  149    HE2  MET  21           1HE      MET  21 -16.244  -1.262  -3.212
  150    HE3  MET  21           2HE      MET  21 -15.922  -0.051  -4.455
  151    H    SER  22           H        SER  22 -11.830   3.384  -0.231
  152    HA   SER  22           HA       SER  22  -9.209   2.311  -0.946
  153    HB2  SER  22           2HB      SER  22  -8.855   4.799  -1.669
  154    HB3  SER  22           1HB      SER  22  -9.836   3.735  -2.677
  155    HG   SER  22           HG       SER  22 -11.625   4.751  -2.044
  156    H    ASP  23           H        ASP  23 -10.623   3.169   1.742
  157    HA   ASP  23           HA       ASP  23  -8.833   5.051   2.875
  158    HB2  ASP  23           2HB      ASP  23 -10.666   3.109   4.250
  159    HB3  ASP  23           1HB      ASP  23  -9.906   4.506   5.006
  160    H    GLU  24           H        GLU  24  -8.603   1.840   2.219
  161    HA   GLU  24           HA       GLU  24  -6.981   0.928   4.317
  162    HB2  GLU  24           2HB      GLU  24  -7.176  -0.050   1.481
  163    HB3  GLU  24           1HB      GLU  24  -6.332  -0.905   2.764
  164    HG2  GLU  24           2HG      GLU  24  -8.327  -1.371   3.914
  165    HG3  GLU  24           1HG      GLU  24  -9.240  -0.199   2.964
  166    H    LYS  25           H        LYS  25  -6.378   2.981   1.804
  167    HA   LYS  25           HA       LYS  25  -3.497   2.571   1.782
  168    HB2  LYS  25           2HB      LYS  25  -4.603   2.962  -0.364
  169    HB3  LYS  25           1HB      LYS  25  -5.222   4.502   0.220
  170    HG2  LYS  25           2HG      LYS  25  -2.280   3.999   0.194
  171    HG3  LYS  25           1HG      LYS  25  -3.119   4.438  -1.297
  172    HD2  LYS  25           2HD      LYS  25  -4.116   6.275   0.447
  173    HD3  LYS  25           1HD      LYS  25  -2.475   6.066   1.062
  174    HE2  LYS  25           2HE      LYS  25  -2.726   7.880  -0.640
  175    HE3  LYS  25           1HE      LYS  25  -1.530   6.649  -1.048
  176    HZ1  LYS  25           3HZ      LYS  25  -3.359   7.477  -2.753
  177    HZ2  LYS  25           1HZ      LYS  25  -4.242   6.228  -2.030
  178    HZ3  LYS  25           2HZ      LYS  25  -2.759   5.896  -2.772
  179    H    THR  26           H        THR  26  -5.901   4.826   2.953
  180    HA   THR  26           HA       THR  26  -4.274   7.002   3.535
  181    HB   THR  26           HB       THR  26  -6.164   6.886   5.606
  182    HG1  THR  26           1HG      THR  26  -7.324   5.268   4.742
  183   HG21  THR  26          3HG2      THR  26  -7.367   8.227   3.486
  184   HG22  THR  26          1HG2      THR  26  -5.630   8.456   3.256
  185   HG23  THR  26          2HG2      THR  26  -6.393   8.924   4.780
  186    H    GLN  27           H        GLN  27  -4.533   3.937   5.123
  187    HA   GLN  27           HA       GLN  27  -3.430   4.661   7.621
  188    HB2  GLN  27           2HB      GLN  27  -3.776   2.135   6.088
  189    HB3  GLN  27           1HB      GLN  27  -2.566   2.128   7.364
  190    HG2  GLN  27           2HG      GLN  27  -4.657   3.264   8.652
  191    HG3  GLN  27           1HG      GLN  27  -5.493   2.190   7.531
  192   HE21  GLN  27          1HE2      GLN  27  -3.620   0.132   7.407
  193   HE22  GLN  27          2HE2      GLN  27  -3.567  -0.662   8.941
  194    H    LEU  28           H        LEU  28  -2.122   4.280   4.470
  195    HA   LEU  28           HA       LEU  28   0.621   4.094   5.350
  196    HB2  LEU  28           2HB      LEU  28  -0.160   2.845   3.382
  197    HB3  LEU  28           1HB      LEU  28  -0.570   4.362   2.607
  198    HG   LEU  28           HG       LEU  28   1.627   3.135   1.954
  199   HD11  LEU  28          1HD1      LEU  28   0.766   5.756   1.812
  200   HD12  LEU  28          2HD1      LEU  28   2.107   5.037   0.920
  201   HD13  LEU  28          3HD1      LEU  28   2.409   5.880   2.439
  202   HD21  LEU  28          3HD2      LEU  28   2.917   4.747   4.077
  203   HD22  LEU  28          1HD2      LEU  28   3.445   3.253   3.303
  204   HD23  LEU  28          2HD2      LEU  28   2.202   3.206   4.553
  205    H    ILE  29           H        ILE  29  -1.591   6.442   4.813
  206    HA   ILE  29           HA       ILE  29  -0.078   8.518   3.707
  207    HB   ILE  29           HB       ILE  29  -2.482   8.622   5.476
  208   HG12  ILE  29          2HG1      ILE  29  -2.616   7.531   3.188
  209   HG13  ILE  29          1HG1      ILE  29  -3.783   8.805   3.527
  210   HG21  ILE  29          1HG2      ILE  29  -1.160  10.854   3.939
  211   HG22  ILE  29          2HG2      ILE  29  -1.402  10.748   5.683
  212   HG23  ILE  29          3HG2      ILE  29  -2.788  10.950   4.612
  213   HD11  ILE  29          3HD1      ILE  29  -1.353   8.927   1.784
  214   HD12  ILE  29          1HD1      ILE  29  -2.239  10.363   2.301
  215   HD13  ILE  29          2HD1      ILE  29  -3.050   9.130   1.336
  216    H    GLU  30           H        GLU  30   0.015   7.124   6.619
  217    HA   GLU  30           HA       GLU  30   0.963   9.325   8.161
  218    HB2  GLU  30           2HB      GLU  30   0.866   6.377   8.742
  219    HB3  GLU  30           1HB      GLU  30   1.517   7.549   9.879
  220    HG2  GLU  30           2HG      GLU  30  -0.831   8.698   9.466
  221    HG3  GLU  30           1HG      GLU  30  -1.286   7.044   9.062
  222    H    ALA  31           H        ALA  31   2.321   7.818   5.756
  223    HA   ALA  31           HA       ALA  31   5.014   7.590   6.858
  224    HB1  ALA  31           1HB      ALA  31   3.713   6.724   4.319
  225    HB2  ALA  31           2HB      ALA  31   4.692   5.799   5.458
  226    HB3  ALA  31           3HB      ALA  31   5.464   6.941   4.359
  227    H    PHE  32           H        PHE  32   3.190   9.482   4.497
  228    HA   PHE  32           HA       PHE  32   5.292  10.977   3.431
  229    HB2  PHE  32           2HB      PHE  32   2.401  11.755   3.849
  230    HB3  PHE  32           1HB      PHE  32   3.540  12.651   2.851
  231    HD1  PHE  32           1HD      PHE  32   4.789  11.140   1.050
  232    HD2  PHE  32           2HD      PHE  32   1.010  10.267   2.803
  233    HE1  PHE  32           1HE      PHE  32   4.230   9.710  -0.874
  234    HE2  PHE  32           2HE      PHE  32   0.445   8.837   0.882
  235    HZ   PHE  32           HZ       PHE  32   2.056   8.556  -0.959
  236    H    TYR  33           H        TYR  33   3.575  11.280   6.451
  237    HA   TYR  33           HA       TYR  33   4.891  13.833   7.022
  238    HB2  TYR  33           2HB      TYR  33   2.809  12.339   8.630
  239    HB3  TYR  33           1HB      TYR  33   3.407  13.961   8.961
  240    HD1  TYR  33           1HD      TYR  33   1.676  11.971   6.326
  241    HD2  TYR  33           2HD      TYR  33   2.297  15.803   8.070
  242    HE1  TYR  33           1HE      TYR  33  -0.086  12.905   4.887
  243    HE2  TYR  33           2HE      TYR  33   0.536  16.746   6.637
  244    HH   TYR  33           HH       TYR  33  -0.781  15.052   3.983
  245    H    ASN  34           H        ASN  34   6.338  11.268   6.908
  246    HA   ASN  34           HA       ASN  34   8.031  11.604   9.102
  247    HB2  ASN  34           2HB      ASN  34   5.741   9.821   9.564
  248    HB3  ASN  34           1HB      ASN  34   7.301   9.090   9.932
  249   HD21  ASN  34          1HD2      ASN  34   8.746  11.146  10.893
  250   HD22  ASN  34          2HD2      ASN  34   8.032  11.765  12.339
  251    H    PHE  35           H        PHE  35   8.310  11.279   6.355
  252    HA   PHE  35           HA       PHE  35  10.402   9.424   6.200
  253    HB2  PHE  35           2HB      PHE  35   8.611   7.742   6.267
  254    HB3  PHE  35           1HB      PHE  35   7.843   8.498   4.874
  255    HD1  PHE  35           2HD      PHE  35  11.421   7.704   5.528
  256    HD2  PHE  35           1HD      PHE  35   7.969   6.967   3.151
  257    HE1  PHE  35           2HE      PHE  35  12.760   6.285   4.027
  258    HE2  PHE  35           1HE      PHE  35   9.301   5.548   1.647
  259    HZ   PHE  35           HZ       PHE  35  11.699   5.207   2.085
  260    H    ASP  36           H        ASP  36  11.137  11.497   5.369
  261    HA   ASP  36           HA       ASP  36  11.821  12.855   3.679
  262    HB2  ASP  36           2HB      ASP  36  10.791  10.583   1.967
  263    HB3  ASP  36           1HB      ASP  36  11.742  11.937   1.363
  264    H    GLY  37           H        GLY  37   9.923  14.124   4.563
  265    HA2  GLY  37           2HA      GLY  37   7.435  14.219   3.288
  266    HA3  GLY  37           1HA      GLY  37   8.169  15.549   4.169
  267    H    ASP  38           H        ASP  38  10.513  15.550   2.336
  268    HA   ASP  38           HA       ASP  38   9.449  16.215  -0.259
  269    HB2  ASP  38           2HB      ASP  38  10.335  18.580  -0.152
  270    HB3  ASP  38           1HB      ASP  38   8.884  18.278   0.799
  271    H    TYR  39           H        TYR  39  11.351  14.341   0.611
  272    HA   TYR  39           HA       TYR  39  13.481  14.894  -1.161
  273    HB2  TYR  39           2HB      TYR  39  13.902  16.147   1.208
  274    HB3  TYR  39           1HB      TYR  39  14.650  14.588   1.536
  275    HD1  TYR  39           2HD      TYR  39  14.606  17.265  -1.069
  276    HD2  TYR  39           1HD      TYR  39  16.864  14.269   0.940
  277    HE1  TYR  39           2HE      TYR  39  16.625  17.988  -2.272
  278    HE2  TYR  39           1HE      TYR  39  18.890  14.985  -0.257
  279    HH   TYR  39           HH       TYR  39  19.023  17.891  -2.071
  280    H    ASP  40           H        ASP  40  12.799  12.864  -1.920
  281    HA   ASP  40           HA       ASP  40  13.746  10.607  -0.284
  282    HB2  ASP  40           2HB      ASP  40  11.905   9.253  -1.400
  283    HB3  ASP  40           1HB      ASP  40  11.380  10.426  -0.196
  284    H    GLY  41           H        GLY  41  13.706   8.552  -1.907
  285    HA2  GLY  41           2HA      GLY  41  14.313   8.888  -4.606
  286    HA3  GLY  41           1HA      GLY  41  15.824   9.036  -3.721
  287    H    PHE  42           H        PHE  42  15.967   7.204  -1.928
  288    HA   PHE  42           HA       PHE  42  14.904   4.668  -2.843
  289    HB2  PHE  42           2HB      PHE  42  17.603   5.544  -3.482
  290    HB3  PHE  42           1HB      PHE  42  17.604   4.047  -2.556
  291    HD1  PHE  42           1HD      PHE  42  16.274   5.654  -5.611
  292    HD2  PHE  42           2HD      PHE  42  17.038   2.006  -3.559
  293    HE1  PHE  42           1HE      PHE  42  15.744   4.397  -7.658
  294    HE2  PHE  42           2HE      PHE  42  16.510   0.741  -5.602
  295    HZ   PHE  42           HZ       PHE  42  15.862   1.936  -7.655
  296    H    VAL  43           H        VAL  43  14.364   3.518  -1.118
  297    HA   VAL  43           HA       VAL  43  15.854   3.957   1.388
  298    HB   VAL  43           HB       VAL  43  13.595   4.895   1.537
  299   HG11  VAL  43          1HG1      VAL  43  11.873   3.919   0.541
  300   HG12  VAL  43          2HG1      VAL  43  12.004   2.552   1.647
  301   HG13  VAL  43          3HG1      VAL  43  12.882   2.537   0.118
  302   HG21  VAL  43          3HG2      VAL  43  14.697   3.857   3.513
  303   HG22  VAL  43          1HG2      VAL  43  13.806   2.370   3.176
  304   HG23  VAL  43          2HG2      VAL  43  12.935   3.847   3.594
  305    H    SER  44           H        SER  44  16.560   2.197   2.474
  306    HA   SER  44           HA       SER  44  16.294  -0.374   1.144
  307    HB2  SER  44           2HB      SER  44  17.872   0.059   3.662
  308    HB3  SER  44           1HB      SER  44  18.185  -1.053   2.330
  309    HG   SER  44           HG       SER  44  18.525   0.953   1.060
  310    H    VAL  45           H        VAL  45  15.456  -2.227   2.073
  311    HA   VAL  45           HA       VAL  45  13.184  -2.040   3.625
  312    HB   VAL  45           HB       VAL  45  15.045  -4.408   3.401
  313   HG11  VAL  45          1HG1      VAL  45  13.174  -5.781   4.031
  314   HG12  VAL  45          2HG1      VAL  45  12.128  -4.368   4.151
  315   HG13  VAL  45          3HG1      VAL  45  13.458  -4.579   5.288
  316   HG21  VAL  45          3HG2      VAL  45  13.509  -5.154   1.633
  317   HG22  VAL  45          1HG2      VAL  45  14.300  -3.629   1.230
  318   HG23  VAL  45          2HG2      VAL  45  12.625  -3.635   1.780
  319    H    GLU  46           H        GLU  46  16.393  -3.144   4.722
  320    HA   GLU  46           HA       GLU  46  15.883  -3.535   7.384
  321    HB2  GLU  46           2HB      GLU  46  18.399  -2.207   6.387
  322    HB3  GLU  46           1HB      GLU  46  18.217  -3.252   7.787
  323    HG2  GLU  46           2HG      GLU  46  17.538  -5.064   6.122
  324    HG3  GLU  46           1HG      GLU  46  18.190  -3.990   4.885
  325    H    GLU  47           H        GLU  47  16.234  -0.509   5.683
  326    HA   GLU  47           HA       GLU  47  16.260   1.054   8.132
  327    HB2  GLU  47           2HB      GLU  47  17.455   1.591   5.863
  328    HB3  GLU  47           1HB      GLU  47  15.883   2.225   5.398
  329    HG2  GLU  47           2HG      GLU  47  15.980   3.639   7.489
  330    HG3  GLU  47           1HG      GLU  47  17.670   3.152   7.625
  331    H    PHE  48           H        PHE  48  14.040   0.020   5.659
  332    HA   PHE  48           HA       PHE  48  11.943   1.842   6.201
  333    HB2  PHE  48           2HB      PHE  48  12.423  -0.090   4.308
  334    HB3  PHE  48           1HB      PHE  48  11.138  -0.823   5.260
  335    HD1  PHE  48           1HD      PHE  48   9.696   1.736   6.008
  336    HD2  PHE  48           2HD      PHE  48  11.266   0.318   2.316
  337    HE1  PHE  48           1HE      PHE  48   8.037   3.084   4.791
  338    HE2  PHE  48           2HE      PHE  48   9.610   1.665   1.089
  339    HZ   PHE  48           HZ       PHE  48   7.993   3.050   2.327
  340    H    ARG  49           H        ARG  49  12.752  -1.361   7.450
  341    HA   ARG  49           HA       ARG  49  10.430  -1.890   8.889
  342    HB2  ARG  49           2HB      ARG  49  13.261  -2.634   9.648
  343    HB3  ARG  49           1HB      ARG  49  11.797  -3.404  10.241
  344    HG2  ARG  49           2HG      ARG  49  11.292  -3.973   7.821
  345    HG3  ARG  49           1HG      ARG  49  12.953  -3.489   7.474
  346    HD2  ARG  49           2HD      ARG  49  13.839  -5.198   8.842
  347    HD3  ARG  49           1HD      ARG  49  12.272  -5.521   9.581
  348    HE   ARG  49           HE       ARG  49  12.005  -6.000   6.860
  349   HH11  ARG  49          1HH1      ARG  49  13.816  -7.289   9.550
  350   HH12  ARG  49          2HH1      ARG  49  13.899  -8.889   8.889
  351   HH21  ARG  49          1HH2      ARG  49  12.111  -8.102   5.991
  352   HH22  ARG  49          2HH2      ARG  49  12.930  -9.349   6.868
  353    H    GLY  50           H        GLY  50  13.413  -0.281   9.994
  354    HA2  GLY  50           2HA      GLY  50  12.638   0.230  12.619
  355    HA3  GLY  50           1HA      GLY  50  13.774   1.210  11.702
  356    H    ILE  51           H        ILE  51  11.630   1.770   9.677
  357    HA   ILE  51           HA       ILE  51  10.534   4.086  11.031
  358    HB   ILE  51           HB       ILE  51  10.142   3.240   8.159
  359   HG12  ILE  51          2HG1      ILE  51  12.125   5.280   9.152
  360   HG13  ILE  51          1HG1      ILE  51  12.559   3.585   8.957
  361   HG21  ILE  51          1HG2      ILE  51   9.082   5.195   7.800
  362   HG22  ILE  51          2HG2      ILE  51  10.103   6.078   8.933
  363   HG23  ILE  51          3HG2      ILE  51   8.758   5.107   9.532
  364   HD11  ILE  51          3HD1      ILE  51  11.638   3.906   6.551
  365   HD12  ILE  51          1HD1      ILE  51  13.247   4.495   6.966
  366   HD13  ILE  51          2HD1      ILE  51  11.891   5.619   6.887
  367    H    ILE  52           H        ILE  52   9.328   1.186   9.389
  368    HA   ILE  52           HA       ILE  52   6.574   1.798   9.789
  369    HB   ILE  52           HB       ILE  52   7.871  -0.869   9.208
  370   HG12  ILE  52          2HG1      ILE  52   8.322   0.910   7.521
  371   HG13  ILE  52          1HG1      ILE  52   7.368  -0.425   6.883
  372   HG21  ILE  52          1HG2      ILE  52   5.704  -1.313  10.023
  373   HG22  ILE  52          2HG2      ILE  52   5.573  -1.377   8.265
  374   HG23  ILE  52          3HG2      ILE  52   5.007   0.047   9.141
  375   HD11  ILE  52          3HD1      ILE  52   5.980   1.119   6.111
  376   HD12  ILE  52          1HD1      ILE  52   6.724   2.385   7.086
  377   HD13  ILE  52          2HD1      ILE  52   5.468   1.360   7.783
  378    H    ARG  53           H        ARG  53   9.024   0.265  11.715
  379    HA   ARG  53           HA       ARG  53   7.554  -1.337  13.413
  380    HB2  ARG  53           2HB      ARG  53  10.042   0.287  13.783
  381    HB3  ARG  53           1HB      ARG  53   9.333  -0.543  15.161
  382    HG2  ARG  53           2HG      ARG  53   9.940  -1.999  12.615
  383    HG3  ARG  53           1HG      ARG  53  11.177  -1.731  13.845
  384    HD2  ARG  53           2HD      ARG  53  10.312  -3.829  14.378
  385    HD3  ARG  53           1HD      ARG  53   9.480  -2.738  15.486
  386    HE   ARG  53           HE       ARG  53   7.522  -3.368  14.516
  387   HH11  ARG  53          1HH1      ARG  53  10.096  -3.964  12.237
  388   HH12  ARG  53          2HH1      ARG  53   9.055  -4.695  11.062
  389   HH21  ARG  53          1HH2      ARG  53   6.151  -4.329  12.972
  390   HH22  ARG  53          2HH2      ARG  53   6.815  -4.902  11.479
  391    H    ASP  54           H        ASP  54   8.445   2.060  14.045
  392    HA   ASP  54           HA       ASP  54   6.111   2.237  15.831
  393    HB2  ASP  54           2HB      ASP  54   8.331   2.583  16.904
  394    HB3  ASP  54           1HB      ASP  54   8.592   3.968  15.848
  395    H    GLY  55           H        GLY  55   6.551   2.781  12.787
  396    HA2  GLY  55           2HA      GLY  55   5.708   5.591  12.725
  397    HA3  GLY  55           1HA      GLY  55   6.232   4.643  11.343
  398    H    LEU  56           H        LEU  56   4.770   3.144  10.398
  399    HA   LEU  56           HA       LEU  56   1.962   3.850  10.904
  400    HB2  LEU  56           2HB      LEU  56   3.153   2.551   8.457
  401    HB3  LEU  56           1HB      LEU  56   1.510   3.135   8.636
  402    HG   LEU  56           HG       LEU  56   2.615   5.449   9.027
  403   HD11  LEU  56          1HD1      LEU  56   4.748   5.498   7.527
  404   HD12  LEU  56          2HD1      LEU  56   4.881   3.803   8.000
  405   HD13  LEU  56          3HD1      LEU  56   4.872   5.064   9.232
  406   HD21  LEU  56          3HD2      LEU  56   1.333   5.304   7.122
  407   HD22  LEU  56          1HD2      LEU  56   2.280   3.972   6.457
  408   HD23  LEU  56          2HD2      LEU  56   2.930   5.612   6.438
  409    HA   PRO  57           HA       PRO  57   1.164  -0.258  12.336
  410    HB2  PRO  57           2HB      PRO  57  -1.496  -0.419  11.900
  411    HB3  PRO  57           1HB      PRO  57  -0.809   0.608  13.166
  412    HG2  PRO  57           2HG      PRO  57  -1.769   1.357  10.431
  413    HG3  PRO  57           1HG      PRO  57  -2.026   2.192  11.974
  414    HD2  PRO  57           2HD      PRO  57  -0.145   2.960  10.160
  415    HD3  PRO  57           1HD      PRO  57   0.034   3.209  11.909
  416    H    MET  58           H        MET  58   2.305  -1.496  10.843
  417    HA   MET  58           HA       MET  58   0.654  -2.640   8.698
  418    HB2  MET  58           2HB      MET  58   2.815  -1.013   8.234
  419    HB3  MET  58           1HB      MET  58   3.544  -2.612   8.175
  420    HG2  MET  58           2HG      MET  58   2.241  -3.271   6.362
  421    HG3  MET  58           1HG      MET  58   1.069  -1.980   6.616
  422    HE1  MET  58           3HE      MET  58   2.429  -2.694   3.704
  423    HE2  MET  58           1HE      MET  58   3.857  -3.241   4.582
  424    HE3  MET  58           2HE      MET  58   3.988  -1.920   3.421
  425    H    THR  59           H        THR  59   0.816  -4.824   8.406
  426    HA   THR  59           HA       THR  59   2.120  -6.305  10.548
  427    HB   THR  59           HB       THR  59   0.923  -8.205   8.995
  428    HG1  THR  59           1HG      THR  59   0.089  -6.402   7.679
  429   HG21  THR  59          3HG2      THR  59  -0.338  -8.547  10.787
  430   HG22  THR  59          1HG2      THR  59  -1.029  -6.926  10.722
  431   HG23  THR  59          2HG2      THR  59   0.526  -7.191  11.510
  432    H    GLU  60           H        GLU  60   3.667  -7.896  10.240
  433    HA   GLU  60           HA       GLU  60   5.673  -7.514   8.397
  434    HB2  GLU  60           2HB      GLU  60   6.271  -9.953   8.840
  435    HB3  GLU  60           1HB      GLU  60   6.168  -8.901  10.243
  436    HG2  GLU  60           2HG      GLU  60   3.715  -9.791  10.360
  437    HG3  GLU  60           1HG      GLU  60   4.362 -11.109   9.386
  438    H    ALA  61           H        ALA  61   3.174 -10.038   8.200
  439    HA   ALA  61           HA       ALA  61   3.769 -11.083   5.728
  440    HB1  ALA  61           1HB      ALA  61   1.256 -11.530   5.613
  441    HB2  ALA  61           2HB      ALA  61   1.173 -10.721   7.179
  442    HB3  ALA  61           3HB      ALA  61   2.143 -12.184   6.991
  443    H    GLU  62           H        GLU  62   2.388  -8.010   6.512
  444    HA   GLU  62           HA       GLU  62   1.427  -7.522   3.825
  445    HB2  GLU  62           2HB      GLU  62   0.036  -6.538   5.410
  446    HB3  GLU  62           1HB      GLU  62   1.377  -6.030   6.420
  447    HG2  GLU  62           2HG      GLU  62   0.369  -4.111   5.453
  448    HG3  GLU  62           1HG      GLU  62   1.962  -4.336   4.734
  449    H    ILE  63           H        ILE  63   3.997  -6.321   5.972
  450    HA   ILE  63           HA       ILE  63   5.156  -4.683   3.884
  451    HB   ILE  63           HB       ILE  63   6.637  -5.371   6.388
  452   HG12  ILE  63          2HG1      ILE  63   5.189  -3.045   6.969
  453   HG13  ILE  63          1HG1      ILE  63   4.002  -4.178   6.325
  454   HG21  ILE  63          1HG2      ILE  63   7.506  -3.913   4.480
  455   HG22  ILE  63          2HG2      ILE  63   7.628  -3.262   6.113
  456   HG23  ILE  63          3HG2      ILE  63   6.351  -2.702   5.035
  457   HD11  ILE  63          3HD1      ILE  63   3.991  -4.646   8.573
  458   HD12  ILE  63          1HD1      ILE  63   5.732  -4.428   8.737
  459   HD13  ILE  63          2HD1      ILE  63   5.092  -5.861   7.930
  460    H    THR  64           H        THR  64   6.074  -7.612   5.669
  461    HA   THR  64           HA       THR  64   8.521  -8.072   4.389
  462    HB   THR  64           HB       THR  64   6.535  -9.947   5.653
  463    HG1  THR  64           1HG      THR  64   7.563  -8.545   7.083
  464   HG21  THR  64          3HG2      THR  64   9.326 -10.594   4.756
  465   HG22  THR  64          1HG2      THR  64   7.826 -11.284   4.133
  466   HG23  THR  64          2HG2      THR  64   8.322 -11.608   5.795
  467    H    GLU  65           H        GLU  65   5.259  -9.239   3.650
  468    HA   GLU  65           HA       GLU  65   6.060 -10.697   1.357
  469    HB2  GLU  65           2HB      GLU  65   3.899 -10.996   2.682
  470    HB3  GLU  65           1HB      GLU  65   3.306  -9.594   1.801
  471    HG2  GLU  65           2HG      GLU  65   2.555 -11.077   0.321
  472    HG3  GLU  65           1HG      GLU  65   4.231 -11.171  -0.219
  473    H    PHE  66           H        PHE  66   5.654  -7.500   1.996
  474    HA   PHE  66           HA       PHE  66   5.302  -6.739  -0.789
  475    HB2  PHE  66           2HB      PHE  66   4.996  -5.307   1.812
  476    HB3  PHE  66           1HB      PHE  66   5.393  -4.362   0.384
  477    HD1  PHE  66           1HD      PHE  66   3.243  -7.375   0.521
  478    HD2  PHE  66           2HD      PHE  66   3.420  -3.146   0.075
  479    HE1  PHE  66           1HE      PHE  66   0.869  -7.348  -0.121
  480    HE2  PHE  66           2HE      PHE  66   1.045  -3.111  -0.569
  481    HZ   PHE  66           HZ       PHE  66  -0.234  -5.215  -0.667
  482    H    PHE  67           H        PHE  67   7.667  -6.973   1.703
  483    HA   PHE  67           HA       PHE  67   9.562  -5.136   0.624
  484    HB2  PHE  67           2HB      PHE  67   9.576  -7.253   2.727
  485    HB3  PHE  67           1HB      PHE  67  11.124  -6.683   2.115
  486    HD1  PHE  67           1HD      PHE  67  10.287  -3.778   1.671
  487    HD2  PHE  67           2HD      PHE  67   9.726  -6.464   4.927
  488    HE1  PHE  67           1HE      PHE  67  10.173  -1.872   3.224
  489    HE2  PHE  67           2HE      PHE  67   9.611  -4.562   6.481
  490    HZ   PHE  67           HZ       PHE  67   9.835  -2.263   5.630
  491    H    GLU  68           H        GLU  68   9.067  -8.624   0.368
  492    HA   GLU  68           HA       GLU  68  11.393  -9.004  -1.286
  493    HB2  GLU  68           2HB      GLU  68   9.122 -10.953  -0.921
  494    HB3  GLU  68           1HB      GLU  68  10.793 -11.303  -1.342
  495    HG2  GLU  68           2HG      GLU  68  11.323 -10.265   0.975
  496    HG3  GLU  68           1HG      GLU  68   9.621 -10.586   1.305
  497    H    ALA  69           H        ALA  69   8.001  -8.394  -1.763
  498    HA   ALA  69           HA       ALA  69   7.936  -9.182  -4.499
  499    HB1  ALA  69           1HB      ALA  69   5.930  -9.158  -3.072
  500    HB2  ALA  69           2HB      ALA  69   5.723  -8.209  -4.545
  501    HB3  ALA  69           3HB      ALA  69   6.041  -7.399  -3.010
  502    H    ALA  70           H        ALA  70   9.196  -6.605  -2.939
  503    HA   ALA  70           HA       ALA  70   8.888  -4.723  -5.151
  504    HB1  ALA  70           1HB      ALA  70  10.304  -3.269  -3.499
  505    HB2  ALA  70           2HB      ALA  70   9.793  -4.476  -2.318
  506    HB3  ALA  70           3HB      ALA  70   8.586  -3.540  -3.203
  507    H    ASP  71           H        ASP  71  11.277  -6.753  -3.615
  508    HA   ASP  71           HA       ASP  71  13.244  -5.884  -5.629
  509    HB2  ASP  71           2HB      ASP  71  13.773  -5.337  -3.194
  510    HB3  ASP  71           1HB      ASP  71  13.950  -7.071  -2.948
  511    HA   PRO  72           HA       PRO  72  12.714 -10.119  -7.015
  512    HB2  PRO  72           2HB      PRO  72  14.712 -10.058  -8.885
  513    HB3  PRO  72           1HB      PRO  72  13.091  -9.412  -9.160
  514    HG2  PRO  72           2HG      PRO  72  15.601  -7.971  -8.403
  515    HG3  PRO  72           1HG      PRO  72  14.352  -7.507  -9.573
  516    HD2  PRO  72           2HD      PRO  72  14.470  -6.423  -7.112
  517    HD3  PRO  72           1HD      PRO  72  12.922  -6.732  -7.927
  518    H    ASN  73           H        ASN  73  15.718  -8.668  -5.950
  519    HA   ASN  73           HA       ASN  73  17.030 -11.241  -5.654
  520    HB2  ASN  73           2HB      ASN  73  18.001  -8.510  -4.793
  521    HB3  ASN  73           1HB      ASN  73  18.968  -9.974  -4.945
  522   HD21  ASN  73          1HD2      ASN  73  18.693  -7.176  -6.306
  523   HD22  ASN  73          2HD2      ASN  73  18.889  -7.560  -7.979
  524    H    ASN  74           H        ASN  74  15.445  -8.825  -3.689
  525    HA   ASN  74           HA       ASN  74  14.631  -8.901  -1.565
  526    HB2  ASN  74           2HB      ASN  74  15.670 -11.726  -1.329
  527    HB3  ASN  74           1HB      ASN  74  14.367 -10.969  -0.418
  528   HD21  ASN  74          1HD2      ASN  74  15.170 -12.853  -3.080
  529   HD22  ASN  74          2HD2      ASN  74  13.629 -12.862  -3.859
  530    H    THR  75           H        THR  75  17.167  -7.901  -2.157
  531    HA   THR  75           HA       THR  75  18.941  -8.789  -0.043
  532    HB   THR  75           HB       THR  75  20.070  -8.309  -2.059
  533    HG1  THR  75           1HG      THR  75  21.380  -7.432  -0.627
  534   HG21  THR  75          3HG2      THR  75  18.412  -5.830  -2.164
  535   HG22  THR  75          1HG2      THR  75  18.659  -7.067  -3.398
  536   HG23  THR  75          2HG2      THR  75  19.954  -5.929  -3.016
  537    H    GLY  76           H        GLY  76  16.565  -7.798   0.959
  538    HA2  GLY  76           2HA      GLY  76  15.681  -6.271   2.417
  539    HA3  GLY  76           1HA      GLY  76  17.346  -6.052   2.936
  540    H    PHE  77           H        PHE  77  16.434  -5.304  -0.330
  541    HA   PHE  77           HA       PHE  77  16.535  -2.436   0.334
  542    HB2  PHE  77           2HB      PHE  77  17.826  -3.940  -1.931
  543    HB3  PHE  77           1HB      PHE  77  17.501  -2.213  -2.050
  544    HD1  PHE  77           2HD      PHE  77  18.322  -0.851   0.104
  545    HD2  PHE  77           1HD      PHE  77  19.912  -4.566  -1.234
  546    HE1  PHE  77           2HE      PHE  77  20.425  -0.374   1.289
  547    HE2  PHE  77           1HE      PHE  77  22.017  -4.095  -0.050
  548    HZ   PHE  77           HZ       PHE  77  22.276  -1.998   1.214
  549    H    ILE  78           H        ILE  78  15.410  -1.025  -1.188
  550    HA   ILE  78           HA       ILE  78  13.291  -2.358  -2.728
  551    HB   ILE  78           HB       ILE  78  12.854  -0.120  -0.746
  552   HG12  ILE  78          2HG1      ILE  78  11.784  -2.941  -0.857
  553   HG13  ILE  78          1HG1      ILE  78  12.926  -2.303   0.326
  554   HG21  ILE  78          1HG2      ILE  78  10.922  -1.351  -2.706
  555   HG22  ILE  78          2HG2      ILE  78  11.538   0.302  -2.734
  556   HG23  ILE  78          3HG2      ILE  78  10.487  -0.225  -1.422
  557   HD11  ILE  78          3HD1      ILE  78  10.626  -0.637   0.311
  558   HD12  ILE  78          1HD1      ILE  78  11.238  -1.669   1.607
  559   HD13  ILE  78          2HD1      ILE  78  10.102  -2.318   0.424
  560    H    ASP  79           H        ASP  79  12.352  -1.099  -4.364
  561    HA   ASP  79           HA       ASP  79  14.051   1.103  -5.297
  562    HB2  ASP  79           2HB      ASP  79  12.160  -0.796  -6.671
  563    HB3  ASP  79           1HB      ASP  79  12.569   0.743  -7.423
  564    H    TYR  80           H        TYR  80  13.290   2.810  -4.126
  565    HA   TYR  80           HA       TYR  80  11.014   3.503  -3.039
  566    HB2  TYR  80           2HB      TYR  80  13.014   4.999  -3.346
  567    HB3  TYR  80           1HB      TYR  80  12.360   5.450  -4.918
  568    HD1  TYR  80           2HD      TYR  80  11.696   5.543  -1.275
  569    HD2  TYR  80           1HD      TYR  80  10.661   7.082  -5.102
  570    HE1  TYR  80           2HE      TYR  80  10.338   7.288  -0.198
  571    HE2  TYR  80           1HE      TYR  80   9.301   8.832  -4.038
  572    HH   TYR  80           HH       TYR  80   8.088   9.124  -1.814
  573    H    LYS  81           H        LYS  81  11.451   3.618  -6.557
  574    HA   LYS  81           HA       LYS  81   8.892   4.708  -7.106
  575    HB2  LYS  81           2HB      LYS  81  10.806   3.124  -8.825
  576    HB3  LYS  81           1HB      LYS  81   9.316   3.830  -9.433
  577    HG2  LYS  81           2HG      LYS  81  10.147   5.927  -9.439
  578    HG3  LYS  81           1HG      LYS  81  11.124   5.660  -7.993
  579    HD2  LYS  81           2HD      LYS  81  12.594   4.183  -9.464
  580    HD3  LYS  81           1HD      LYS  81  11.736   4.890 -10.835
  581    HE2  LYS  81           2HE      LYS  81  12.364   7.148  -9.653
  582    HE3  LYS  81           1HE      LYS  81  13.623   6.162  -8.907
  583    HZ1  LYS  81           3HZ      LYS  81  13.219   6.758 -11.776
  584    HZ2  LYS  81           1HZ      LYS  81  14.169   5.453 -11.268
  585    HZ3  LYS  81           2HZ      LYS  81  14.593   7.029 -10.826
  586    H    ALA  82           H        ALA  82  10.124   1.372  -7.425
  587    HA   ALA  82           HA       ALA  82   7.766   0.112  -8.119
  588    HB1  ALA  82           1HB      ALA  82  10.315  -0.708  -7.483
  589    HB2  ALA  82           2HB      ALA  82   8.970  -1.762  -7.918
  590    HB3  ALA  82           3HB      ALA  82   9.332  -1.450  -6.219
  591    H    PHE  83           H        PHE  83   8.763   1.396  -5.057
  592    HA   PHE  83           HA       PHE  83   6.598   0.089  -3.618
  593    HB2  PHE  83           2HB      PHE  83   9.143   1.106  -2.915
  594    HB3  PHE  83           1HB      PHE  83   7.953   2.079  -2.054
  595    HD1  PHE  83           2HD      PHE  83   8.455  -1.518  -2.910
  596    HD2  PHE  83           1HD      PHE  83   7.446   1.356   0.061
  597    HE1  PHE  83           2HE      PHE  83   8.190  -3.322  -1.262
  598    HE2  PHE  83           1HE      PHE  83   7.179  -0.444   1.717
  599    HZ   PHE  83           HZ       PHE  83   7.550  -2.788   1.056
  600    H    ALA  84           H        ALA  84   7.485   3.229  -4.891
  601    HA   ALA  84           HA       ALA  84   5.307   4.613  -3.611
  602    HB1  ALA  84           1HB      ALA  84   7.454   5.720  -4.145
  603    HB2  ALA  84           2HB      ALA  84   6.058   6.554  -4.826
  604    HB3  ALA  84           3HB      ALA  84   7.079   5.554  -5.859
  605    H    ALA  85           H        ALA  85   5.701   2.757  -6.463
  606    HA   ALA  85           HA       ALA  85   3.712   4.001  -8.042
  607    HB1  ALA  85           1HB      ALA  85   3.875   2.072  -9.486
  608    HB2  ALA  85           2HB      ALA  85   4.729   1.186  -8.222
  609    HB3  ALA  85           3HB      ALA  85   5.488   2.582  -8.986
  610    H    MET  86           H        MET  86   3.530   2.165  -5.341
  611    HA   MET  86           HA       MET  86   1.083   0.768  -5.851
  612    HB2  MET  86           2HB      MET  86   2.570   1.346  -3.286
  613    HB3  MET  86           1HB      MET  86   1.116   0.363  -3.372
  614    HG2  MET  86           2HG      MET  86   2.481  -0.980  -5.145
  615    HG3  MET  86           1HG      MET  86   3.864  -0.227  -4.353
  616    HE1  MET  86           3HE      MET  86   4.214  -0.098  -2.061
  617    HE2  MET  86           1HE      MET  86   4.669  -1.706  -1.494
  618    HE3  MET  86           2HE      MET  86   3.284  -0.879  -0.782
  619    H    LEU  87           H        LEU  87   2.003   3.784  -4.281
  620    HA   LEU  87           HA       LEU  87  -0.713   4.368  -3.536
  621    HB2  LEU  87           2HB      LEU  87   1.797   5.982  -3.328
  622    HB3  LEU  87           1HB      LEU  87   0.246   6.501  -2.696
  623    HG   LEU  87           HG       LEU  87   1.531   5.674  -0.862
  624   HD11  LEU  87          1HD1      LEU  87  -0.107   4.455   0.073
  625   HD12  LEU  87          2HD1      LEU  87  -0.096   3.255  -1.219
  626   HD13  LEU  87          3HD1      LEU  87  -0.959   4.778  -1.438
  627   HD21  LEU  87          3HD2      LEU  87   2.763   3.728  -0.821
  628   HD22  LEU  87          1HD2      LEU  87   2.966   4.241  -2.497
  629   HD23  LEU  87          2HD2      LEU  87   1.810   2.971  -2.097
  630    H    TYR  88           H        TYR  88   1.022   4.579  -6.194
  631    HA   TYR  88           HA       TYR  88  -0.643   6.715  -7.337
  632    HB2  TYR  88           2HB      TYR  88   2.194   6.102  -8.180
  633    HB3  TYR  88           1HB      TYR  88   1.182   7.426  -8.749
  634    HD1  TYR  88           2HD      TYR  88   0.101   8.648  -6.413
  635    HD2  TYR  88           1HD      TYR  88   3.956   6.929  -6.946
  636    HE1  TYR  88           2HE      TYR  88   0.986  10.096  -4.631
  637    HE2  TYR  88           1HE      TYR  88   4.851   8.369  -5.166
  638    HH   TYR  88           HH       TYR  88   4.057   9.615  -3.230
  639    H    SER  89           H        SER  89  -0.839   3.708  -7.248
  640    HA   SER  89           HA       SER  89  -0.643   3.065 -10.097
  641    HB2  SER  89           2HB      SER  89  -0.532   1.528  -7.616
  642    HB3  SER  89           1HB      SER  89  -1.606   0.802  -8.811
  643    HG   SER  89           HG       SER  89   0.096   0.767 -10.271
  644    H    VAL  90           H        VAL  90  -2.660   4.914  -9.070
  645    HA   VAL  90           HA       VAL  90  -5.130   3.378  -9.489
  646    HB   VAL  90           HB       VAL  90  -6.302   5.397  -8.648
  647   HG11  VAL  90          1HG1      VAL  90  -6.010   4.855  -6.434
  648   HG12  VAL  90          2HG1      VAL  90  -4.259   4.710  -6.588
  649   HG13  VAL  90          3HG1      VAL  90  -5.308   3.440  -7.220
  650   HG21  VAL  90          3HG2      VAL  90  -5.146   7.250  -7.740
  651   HG22  VAL  90          1HG2      VAL  90  -4.435   6.963  -9.328
  652   HG23  VAL  90          2HG2      VAL  90  -3.587   6.436  -7.873
  653    H    ASP  91           H        ASP  91  -3.304   4.110 -11.648
  654    HA   ASP  91           HA       ASP  91  -5.245   5.493 -13.332
  655    HB2  ASP  91           2HB      ASP  91  -2.528   6.504 -12.654
  656    HB3  ASP  91           1HB      ASP  91  -3.059   6.671 -14.325
  657    H    GLU  92           H        GLU  92  -4.358   2.742 -13.093
  658    HA   GLU  92           HA       GLU  92  -3.718   2.292 -15.879
  659    HB2  GLU  92           2HB      GLU  92  -1.830   1.630 -13.651
  660    HB3  GLU  92           1HB      GLU  92  -1.911   0.575 -15.055
  661    HG2  GLU  92           2HG      GLU  92  -1.459   2.562 -16.485
  662    HG3  GLU  92           1HG      GLU  92  -1.205   3.498 -15.013
  663    H    SER  93           H        SER  93  -4.137   0.789 -12.686
  664    HA   SER  93           HA       SER  93  -6.067  -1.058 -13.865
  665    HB2  SER  93           2HB      SER  93  -3.967  -2.125 -11.989
  666    HB3  SER  93           1HB      SER  93  -5.054  -3.022 -13.052
  667    HG   SER  93           HG       SER  93  -2.866  -1.389 -13.830
  Start of MODEL    5
    1    H1   MET   1           1HT      MET   1 -28.193  -3.802 -16.568
    2    H2   MET   1           2HT      MET   1 -28.122  -2.757 -17.929
    3    H3   MET   1           3HT      MET   1 -28.866  -4.298 -18.065
    4    HA   MET   1           HA       MET   1 -30.599  -3.671 -16.628
    5    HB2  MET   1           2HB      MET   1 -28.747  -1.393 -16.151
    6    HB3  MET   1           1HB      MET   1 -30.469  -1.046 -16.093
    7    HG2  MET   1           2HG      MET   1 -29.255  -3.288 -14.521
    8    HG3  MET   1           1HG      MET   1 -29.303  -1.635 -13.911
    9    HE1  MET   1           2HE      MET   1 -30.761  -4.878 -14.079
   10    HE2  MET   1           3HE      MET   1 -31.912  -4.502 -15.362
   11    HE3  MET   1           1HE      MET   1 -32.480  -4.748 -13.710
   12    H    GLY   2           H        GLY   2 -32.216  -1.704 -17.103
   13    HA2  GLY   2           2HA      GLY   2 -31.953  -0.510 -19.698
   14    HA3  GLY   2           1HA      GLY   2 -33.044  -1.887 -19.708
   15    H    SER   3           H        SER   3 -32.664   0.279 -16.976
   16    HA   SER   3           HA       SER   3 -35.121   1.696 -17.639
   17    HB2  SER   3           2HB      SER   3 -35.763  -0.402 -16.387
   18    HB3  SER   3           1HB      SER   3 -34.872   0.234 -15.004
   19    HG   SER   3           HG       SER   3 -37.032   0.806 -14.813
   20    H    SER   4           H        SER   4 -35.415   3.629 -16.470
   21    HA   SER   4           HA       SER   4 -33.824   4.472 -14.319
   22    HB2  SER   4           2HB      SER   4 -32.616   6.275 -15.901
   23    HB3  SER   4           1HB      SER   4 -31.875   4.729 -15.489
   24    HG   SER   4           HG       SER   4 -33.093   5.545 -17.881
   25    H    HIS   5           H        HIS   5 -33.811   7.030 -14.264
   26    HA   HIS   5           HA       HIS   5 -35.063   8.918 -14.076
   27    HB2  HIS   5           2HB      HIS   5 -35.788   7.877 -16.770
   28    HB3  HIS   5           1HB      HIS   5 -36.796   9.154 -16.095
   29    HD1  HIS   5           1HD      HIS   5 -33.106   8.512 -16.772
   30    HD2  HIS   5           2HD      HIS   5 -35.830  11.642 -16.557
   31    HE1  HIS   5           1HE      HIS   5 -31.827  10.564 -17.462
   32    HE2  HIS   5           2HE      HIS   5 -33.518  12.431 -17.409
   33    H    HIS   6           H        HIS   6 -35.963   6.490 -12.795
   34    HA   HIS   6           HA       HIS   6 -38.465   7.343 -11.855
   35    HB2  HIS   6           2HB      HIS   6 -38.804   6.161 -14.272
   36    HB3  HIS   6           1HB      HIS   6 -38.946   4.763 -13.213
   37    HD1  HIS   6           1HD      HIS   6 -40.914   4.826 -11.451
   38    HD2  HIS   6           2HD      HIS   6 -40.977   7.856 -14.294
   39    HE1  HIS   6           1HE      HIS   6 -43.226   5.810 -11.334
   40    HE2  HIS   6           2HE      HIS   6 -43.212   7.698 -13.002
   41    H    HIS   7           H        HIS   7 -37.165   4.098 -12.558
   42    HA   HIS   7           HA       HIS   7 -36.625   3.727  -9.707
   43    HB2  HIS   7           2HB      HIS   7 -38.955   2.845 -10.408
   44    HB3  HIS   7           1HB      HIS   7 -38.065   1.574 -11.238
   45    HD1  HIS   7           1HD      HIS   7 -37.362   3.034  -7.803
   46    HD2  HIS   7           2HD      HIS   7 -38.459  -0.553  -9.591
   47    HE1  HIS   7           1HE      HIS   7 -37.354   1.331  -5.953
   48    HE2  HIS   7           2HE      HIS   7 -38.106  -0.814  -7.042
   49    H    HIS   8           H        HIS   8 -35.303   1.791  -9.279
   50    HA   HIS   8           HA       HIS   8 -33.985   0.492 -11.471
   51    HB2  HIS   8           2HB      HIS   8 -31.694   1.319 -10.787
   52    HB3  HIS   8           1HB      HIS   8 -32.708   2.499 -11.612
   53    HD1  HIS   8           1HD      HIS   8 -34.223   3.924  -9.620
   54    HD2  HIS   8           2HD      HIS   8 -30.429   2.488  -8.721
   55    HE1  HIS   8           1HE      HIS   8 -33.434   5.290  -7.661
   56    HE2  HIS   8           2HE      HIS   8 -31.101   4.462  -7.190
   57    H    HIS   9           H        HIS   9 -34.844  -1.291 -10.272
   58    HA   HIS   9           HA       HIS   9 -33.422  -1.868  -7.761
   59    HB2  HIS   9           2HB      HIS   9 -36.091  -1.915  -8.159
   60    HB3  HIS   9           1HB      HIS   9 -35.698  -3.578  -8.584
   61    HD1  HIS   9           1HD      HIS   9 -37.017  -2.013  -5.867
   62    HD2  HIS   9           2HD      HIS   9 -33.634  -4.390  -6.277
   63    HE1  HIS   9           1HE      HIS   9 -36.538  -2.902  -3.564
   64    HE2  HIS   9           2HE      HIS   9 -34.435  -4.267  -3.821
   65    H    HIS  10           H        HIS  10 -31.984  -3.475  -7.689
   66    HA   HIS  10           HA       HIS  10 -32.112  -5.867  -9.141
   67    HB2  HIS  10           2HB      HIS  10 -30.103  -5.432 -10.647
   68    HB3  HIS  10           1HB      HIS  10 -31.627  -4.699 -11.142
   69    HD1  HIS  10           1HD      HIS  10 -28.245  -3.833  -9.772
   70    HD2  HIS  10           2HD      HIS  10 -31.662  -1.915 -11.152
   71    HE1  HIS  10           1HE      HIS  10 -27.602  -1.416 -10.023
   72    HE2  HIS  10           2HE      HIS  10 -29.711  -0.260 -10.778
   73    H    SER  11           H        SER  11 -30.002  -3.455  -7.664
   74    HA   SER  11           HA       SER  11 -28.347  -3.622  -6.114
   75    HB2  SER  11           2HB      SER  11 -30.105  -5.088  -4.998
   76    HB3  SER  11           1HB      SER  11 -29.228  -6.472  -5.649
   77    HG   SER  11           HG       SER  11 -27.982  -4.474  -4.078
   78    H    SER  12           H        SER  12 -26.198  -4.294  -5.930
   79    HA   SER  12           HA       SER  12 -24.981  -5.225  -8.269
   80    HB2  SER  12           2HB      SER  12 -24.060  -3.944  -6.099
   81    HB3  SER  12           1HB      SER  12 -23.516  -5.574  -5.706
   82    HG   SER  12           HG       SER  12 -22.337  -5.622  -7.588
   83    H    GLY  13           H        GLY  13 -25.426  -6.893  -5.147
   84    HA2  GLY  13           2HA      GLY  13 -25.500  -9.128  -4.628
   85    HA3  GLY  13           1HA      GLY  13 -26.065  -9.377  -6.273
   86    H    LEU  14           H        LEU  14 -24.889 -11.338  -6.380
   87    HA   LEU  14           HA       LEU  14 -23.116 -12.642  -6.952
   88    HB2  LEU  14           2HB      LEU  14 -22.723 -10.123  -8.237
   89    HB3  LEU  14           1HB      LEU  14 -21.160 -10.728  -7.727
   90    HG   LEU  14           HG       LEU  14 -21.605 -11.422  -9.998
   91   HD11  LEU  14          1HD1      LEU  14 -21.696 -13.997  -9.539
   92   HD12  LEU  14          2HD1      LEU  14 -21.552 -13.493  -7.855
   93   HD13  LEU  14          3HD1      LEU  14 -20.306 -13.041  -9.021
   94   HD21  LEU  14          3HD2      LEU  14 -24.038 -12.848  -8.933
   95   HD22  LEU  14          1HD2      LEU  14 -23.481 -12.798 -10.605
   96   HD23  LEU  14          2HD2      LEU  14 -24.078 -11.330  -9.831
   97    H    VAL  15           H        VAL  15 -20.370 -12.284  -6.788
   98    HA   VAL  15           HA       VAL  15 -19.809 -12.875  -4.143
   99    HB   VAL  15           HB       VAL  15 -17.410 -12.269  -4.733
  100   HG11  VAL  15          1HG1      VAL  15 -17.957 -14.521  -4.940
  101   HG12  VAL  15          2HG1      VAL  15 -17.328 -14.107  -6.535
  102   HG13  VAL  15          3HG1      VAL  15 -19.068 -14.229  -6.277
  103   HG21  VAL  15          3HG2      VAL  15 -18.529 -11.909  -7.504
  104   HG22  VAL  15          1HG2      VAL  15 -16.863 -11.694  -6.970
  105   HG23  VAL  15          2HG2      VAL  15 -18.108 -10.561  -6.448
  106    HA   PRO  16           HA       PRO  16 -19.558  -9.262  -1.649
  107    HB2  PRO  16           2HB      PRO  16 -16.654  -9.843  -1.273
  108    HB3  PRO  16           1HB      PRO  16 -17.904  -9.531  -0.064
  109    HG2  PRO  16           2HG      PRO  16 -17.030 -12.006  -0.496
  110    HG3  PRO  16           1HG      PRO  16 -18.748 -11.689  -0.187
  111    HD2  PRO  16           2HD      PRO  16 -17.369 -12.339  -2.749
  112    HD3  PRO  16           1HD      PRO  16 -18.996 -12.783  -2.197
  113    H    ARG  17           H        ARG  17 -18.497  -7.144  -1.438
  114    HA   ARG  17           HA       ARG  17 -18.026  -5.935  -3.913
  115    HB2  ARG  17           2HB      ARG  17 -17.068  -4.824  -1.280
  116    HB3  ARG  17           1HB      ARG  17 -17.577  -3.936  -2.709
  117    HG2  ARG  17           2HG      ARG  17 -19.875  -4.960  -2.336
  118    HG3  ARG  17           1HG      ARG  17 -19.275  -5.440  -0.747
  119    HD2  ARG  17           2HD      ARG  17 -18.540  -2.826  -0.825
  120    HD3  ARG  17           1HD      ARG  17 -20.029  -2.790  -1.768
  121    HE   ARG  17           HE       ARG  17 -21.216  -3.195   0.147
  122   HH11  ARG  17          1HH1      ARG  17 -17.848  -3.888   0.737
  123   HH12  ARG  17          2HH1      ARG  17 -18.061  -4.102   2.442
  124   HH21  ARG  17          1HH2      ARG  17 -21.500  -3.477   2.389
  125   HH22  ARG  17          2HH2      ARG  17 -20.135  -3.871   3.379
  126    H    GLY  18           H        GLY  18 -16.274  -5.731  -5.153
  127    HA2  GLY  18           2HA      GLY  18 -13.702  -6.643  -4.039
  128    HA3  GLY  18           1HA      GLY  18 -14.144  -6.708  -5.738
  129    H    SER  19           H        SER  19 -14.816  -3.897  -3.790
  130    HA   SER  19           HA       SER  19 -12.526  -2.496  -4.979
  131    HB2  SER  19           2HB      SER  19 -14.259  -1.839  -6.442
  132    HB3  SER  19           1HB      SER  19 -15.428  -1.698  -5.129
  133    HG   SER  19           HG       SER  19 -14.113   0.246  -6.142
  134    H    HIS  20           H        HIS  20 -11.461  -2.418  -3.016
  135    HA   HIS  20           HA       HIS  20 -12.593  -1.726  -0.551
  136    HB2  HIS  20           2HB      HIS  20 -10.244  -1.181   0.123
  137    HB3  HIS  20           1HB      HIS  20 -10.426  -2.763  -0.625
  138    HD1  HIS  20           1HD      HIS  20  -8.769   0.521  -1.055
  139    HD2  HIS  20           2HD      HIS  20  -9.301  -2.980  -3.230
  140    HE1  HIS  20           1HE      HIS  20  -7.114   0.646  -2.944
  141    HE2  HIS  20           2HE      HIS  20  -7.392  -1.524  -4.194
  142    H    MET  21           H        MET  21 -12.502   0.221   0.655
  143    HA   MET  21           HA       MET  21 -13.308   2.513  -0.740
  144    HB2  MET  21           2HB      MET  21 -13.545   1.782   1.797
  145    HB3  MET  21           1HB      MET  21 -12.111   2.784   1.979
  146    HG2  MET  21           2HG      MET  21 -13.225   4.714   1.505
  147    HG3  MET  21           1HG      MET  21 -14.427   3.906   0.500
  148    HE1  MET  21           3HE      MET  21 -15.922   5.771   3.850
  149    HE2  MET  21           1HE      MET  21 -16.121   5.817   2.098
  150    HE3  MET  21           2HE      MET  21 -14.549   6.170   2.817
  151    H    SER  22           H        SER  22 -12.157   4.720  -0.193
  152    HA   SER  22           HA       SER  22  -9.450   4.464  -1.246
  153    HB2  SER  22           2HB      SER  22  -9.693   6.931  -1.736
  154    HB3  SER  22           1HB      SER  22 -10.824   5.886  -2.598
  155    HG   SER  22           HG       SER  22 -11.308   7.835  -0.750
  156    H    ASP  23           H        ASP  23 -10.687   4.531   1.656
  157    HA   ASP  23           HA       ASP  23  -8.944   6.521   2.835
  158    HB2  ASP  23           2HB      ASP  23 -10.911   4.653   4.128
  159    HB3  ASP  23           1HB      ASP  23 -10.050   5.948   4.956
  160    H    GLU  24           H        GLU  24  -8.909   3.324   2.079
  161    HA   GLU  24           HA       GLU  24  -7.334   2.254   4.142
  162    HB2  GLU  24           2HB      GLU  24  -8.640   0.943   2.416
  163    HB3  GLU  24           1HB      GLU  24  -7.335   1.304   1.293
  164    HG2  GLU  24           2HG      GLU  24  -6.445   0.155   3.830
  165    HG3  GLU  24           1HG      GLU  24  -7.487  -0.903   2.879
  166    H    LYS  25           H        LYS  25  -6.636   4.349   1.695
  167    HA   LYS  25           HA       LYS  25  -3.781   3.786   1.625
  168    HB2  LYS  25           2HB      LYS  25  -5.508   4.697  -0.295
  169    HB3  LYS  25           1HB      LYS  25  -4.754   6.193   0.241
  170    HG2  LYS  25           2HG      LYS  25  -3.101   3.805  -0.489
  171    HG3  LYS  25           1HG      LYS  25  -3.698   4.922  -1.718
  172    HD2  LYS  25           2HD      LYS  25  -2.116   5.795   0.692
  173    HD3  LYS  25           1HD      LYS  25  -1.381   5.400  -0.862
  174    HE2  LYS  25           2HE      LYS  25  -3.632   7.287  -0.986
  175    HE3  LYS  25           1HE      LYS  25  -2.206   7.879  -0.136
  176    HZ1  LYS  25           3HZ      LYS  25  -2.221   8.369  -2.548
  177    HZ2  LYS  25           1HZ      LYS  25  -2.142   6.708  -2.862
  178    HZ3  LYS  25           2HZ      LYS  25  -0.872   7.477  -2.056
  179    H    THR  26           H        THR  26  -6.051   6.029   3.003
  180    HA   THR  26           HA       THR  26  -4.243   8.087   3.661
  181    HB   THR  26           HB       THR  26  -6.240   8.130   5.615
  182    HG1  THR  26           1HG      THR  26  -7.963   7.283   4.772
  183   HG21  THR  26          3HG2      THR  26  -7.173   9.560   3.375
  184   HG22  THR  26          1HG2      THR  26  -5.410   9.694   3.383
  185   HG23  THR  26          2HG2      THR  26  -6.344  10.179   4.804
  186    H    GLN  27           H        GLN  27  -4.998   5.039   5.158
  187    HA   GLN  27           HA       GLN  27  -3.986   5.532   7.730
  188    HB2  GLN  27           2HB      GLN  27  -4.408   3.106   6.050
  189    HB3  GLN  27           1HB      GLN  27  -3.367   2.949   7.458
  190    HG2  GLN  27           2HG      GLN  27  -5.116   3.575   8.930
  191    HG3  GLN  27           1HG      GLN  27  -6.150   4.071   7.591
  192   HE21  GLN  27          1HE2      GLN  27  -7.174   2.507   6.348
  193   HE22  GLN  27          2HE2      GLN  27  -7.323   0.867   6.870
  194    H    LEU  28           H        LEU  28  -2.466   5.152   4.673
  195    HA   LEU  28           HA       LEU  28   0.161   4.653   5.758
  196    HB2  LEU  28           2HB      LEU  28  -0.756   3.677   3.597
  197    HB3  LEU  28           1HB      LEU  28  -0.555   5.281   2.921
  198    HG   LEU  28           HG       LEU  28   1.838   4.104   4.213
  199   HD11  LEU  28          1HD1      LEU  28   0.426   2.832   1.952
  200   HD12  LEU  28          2HD1      LEU  28   1.522   2.138   3.146
  201   HD13  LEU  28          3HD1      LEU  28   2.169   3.045   1.779
  202   HD21  LEU  28          3HD2      LEU  28   2.448   6.047   3.236
  203   HD22  LEU  28          1HD2      LEU  28   1.148   5.984   2.048
  204   HD23  LEU  28          2HD2      LEU  28   2.607   5.023   1.810
  205    H    ILE  29           H        ILE  29  -1.752   7.235   5.169
  206    HA   ILE  29           HA       ILE  29   0.071   9.182   4.305
  207    HB   ILE  29           HB       ILE  29  -2.493   9.486   5.809
  208   HG12  ILE  29          2HG1      ILE  29  -2.485   8.416   3.499
  209   HG13  ILE  29          1HG1      ILE  29  -3.569   9.781   3.746
  210   HG21  ILE  29          1HG2      ILE  29  -0.805  11.580   4.447
  211   HG22  ILE  29          2HG2      ILE  29  -1.258  11.502   6.149
  212   HG23  ILE  29          3HG2      ILE  29  -2.483  11.835   4.925
  213   HD11  ILE  29          3HD1      ILE  29  -1.052  10.715   2.789
  214   HD12  ILE  29          1HD1      ILE  29  -2.659  10.853   2.067
  215   HD13  ILE  29          2HD1      ILE  29  -1.665   9.432   1.744
  216    H    GLU  30           H        GLU  30  -0.294   7.680   7.133
  217    HA   GLU  30           HA       GLU  30   0.626   9.719   8.893
  218    HB2  GLU  30           2HB      GLU  30   0.636   6.773   9.491
  219    HB3  GLU  30           1HB      GLU  30   0.569   8.100  10.642
  220    HG2  GLU  30           2HG      GLU  30  -1.607   7.559   8.645
  221    HG3  GLU  30           1HG      GLU  30  -1.577   6.846  10.257
  222    H    ALA  31           H        ALA  31   2.150   8.252   6.564
  223    HA   ALA  31           HA       ALA  31   4.676   7.769   7.939
  224    HB1  ALA  31           1HB      ALA  31   4.569   6.110   6.410
  225    HB2  ALA  31           2HB      ALA  31   5.277   7.333   5.355
  226    HB3  ALA  31           3HB      ALA  31   3.540   7.033   5.317
  227    H    PHE  32           H        PHE  32   3.181  10.023   5.710
  228    HA   PHE  32           HA       PHE  32   5.502  11.396   4.901
  229    HB2  PHE  32           2HB      PHE  32   2.582  11.942   4.875
  230    HB3  PHE  32           1HB      PHE  32   3.652  13.331   4.710
  231    HD1  PHE  32           1HD      PHE  32   3.753   9.838   3.396
  232    HD2  PHE  32           2HD      PHE  32   3.764  14.003   2.525
  233    HE1  PHE  32           1HE      PHE  32   4.031   9.332   1.005
  234    HE2  PHE  32           2HE      PHE  32   4.041  13.505   0.131
  235    HZ   PHE  32           HZ       PHE  32   4.175  11.167  -0.632
  236    H    TYR  33           H        TYR  33   3.552  11.575   7.782
  237    HA   TYR  33           HA       TYR  33   4.966  13.975   8.680
  238    HB2  TYR  33           2HB      TYR  33   2.761  12.528  10.146
  239    HB3  TYR  33           1HB      TYR  33   3.308  14.186  10.374
  240    HD1  TYR  33           2HD      TYR  33   3.279  15.463   7.881
  241    HD2  TYR  33           1HD      TYR  33   0.645  12.419   9.256
  242    HE1  TYR  33           2HE      TYR  33   1.561  16.249   6.308
  243    HE2  TYR  33           1HE      TYR  33  -1.082  13.196   7.686
  244    HH   TYR  33           HH       TYR  33  -1.253  14.451   5.612
  245    H    ASN  34           H        ASN  34   6.332  11.425   8.442
  246    HA   ASN  34           HA       ASN  34   7.637  11.401  10.968
  247    HB2  ASN  34           2HB      ASN  34   5.519  10.020  11.368
  248    HB3  ASN  34           1HB      ASN  34   6.232   8.820  10.294
  249   HD21  ASN  34          1HD2      ASN  34   7.488  10.883  12.896
  250   HD22  ASN  34          2HD2      ASN  34   8.211   9.598  13.796
  251    H    PHE  35           H        PHE  35   8.289  11.714   8.181
  252    HA   PHE  35           HA       PHE  35  10.532   9.912   8.069
  253    HB2  PHE  35           2HB      PHE  35   8.734   8.565   7.019
  254    HB3  PHE  35           1HB      PHE  35   8.492   9.844   5.834
  255    HD1  PHE  35           1HD      PHE  35  11.590   8.292   7.209
  256    HD2  PHE  35           2HD      PHE  35   9.179   9.058   3.786
  257    HE1  PHE  35           1HE      PHE  35  13.313   7.281   5.772
  258    HE2  PHE  35           2HE      PHE  35  10.897   8.048   2.344
  259    HZ   PHE  35           HZ       PHE  35  12.968   7.158   3.336
  260    H    ASP  36           H        ASP  36  10.284  12.705   8.341
  261    HA   ASP  36           HA       ASP  36  11.177  13.717   5.729
  262    HB2  ASP  36           2HB      ASP  36   9.882  14.995   8.101
  263    HB3  ASP  36           1HB      ASP  36  10.924  15.977   7.075
  264    H    GLY  37           H        GLY  37  12.902  12.106   7.326
  265    HA2  GLY  37           2HA      GLY  37  15.179  13.851   7.424
  266    HA3  GLY  37           1HA      GLY  37  14.660  13.337   9.021
  267    H    ASP  38           H        ASP  38  14.964  11.718   5.859
  268    HA   ASP  38           HA       ASP  38  17.171  10.134   6.552
  269    HB2  ASP  38           2HB      ASP  38  15.285   9.229   8.093
  270    HB3  ASP  38           1HB      ASP  38  14.653   8.493   6.622
  271    H    TYR  39           H        TYR  39  17.480  11.003   4.387
  272    HA   TYR  39           HA       TYR  39  17.626  10.777   2.129
  273    HB2  TYR  39           2HB      TYR  39  16.689   8.010   2.873
  274    HB3  TYR  39           1HB      TYR  39  17.055   8.462   1.213
  275    HD1  TYR  39           1HD      TYR  39  19.444  10.027   1.351
  276    HD2  TYR  39           2HD      TYR  39  18.357   6.639   3.685
  277    HE1  TYR  39           1HE      TYR  39  21.823   9.538   1.740
  278    HE2  TYR  39           2HE      TYR  39  20.732   6.142   4.080
  279    HH   TYR  39           HH       TYR  39  23.076   6.950   2.464
  280    H    ASP  40           H        ASP  40  16.290  10.273   0.101
  281    HA   ASP  40           HA       ASP  40  13.426  10.690   0.611
  282    HB2  ASP  40           2HB      ASP  40  14.985  12.760  -0.116
  283    HB3  ASP  40           1HB      ASP  40  14.606  12.113  -1.710
  284    H    GLY  41           H        GLY  41  12.042   9.687  -0.783
  285    HA2  GLY  41           2HA      GLY  41  11.325   8.266  -2.440
  286    HA3  GLY  41           1HA      GLY  41  12.752   8.735  -3.352
  287    H    PHE  42           H        PHE  42  14.699   7.548  -3.067
  288    HA   PHE  42           HA       PHE  42  14.355   4.776  -2.890
  289    HB2  PHE  42           2HB      PHE  42  16.197   5.817  -4.133
  290    HB3  PHE  42           1HB      PHE  42  16.904   6.385  -2.624
  291    HD1  PHE  42           1HD      PHE  42  16.181   3.416  -4.670
  292    HD2  PHE  42           2HD      PHE  42  18.176   4.936  -1.232
  293    HE1  PHE  42           1HE      PHE  42  17.444   1.313  -4.479
  294    HE2  PHE  42           2HE      PHE  42  19.444   2.836  -1.034
  295    HZ   PHE  42           HZ       PHE  42  19.078   1.022  -2.659
  296    H    VAL  43           H        VAL  43  14.168   3.465  -1.212
  297    HA   VAL  43           HA       VAL  43  15.491   4.128   1.309
  298    HB   VAL  43           HB       VAL  43  13.232   5.022   1.563
  299   HG11  VAL  43          1HG1      VAL  43  12.148   3.553  -0.102
  300   HG12  VAL  43          2HG1      VAL  43  11.267   3.631   1.425
  301   HG13  VAL  43          3HG1      VAL  43  12.253   2.218   1.046
  302   HG21  VAL  43          3HG2      VAL  43  14.194   4.185   3.567
  303   HG22  VAL  43          1HG2      VAL  43  13.827   2.516   3.127
  304   HG23  VAL  43          2HG2      VAL  43  12.522   3.628   3.540
  305    H    SER  44           H        SER  44  16.531   2.411   2.068
  306    HA   SER  44           HA       SER  44  16.209  -0.158   0.835
  307    HB2  SER  44           2HB      SER  44  17.858   0.359   3.299
  308    HB3  SER  44           1HB      SER  44  18.144  -0.802   2.004
  309    HG   SER  44           HG       SER  44  18.656   1.941   2.091
  310    H    VAL  45           H        VAL  45  15.750  -2.135   1.945
  311    HA   VAL  45           HA       VAL  45  13.431  -2.068   3.515
  312    HB   VAL  45           HB       VAL  45  15.419  -4.332   3.265
  313   HG11  VAL  45          1HG1      VAL  45  13.710  -5.790   3.989
  314   HG12  VAL  45          2HG1      VAL  45  12.484  -4.530   3.888
  315   HG13  VAL  45          3HG1      VAL  45  13.723  -4.457   5.139
  316   HG21  VAL  45          3HG2      VAL  45  14.214  -5.100   1.392
  317   HG22  VAL  45          1HG2      VAL  45  14.457  -3.377   1.119
  318   HG23  VAL  45          2HG2      VAL  45  12.894  -3.967   1.677
  319    H    GLU  46           H        GLU  46  16.775  -2.861   4.445
  320    HA   GLU  46           HA       GLU  46  16.418  -3.328   7.131
  321    HB2  GLU  46           2HB      GLU  46  18.775  -1.789   6.061
  322    HB3  GLU  46           1HB      GLU  46  18.734  -2.904   7.419
  323    HG2  GLU  46           2HG      GLU  46  17.875  -4.346   5.159
  324    HG3  GLU  46           1HG      GLU  46  19.296  -3.424   4.671
  325    H    GLU  47           H        GLU  47  16.445  -0.281   5.434
  326    HA   GLU  47           HA       GLU  47  16.398   1.242   7.920
  327    HB2  GLU  47           2HB      GLU  47  16.119   2.344   5.127
  328    HB3  GLU  47           1HB      GLU  47  16.631   3.192   6.581
  329    HG2  GLU  47           2HG      GLU  47  18.170   1.034   5.154
  330    HG3  GLU  47           1HG      GLU  47  18.504   2.764   5.096
  331    H    PHE  48           H        PHE  48  14.286   0.131   5.391
  332    HA   PHE  48           HA       PHE  48  12.097   1.846   5.856
  333    HB2  PHE  48           2HB      PHE  48  12.689  -0.148   4.051
  334    HB3  PHE  48           1HB      PHE  48  11.409  -0.878   5.011
  335    HD1  PHE  48           1HD      PHE  48   9.832   1.602   5.630
  336    HD2  PHE  48           2HD      PHE  48  11.596   0.203   2.018
  337    HE1  PHE  48           1HE      PHE  48   8.152   2.846   4.331
  338    HE2  PHE  48           2HE      PHE  48   9.920   1.444   0.713
  339    HZ   PHE  48           HZ       PHE  48   8.195   2.768   1.870
  340    H    ARG  49           H        ARG  49  13.112  -1.184   7.320
  341    HA   ARG  49           HA       ARG  49  10.783  -1.826   8.718
  342    HB2  ARG  49           2HB      ARG  49  13.680  -2.323   9.415
  343    HB3  ARG  49           1HB      ARG  49  12.329  -3.035  10.288
  344    HG2  ARG  49           2HG      ARG  49  11.843  -4.499   8.627
  345    HG3  ARG  49           1HG      ARG  49  12.383  -3.404   7.353
  346    HD2  ARG  49           2HD      ARG  49  14.533  -4.117   7.464
  347    HD3  ARG  49           1HD      ARG  49  14.461  -4.402   9.203
  348    HE   ARG  49           HE       ARG  49  12.851  -6.317   8.022
  349   HH11  ARG  49          1HH1      ARG  49  16.219  -5.407   7.958
  350   HH12  ARG  49          2HH1      ARG  49  16.777  -7.014   7.636
  351   HH21  ARG  49          1HH2      ARG  49  13.582  -8.432   7.598
  352   HH22  ARG  49          2HH2      ARG  49  15.280  -8.732   7.431
  353    H    GLY  50           H        GLY  50  13.586   0.103   9.771
  354    HA2  GLY  50           2HA      GLY  50  12.701   0.696  12.348
  355    HA3  GLY  50           1HA      GLY  50  13.786   1.705  11.403
  356    H    ILE  51           H        ILE  51  11.698   2.005   9.288
  357    HA   ILE  51           HA       ILE  51  10.366   4.283  10.483
  358    HB   ILE  51           HB       ILE  51  10.158   3.284   7.641
  359   HG12  ILE  51          2HG1      ILE  51  11.952   5.505   8.602
  360   HG13  ILE  51          1HG1      ILE  51  12.511   3.838   8.516
  361   HG21  ILE  51          1HG2      ILE  51   9.888   6.144   8.296
  362   HG22  ILE  51          2HG2      ILE  51   8.585   5.098   8.866
  363   HG23  ILE  51          3HG2      ILE  51   8.990   5.149   7.150
  364   HD11  ILE  51          3HD1      ILE  51  13.182   5.034   6.543
  365   HD12  ILE  51          1HD1      ILE  51  11.515   5.518   6.228
  366   HD13  ILE  51          2HD1      ILE  51  11.978   3.819   6.114
  367    H    ILE  52           H        ILE  52   9.458   1.233   8.920
  368    HA   ILE  52           HA       ILE  52   6.660   1.619   9.118
  369    HB   ILE  52           HB       ILE  52   8.256  -0.933   8.865
  370   HG12  ILE  52          2HG1      ILE  52   8.496   0.698   7.005
  371   HG13  ILE  52          1HG1      ILE  52   7.712  -0.799   6.505
  372   HG21  ILE  52          1HG2      ILE  52   6.173  -1.614   9.703
  373   HG22  ILE  52          2HG2      ILE  52   6.045  -1.817   7.955
  374   HG23  ILE  52          3HG2      ILE  52   5.299  -0.423   8.738
  375   HD11  ILE  52          3HD1      ILE  52   6.134   0.468   5.607
  376   HD12  ILE  52          1HD1      ILE  52   6.744   1.916   6.407
  377   HD13  ILE  52          2HD1      ILE  52   5.617   0.850   7.248
  378    H    ARG  53           H        ARG  53   9.070   0.416  11.333
  379    HA   ARG  53           HA       ARG  53   7.558  -1.063  13.105
  380    HB2  ARG  53           2HB      ARG  53  10.129  -0.271  13.050
  381    HB3  ARG  53           1HB      ARG  53   9.525   0.806  14.302
  382    HG2  ARG  53           2HG      ARG  53   8.783  -2.041  14.546
  383    HG3  ARG  53           1HG      ARG  53  10.482  -1.636  14.801
  384    HD2  ARG  53           2HD      ARG  53   9.359   0.290  16.274
  385    HD3  ARG  53           1HD      ARG  53   8.093  -0.930  16.401
  386    HE   ARG  53           HE       ARG  53   9.458  -2.139  17.775
  387   HH11  ARG  53          1HH1      ARG  53  11.404   0.178  16.037
  388   HH12  ARG  53          2HH1      ARG  53  12.845  -0.175  16.930
  389   HH21  ARG  53          1HH2      ARG  53  11.352  -2.604  18.950
  390   HH22  ARG  53          2HH2      ARG  53  12.816  -1.756  18.584
  391    H    ASP  54           H        ASP  54   8.255   2.426  13.347
  392    HA   ASP  54           HA       ASP  54   5.853   2.698  15.026
  393    HB2  ASP  54           2HB      ASP  54   8.364   3.403  15.719
  394    HB3  ASP  54           1HB      ASP  54   7.833   4.902  14.961
  395    H    GLY  55           H        GLY  55   6.381   2.860  11.953
  396    HA2  GLY  55           2HA      GLY  55   5.370   5.577  11.495
  397    HA3  GLY  55           1HA      GLY  55   6.029   4.507  10.268
  398    H    LEU  56           H        LEU  56   4.722   2.808   9.450
  399    HA   LEU  56           HA       LEU  56   1.862   3.406   9.666
  400    HB2  LEU  56           2HB      LEU  56   3.073   1.560   7.637
  401    HB3  LEU  56           1HB      LEU  56   1.579   2.474   7.538
  402    HG   LEU  56           HG       LEU  56   4.271   3.820   7.579
  403   HD11  LEU  56          1HD1      LEU  56   3.672   4.010   5.023
  404   HD12  LEU  56          2HD1      LEU  56   2.839   2.488   5.340
  405   HD13  LEU  56          3HD1      LEU  56   4.569   2.629   5.653
  406   HD21  LEU  56          3HD2      LEU  56   1.464   4.641   7.268
  407   HD22  LEU  56          1HD2      LEU  56   2.596   5.368   6.128
  408   HD23  LEU  56          2HD2      LEU  56   2.856   5.547   7.864
  409    HA   PRO  57           HA       PRO  57   1.271  -0.400  11.878
  410    HB2  PRO  57           2HB      PRO  57  -1.409  -0.506  11.854
  411    HB3  PRO  57           1HB      PRO  57  -0.541   0.717  12.789
  412    HG2  PRO  57           2HG      PRO  57  -1.879   0.966  10.125
  413    HG3  PRO  57           1HG      PRO  57  -1.891   2.093  11.492
  414    HD2  PRO  57           2HD      PRO  57  -0.271   2.363   9.291
  415    HD3  PRO  57           1HD      PRO  57   0.108   3.030  10.891
  416    H    MET  58           H        MET  58   2.215  -1.085   9.504
  417    HA   MET  58           HA       MET  58   0.237  -2.710   8.101
  418    HB2  MET  58           2HB      MET  58   1.955  -1.232   6.922
  419    HB3  MET  58           1HB      MET  58   3.158  -2.416   7.411
  420    HG2  MET  58           2HG      MET  58   2.461  -3.951   5.915
  421    HG3  MET  58           1HG      MET  58   0.772  -3.465   6.029
  422    HE1  MET  58           3HE      MET  58   3.308  -2.910   2.586
  423    HE2  MET  58           1HE      MET  58   3.394  -4.025   3.950
  424    HE3  MET  58           2HE      MET  58   4.277  -2.499   4.001
  425    H    THR  59           H        THR  59   0.258  -4.923   8.051
  426    HA   THR  59           HA       THR  59   1.603  -6.257  10.203
  427    HB   THR  59           HB       THR  59   0.569  -8.311   8.843
  428    HG1  THR  59           1HG      THR  59  -1.306  -7.597   7.761
  429   HG21  THR  59          3HG2      THR  59  -0.443  -6.553  10.886
  430   HG22  THR  59          1HG2      THR  59  -0.635  -8.296  10.697
  431   HG23  THR  59          2HG2      THR  59  -1.747  -7.193   9.884
  432    H    GLU  60           H        GLU  60   3.237  -7.740  10.123
  433    HA   GLU  60           HA       GLU  60   5.406  -7.454   8.544
  434    HB2  GLU  60           2HB      GLU  60   5.848  -9.947   9.000
  435    HB3  GLU  60           1HB      GLU  60   5.667  -8.880  10.385
  436    HG2  GLU  60           2HG      GLU  60   3.217  -9.614  10.393
  437    HG3  GLU  60           1HG      GLU  60   3.735 -10.901   9.305
  438    H    ALA  61           H        ALA  61   2.846  -9.805   7.949
  439    HA   ALA  61           HA       ALA  61   3.711 -11.049   5.701
  440    HB1  ALA  61           1HB      ALA  61   0.927 -10.429   5.376
  441    HB2  ALA  61           2HB      ALA  61   1.280 -10.800   7.064
  442    HB3  ALA  61           3HB      ALA  61   1.691 -11.960   5.800
  443    H    GLU  62           H        GLU  62   1.739  -8.074   5.722
  444    HA   GLU  62           HA       GLU  62   1.777  -7.629   2.969
  445    HB2  GLU  62           2HB      GLU  62   1.971  -5.177   4.590
  446    HB3  GLU  62           1HB      GLU  62   0.780  -5.637   3.388
  447    HG2  GLU  62           2HG      GLU  62   0.869  -6.456   6.274
  448    HG3  GLU  62           1HG      GLU  62  -0.303  -5.396   5.495
  449    H    ILE  63           H        ILE  63   3.863  -6.048   5.396
  450    HA   ILE  63           HA       ILE  63   5.631  -4.868   3.559
  451    HB   ILE  63           HB       ILE  63   6.566  -5.823   6.250
  452   HG12  ILE  63          2HG1      ILE  63   5.618  -3.267   6.679
  453   HG13  ILE  63          1HG1      ILE  63   4.359  -3.992   5.684
  454   HG21  ILE  63          1HG2      ILE  63   7.971  -4.575   4.440
  455   HG22  ILE  63          2HG2      ILE  63   8.100  -4.109   6.137
  456   HG23  ILE  63          3HG2      ILE  63   7.111  -3.153   5.031
  457   HD11  ILE  63          3HD1      ILE  63   3.576  -4.719   7.640
  458   HD12  ILE  63          1HD1      ILE  63   5.134  -4.554   8.446
  459   HD13  ILE  63          2HD1      ILE  63   4.800  -5.974   7.452
  460    H    THR  64           H        THR  64   6.234  -7.739   5.567
  461    HA   THR  64           HA       THR  64   8.599  -8.583   4.461
  462    HB   THR  64           HB       THR  64   6.304 -10.240   5.487
  463    HG1  THR  64           1HG      THR  64   7.103  -8.886   7.059
  464   HG21  THR  64          3HG2      THR  64   9.172 -11.052   5.116
  465   HG22  THR  64          1HG2      THR  64   7.777 -11.686   4.242
  466   HG23  THR  64          2HG2      THR  64   7.943 -11.982   5.974
  467    H    GLU  65           H        GLU  65   5.321  -9.598   3.462
  468    HA   GLU  65           HA       GLU  65   6.255 -11.130   1.277
  469    HB2  GLU  65           2HB      GLU  65   3.537  -9.904   1.680
  470    HB3  GLU  65           1HB      GLU  65   3.923 -11.129   0.481
  471    HG2  GLU  65           2HG      GLU  65   4.081 -12.807   2.032
  472    HG3  GLU  65           1HG      GLU  65   4.486 -11.701   3.346
  473    H    PHE  66           H        PHE  66   5.986  -7.897   1.781
  474    HA   PHE  66           HA       PHE  66   5.871  -7.212  -1.035
  475    HB2  PHE  66           2HB      PHE  66   5.581  -5.651   1.497
  476    HB3  PHE  66           1HB      PHE  66   6.107  -4.807   0.047
  477    HD1  PHE  66           1HD      PHE  66   3.786  -7.654  -0.065
  478    HD2  PHE  66           2HD      PHE  66   4.171  -3.415  -0.101
  479    HE1  PHE  66           1HE      PHE  66   1.449  -7.451  -0.803
  480    HE2  PHE  66           2HE      PHE  66   1.834  -3.206  -0.838
  481    HZ   PHE  66           HZ       PHE  66   0.469  -5.225  -1.190
  482    H    PHE  67           H        PHE  67   8.087  -7.478   1.613
  483    HA   PHE  67           HA       PHE  67  10.181  -5.906   0.443
  484    HB2  PHE  67           2HB      PHE  67   9.937  -7.745   2.787
  485    HB3  PHE  67           1HB      PHE  67  11.543  -7.325   2.208
  486    HD1  PHE  67           1HD      PHE  67  10.520  -4.426   1.356
  487    HD2  PHE  67           2HD      PHE  67  10.387  -6.737   4.932
  488    HE1  PHE  67           1HE      PHE  67  10.433  -2.362   2.685
  489    HE2  PHE  67           2HE      PHE  67  10.297  -4.670   6.264
  490    HZ   PHE  67           HZ       PHE  67  10.320  -2.482   5.141
  491    H    GLU  68           H        GLU  68   9.180  -9.239   0.313
  492    HA   GLU  68           HA       GLU  68  11.616 -10.033  -1.079
  493    HB2  GLU  68           2HB      GLU  68  10.471 -12.305  -1.088
  494    HB3  GLU  68           1HB      GLU  68  10.914 -11.657   0.485
  495    HG2  GLU  68           2HG      GLU  68   8.797 -11.575   1.179
  496    HG3  GLU  68           1HG      GLU  68   8.221 -10.922  -0.355
  497    H    ALA  69           H        ALA  69   8.328  -9.169  -1.730
  498    HA   ALA  69           HA       ALA  69   8.388 -10.257  -4.409
  499    HB1  ALA  69           1HB      ALA  69   6.327 -10.371  -3.071
  500    HB2  ALA  69           2HB      ALA  69   6.099  -9.502  -4.590
  501    HB3  ALA  69           3HB      ALA  69   6.269  -8.609  -3.078
  502    H    ALA  70           H        ALA  70   9.326  -7.510  -2.906
  503    HA   ALA  70           HA       ALA  70   8.997  -5.796  -5.258
  504    HB1  ALA  70           1HB      ALA  70   9.999  -5.022  -2.520
  505    HB2  ALA  70           2HB      ALA  70   8.318  -4.913  -3.043
  506    HB3  ALA  70           3HB      ALA  70   9.552  -3.937  -3.836
  507    H    ASP  71           H        ASP  71  11.399  -7.484  -3.399
  508    HA   ASP  71           HA       ASP  71  13.492  -6.402  -5.169
  509    HB2  ASP  71           2HB      ASP  71  13.741  -5.795  -2.751
  510    HB3  ASP  71           1HB      ASP  71  13.889  -7.512  -2.385
  511    HA   PRO  72           HA       PRO  72  13.467 -10.673  -6.595
  512    HB2  PRO  72           2HB      PRO  72  15.473 -10.360  -8.422
  513    HB3  PRO  72           1HB      PRO  72  13.792  -9.907  -8.726
  514    HG2  PRO  72           2HG      PRO  72  16.103  -8.187  -7.918
  515    HG3  PRO  72           1HG      PRO  72  14.829  -7.864  -9.108
  516    HD2  PRO  72           2HD      PRO  72  14.780  -6.796  -6.633
  517    HD3  PRO  72           1HD      PRO  72  13.294  -7.258  -7.490
  518    H    ASN  73           H        ASN  73  16.598  -9.004  -6.177
  519    HA   ASN  73           HA       ASN  73  18.033 -11.383  -5.603
  520    HB2  ASN  73           2HB      ASN  73  18.681  -8.473  -5.100
  521    HB3  ASN  73           1HB      ASN  73  19.810  -9.790  -4.794
  522   HD21  ASN  73          1HD2      ASN  73  18.394  -7.746  -7.133
  523   HD22  ASN  73          2HD2      ASN  73  19.235  -8.359  -8.511
  524    H    ASN  74           H        ASN  74  16.314  -9.054  -3.640
  525    HA   ASN  74           HA       ASN  74  15.585  -9.155  -1.484
  526    HB2  ASN  74           2HB      ASN  74  16.923 -11.845  -1.209
  527    HB3  ASN  74           1HB      ASN  74  15.571 -11.207  -0.280
  528   HD21  ASN  74          1HD2      ASN  74  13.614 -10.657  -1.625
  529   HD22  ASN  74          2HD2      ASN  74  13.179 -11.789  -2.856
  530    H    THR  75           H        THR  75  18.162  -8.097  -2.313
  531    HA   THR  75           HA       THR  75  20.137  -8.709  -0.378
  532    HB   THR  75           HB       THR  75  21.316  -6.770  -1.214
  533    HG1  THR  75           1HG      THR  75  18.917  -6.097  -2.567
  534   HG21  THR  75          3HG2      THR  75  21.576  -7.300  -3.462
  535   HG22  THR  75          1HG2      THR  75  19.898  -7.816  -3.630
  536   HG23  THR  75          2HG2      THR  75  21.039  -8.808  -2.724
  537    H    GLY  76           H        GLY  76  17.329  -6.711  -0.337
  538    HA2  GLY  76           2HA      GLY  76  16.504  -6.118   1.896
  539    HA3  GLY  76           1HA      GLY  76  18.153  -5.666   2.301
  540    H    PHE  77           H        PHE  77  17.009  -4.835  -0.842
  541    HA   PHE  77           HA       PHE  77  16.334  -2.118   0.028
  542    HB2  PHE  77           2HB      PHE  77  18.199  -2.683  -2.284
  543    HB3  PHE  77           1HB      PHE  77  17.754  -1.108  -1.637
  544    HD1  PHE  77           2HD      PHE  77  19.311  -4.309  -0.523
  545    HD2  PHE  77           1HD      PHE  77  19.219  -0.067  -0.212
  546    HE1  PHE  77           2HE      PHE  77  21.260  -4.381   0.975
  547    HE2  PHE  77           1HE      PHE  77  21.168  -0.130   1.286
  548    HZ   PHE  77           HZ       PHE  77  22.191  -2.290   1.883
  549    H    ILE  78           H        ILE  78  14.982  -0.965  -1.416
  550    HA   ILE  78           HA       ILE  78  13.864  -2.537  -3.641
  551    HB   ILE  78           HB       ILE  78  12.089  -0.809  -1.957
  552   HG12  ILE  78          2HG1      ILE  78  11.902  -3.710  -1.495
  553   HG13  ILE  78          1HG1      ILE  78  13.323  -2.937  -0.793
  554   HG21  ILE  78          1HG2      ILE  78  10.328  -1.921  -3.005
  555   HG22  ILE  78          2HG2      ILE  78  11.360  -3.248  -3.538
  556   HG23  ILE  78          3HG2      ILE  78  11.510  -1.659  -4.285
  557   HD11  ILE  78          3HD1      ILE  78  12.043  -2.350   0.916
  558   HD12  ILE  78          1HD1      ILE  78  10.588  -2.899   0.081
  559   HD13  ILE  78          2HD1      ILE  78  11.188  -1.258  -0.177
  560    H    ASP  79           H        ASP  79  13.101  -1.362  -5.388
  561    HA   ASP  79           HA       ASP  79  14.184   1.287  -5.686
  562    HB2  ASP  79           2HB      ASP  79  12.275  -0.118  -7.567
  563    HB3  ASP  79           1HB      ASP  79  13.408   1.174  -7.952
  564    H    TYR  80           H        TYR  80  13.187   2.823  -4.533
  565    HA   TYR  80           HA       TYR  80  10.898   3.048  -3.293
  566    HB2  TYR  80           2HB      TYR  80  12.472   4.911  -3.483
  567    HB3  TYR  80           1HB      TYR  80  11.928   5.221  -5.126
  568    HD1  TYR  80           1HD      TYR  80  10.101   4.586  -1.925
  569    HD2  TYR  80           2HD      TYR  80  10.780   7.221  -5.195
  570    HE1  TYR  80           1HE      TYR  80   8.367   6.099  -1.059
  571    HE2  TYR  80           2HE      TYR  80   9.049   8.742  -4.337
  572    HH   TYR  80           HH       TYR  80   7.998   9.243  -2.066
  573    H    LYS  81           H        LYS  81  11.068   3.357  -6.822
  574    HA   LYS  81           HA       LYS  81   8.365   4.066  -7.196
  575    HB2  LYS  81           2HB      LYS  81  10.385   2.764  -9.021
  576    HB3  LYS  81           1HB      LYS  81   8.756   3.166  -9.548
  577    HG2  LYS  81           2HG      LYS  81   9.657   5.110 -10.171
  578    HG3  LYS  81           1HG      LYS  81   9.574   5.522  -8.457
  579    HD2  LYS  81           2HD      LYS  81  11.898   4.346  -8.346
  580    HD3  LYS  81           1HD      LYS  81  11.922   4.641 -10.086
  581    HE2  LYS  81           2HE      LYS  81  12.886   6.581  -9.402
  582    HE3  LYS  81           1HE      LYS  81  11.196   7.070  -9.282
  583    HZ1  LYS  81           3HZ      LYS  81  11.429   6.164  -6.881
  584    HZ2  LYS  81           1HZ      LYS  81  12.028   7.701  -7.253
  585    HZ3  LYS  81           2HZ      LYS  81  13.085   6.388  -7.136
  586    H    ALA  82           H        ALA  82   9.982   0.902  -7.505
  587    HA   ALA  82           HA       ALA  82   7.781  -0.658  -8.108
  588    HB1  ALA  82           1HB      ALA  82  10.448  -1.118  -7.366
  589    HB2  ALA  82           2HB      ALA  82   9.289  -2.290  -7.992
  590    HB3  ALA  82           3HB      ALA  82   9.464  -2.067  -6.250
  591    H    PHE  83           H        PHE  83   8.680   0.825  -5.110
  592    HA   PHE  83           HA       PHE  83   6.697  -0.683  -3.600
  593    HB2  PHE  83           2HB      PHE  83   9.166   0.548  -2.979
  594    HB3  PHE  83           1HB      PHE  83   7.927   1.425  -2.085
  595    HD1  PHE  83           2HD      PHE  83   8.116  -2.165  -3.004
  596    HD2  PHE  83           1HD      PHE  83   8.148   0.724   0.119
  597    HE1  PHE  83           2HE      PHE  83   8.074  -3.971  -1.341
  598    HE2  PHE  83           1HE      PHE  83   8.105  -1.080   1.793
  599    HZ   PHE  83           HZ       PHE  83   8.068  -3.432   1.063
  600    H    ALA  84           H        ALA  84   7.259   2.506  -4.921
  601    HA   ALA  84           HA       ALA  84   5.033   3.722  -3.565
  602    HB1  ALA  84           1HB      ALA  84   7.037   4.999  -4.245
  603    HB2  ALA  84           2HB      ALA  84   5.538   5.686  -4.872
  604    HB3  ALA  84           3HB      ALA  84   6.591   4.749  -5.933
  605    H    ALA  85           H        ALA  85   5.436   1.829  -6.393
  606    HA   ALA  85           HA       ALA  85   3.244   2.847  -7.872
  607    HB1  ALA  85           1HB      ALA  85   4.533   0.146  -8.078
  608    HB2  ALA  85           2HB      ALA  85   5.094   1.597  -8.908
  609    HB3  ALA  85           3HB      ALA  85   3.515   0.913  -9.297
  610    H    MET  86           H        MET  86   3.413   1.055  -5.140
  611    HA   MET  86           HA       MET  86   1.129  -0.626  -5.465
  612    HB2  MET  86           2HB      MET  86   2.945   0.108  -3.229
  613    HB3  MET  86           1HB      MET  86   1.352  -0.500  -2.798
  614    HG2  MET  86           2HG      MET  86   2.396  -2.483  -2.882
  615    HG3  MET  86           1HG      MET  86   2.058  -2.344  -4.607
  616    HE1  MET  86           3HE      MET  86   3.617  -3.446  -5.865
  617    HE2  MET  86           1HE      MET  86   4.354  -4.343  -4.537
  618    HE3  MET  86           2HE      MET  86   5.372  -3.483  -5.693
  619    H    LEU  87           H        LEU  87   1.719   2.528  -3.976
  620    HA   LEU  87           HA       LEU  87  -1.048   2.808  -3.231
  621    HB2  LEU  87           2HB      LEU  87   1.327   4.602  -2.993
  622    HB3  LEU  87           1HB      LEU  87  -0.279   5.106  -2.501
  623    HG   LEU  87           HG       LEU  87  -0.295   3.152  -0.901
  624   HD11  LEU  87          1HD1      LEU  87   1.298   1.639  -1.472
  625   HD12  LEU  87          2HD1      LEU  87   2.240   2.595  -0.328
  626   HD13  LEU  87          3HD1      LEU  87   2.415   2.869  -2.061
  627   HD21  LEU  87          3HD2      LEU  87   2.007   4.785  -0.069
  628   HD22  LEU  87          1HD2      LEU  87   0.459   4.508   0.730
  629   HD23  LEU  87          2HD2      LEU  87   0.578   5.687  -0.575
  630    H    TYR  88           H        TYR  88   0.640   3.184  -5.900
  631    HA   TYR  88           HA       TYR  88  -1.249   5.120  -7.049
  632    HB2  TYR  88           2HB      TYR  88   1.695   4.826  -7.663
  633    HB3  TYR  88           1HB      TYR  88   0.585   5.804  -8.617
  634    HD1  TYR  88           2HD      TYR  88  -0.957   7.353  -6.893
  635    HD2  TYR  88           1HD      TYR  88   3.058   6.079  -6.303
  636    HE1  TYR  88           2HE      TYR  88  -0.581   9.259  -5.385
  637    HE2  TYR  88           1HE      TYR  88   3.447   7.981  -4.794
  638    HH   TYR  88           HH       TYR  88   2.520  10.200  -4.352
  639    H    SER  89           H        SER  89  -1.137   2.112  -6.928
  640    HA   SER  89           HA       SER  89  -0.664   1.278  -9.643
  641    HB2  SER  89           2HB      SER  89  -0.577  -0.069  -7.322
  642    HB3  SER  89           1HB      SER  89  -2.228  -0.453  -7.802
  643    HG   SER  89           HG       SER  89   0.175  -1.245  -8.914
  644    H    VAL  90           H        VAL  90  -2.179   2.981 -10.474
  645    HA   VAL  90           HA       VAL  90  -4.797   1.765 -10.902
  646    HB   VAL  90           HB       VAL  90  -4.581   4.683 -10.168
  647   HG11  VAL  90          1HG1      VAL  90  -7.135   4.041  -9.740
  648   HG12  VAL  90          2HG1      VAL  90  -6.761   2.857 -10.992
  649   HG13  VAL  90          3HG1      VAL  90  -6.540   4.576 -11.311
  650   HG21  VAL  90          3HG2      VAL  90  -5.104   2.282  -8.461
  651   HG22  VAL  90          1HG2      VAL  90  -5.850   3.831  -8.071
  652   HG23  VAL  90          2HG2      VAL  90  -4.092   3.690  -8.132
  653    H    ASP  91           H        ASP  91  -2.396   2.140 -12.518
  654    HA   ASP  91           HA       ASP  91  -3.584   2.940 -14.932
  655    HB2  ASP  91           2HB      ASP  91  -2.152   4.982 -15.356
  656    HB3  ASP  91           1HB      ASP  91  -3.459   5.205 -14.196
  657    H    GLU  92           H        GLU  92  -2.553   1.827 -16.448
  658    HA   GLU  92           HA       GLU  92  -0.013   0.601 -15.879
  659    HB2  GLU  92           2HB      GLU  92  -1.714   0.539 -18.378
  660    HB3  GLU  92           1HB      GLU  92  -0.297  -0.461 -18.093
  661    HG2  GLU  92           2HG      GLU  92  -2.486  -0.549 -16.094
  662    HG3  GLU  92           1HG      GLU  92  -2.749  -1.334 -17.651
  663    H    SER  93           H        SER  93   1.957   1.106 -16.682
  664    HA   SER  93           HA       SER  93   2.147   3.221 -18.705
  665    HB2  SER  93           2HB      SER  93   2.529   3.842 -16.106
  666    HB3  SER  93           1HB      SER  93   4.159   3.320 -16.532
  667    HG   SER  93           HG       SER  93   2.820   5.589 -17.230
  Start of MODEL    6
    1    H1   MET   1           1HT      MET   1 -56.830  -8.962  10.547
    2    H2   MET   1           2HT      MET   1 -55.904  -8.065   9.415
    3    H3   MET   1           3HT      MET   1 -56.945  -7.253  10.510
    4    HA   MET   1           HA       MET   1 -55.635  -7.958  12.345
    5    HB2  MET   1           2HB      MET   1 -54.155  -9.399  10.153
    6    HB3  MET   1           1HB      MET   1 -53.375  -9.021  11.682
    7    HG2  MET   1           2HG      MET   1 -55.938 -10.575  11.472
    8    HG3  MET   1           1HG      MET   1 -54.342 -11.321  11.497
    9    HE1  MET   1           2HE      MET   1 -53.765 -12.009  14.960
   10    HE2  MET   1           3HE      MET   1 -52.659 -11.015  14.014
   11    HE3  MET   1           1HE      MET   1 -53.550 -12.323  13.238
   12    H    GLY   2           H        GLY   2 -53.583  -6.881  12.956
   13    HA2  GLY   2           2HA      GLY   2 -52.666  -4.894  10.994
   14    HA3  GLY   2           1HA      GLY   2 -53.278  -4.339  12.544
   15    H    SER   3           H        SER   3 -50.717  -6.127  10.944
   16    HA   SER   3           HA       SER   3 -48.758  -5.201  12.770
   17    HB2  SER   3           2HB      SER   3 -49.909  -7.916  13.201
   18    HB3  SER   3           1HB      SER   3 -48.163  -7.730  13.376
   19    HG   SER   3           HG       SER   3 -50.230  -6.451  14.819
   20    H    SER   4           H        SER   4 -49.194  -5.291   9.941
   21    HA   SER   4           HA       SER   4 -46.699  -6.603   9.159
   22    HB2  SER   4           2HB      SER   4 -49.005  -7.862   8.578
   23    HB3  SER   4           1HB      SER   4 -48.910  -6.783   7.186
   24    HG   SER   4           HG       SER   4 -46.684  -7.616   6.977
   25    H    HIS   5           H        HIS   5 -45.470  -5.394   7.837
   26    HA   HIS   5           HA       HIS   5 -46.463  -3.530   5.959
   27    HB2  HIS   5           2HB      HIS   5 -47.002  -2.248   7.995
   28    HB3  HIS   5           1HB      HIS   5 -45.316  -2.334   8.491
   29    HD1  HIS   5           1HD      HIS   5 -45.974   0.409   8.383
   30    HD2  HIS   5           2HD      HIS   5 -45.215  -1.621   4.838
   31    HE1  HIS   5           1HE      HIS   5 -45.412   2.189   6.697
   32    HE2  HIS   5           2HE      HIS   5 -45.041   0.942   4.539
   33    H    HIS   6           H        HIS   6 -43.676  -3.450   8.183
   34    HA   HIS   6           HA       HIS   6 -41.433  -3.536   7.816
   35    HB2  HIS   6           2HB      HIS   6 -42.549  -5.655   6.368
   36    HB3  HIS   6           1HB      HIS   6 -41.425  -4.890   5.249
   37    HD1  HIS   6           1HD      HIS   6 -39.521  -4.093   7.831
   38    HD2  HIS   6           2HD      HIS   6 -40.761  -7.849   6.557
   39    HE1  HIS   6           1HE      HIS   6 -37.829  -5.709   8.754
   40    HE2  HIS   6           2HE      HIS   6 -38.552  -7.965   7.897
   41    H    HIS   7           H        HIS   7 -39.672  -2.927   6.220
   42    HA   HIS   7           HA       HIS   7 -40.229  -1.507   3.865
   43    HB2  HIS   7           2HB      HIS   7 -41.120  -0.048   5.958
   44    HB3  HIS   7           1HB      HIS   7 -39.450   0.507   5.892
   45    HD1  HIS   7           1HD      HIS   7 -42.096   2.166   5.131
   46    HD2  HIS   7           2HD      HIS   7 -39.359   0.472   2.505
   47    HE1  HIS   7           1HE      HIS   7 -42.324   3.467   2.993
   48    HE2  HIS   7           2HE      HIS   7 -40.719   2.369   1.390
   49    H    HIS   8           H        HIS   8 -38.385  -1.261   2.751
   50    HA   HIS   8           HA       HIS   8 -35.854  -0.902   4.129
   51    HB2  HIS   8           2HB      HIS   8 -36.571  -3.465   3.694
   52    HB3  HIS   8           1HB      HIS   8 -35.807  -3.108   2.148
   53    HD1  HIS   8           1HD      HIS   8 -34.961  -4.590   5.178
   54    HD2  HIS   8           2HD      HIS   8 -33.126  -1.677   2.850
   55    HE1  HIS   8           1HE      HIS   8 -32.546  -4.594   5.876
   56    HE2  HIS   8           2HE      HIS   8 -31.473  -2.766   4.515
   57    H    HIS   9           H        HIS   9 -37.372   0.758   2.391
   58    HA   HIS   9           HA       HIS   9 -35.888   0.687  -0.134
   59    HB2  HIS   9           2HB      HIS   9 -38.466   1.880   0.751
   60    HB3  HIS   9           1HB      HIS   9 -37.575   2.728  -0.509
   61    HD1  HIS   9           1HD      HIS   9 -37.519   1.671  -2.828
   62    HD2  HIS   9           2HD      HIS   9 -39.436  -0.680   0.011
   63    HE1  HIS   9           1HE      HIS   9 -38.658  -0.156  -4.127
   64    HE2  HIS   9           2HE      HIS   9 -39.736  -1.618  -2.379
   65    H    HIS  10           H        HIS  10 -34.598   1.452   2.347
   66    HA   HIS  10           HA       HIS  10 -33.584   4.038   1.481
   67    HB2  HIS  10           2HB      HIS  10 -33.755   5.031   3.716
   68    HB3  HIS  10           1HB      HIS  10 -35.348   4.618   3.090
   69    HD1  HIS  10           1HD      HIS  10 -32.742   3.178   5.451
   70    HD2  HIS  10           2HD      HIS  10 -36.844   3.118   4.788
   71    HE1  HIS  10           1HE      HIS  10 -33.716   1.887   7.376
   72    HE2  HIS  10           2HE      HIS  10 -36.189   1.788   6.907
   73    H    SER  11           H        SER  11 -32.568   1.315   1.518
   74    HA   SER  11           HA       SER  11 -29.963   1.801   2.441
   75    HB2  SER  11           2HB      SER  11 -29.941   0.006   4.253
   76    HB3  SER  11           1HB      SER  11 -30.721   1.531   4.679
   77    HG   SER  11           HG       SER  11 -32.638   0.575   4.673
   78    H    SER  12           H        SER  12 -29.695   1.046   0.282
   79    HA   SER  12           HA       SER  12 -30.515  -1.464  -0.652
   80    HB2  SER  12           2HB      SER  12 -29.118  -1.086  -2.506
   81    HB3  SER  12           1HB      SER  12 -29.540   0.538  -1.965
   82    HG   SER  12           HG       SER  12 -27.108  -0.821  -1.805
   83    H    GLY  13           H        GLY  13 -30.048  -3.335   0.308
   84    HA2  GLY  13           2HA      GLY  13 -27.441  -3.685   1.598
   85    HA3  GLY  13           1HA      GLY  13 -28.840  -4.730   1.793
   86    H    LEU  14           H        LEU  14 -27.454  -3.614  -1.256
   87    HA   LEU  14           HA       LEU  14 -27.042  -6.417  -2.007
   88    HB2  LEU  14           2HB      LEU  14 -27.210  -3.900  -3.662
   89    HB3  LEU  14           1HB      LEU  14 -26.843  -5.481  -4.325
   90    HG   LEU  14           HG       LEU  14 -29.354  -5.146  -2.747
   91   HD11  LEU  14          1HD1      LEU  14 -30.564  -4.398  -4.699
   92   HD12  LEU  14          2HD1      LEU  14 -29.074  -4.354  -5.641
   93   HD13  LEU  14          3HD1      LEU  14 -29.299  -3.233  -4.299
   94   HD21  LEU  14          3HD2      LEU  14 -28.377  -7.324  -3.742
   95   HD22  LEU  14          1HD2      LEU  14 -28.955  -6.688  -5.282
   96   HD23  LEU  14          2HD2      LEU  14 -30.092  -6.977  -3.965
   97    H    VAL  15           H        VAL  15 -25.197  -4.997  -0.257
   98    HA   VAL  15           HA       VAL  15 -22.762  -5.643  -1.651
   99    HB   VAL  15           HB       VAL  15 -21.712  -3.398  -1.087
  100   HG11  VAL  15          1HG1      VAL  15 -22.385  -4.207  -3.378
  101   HG12  VAL  15          2HG1      VAL  15 -22.285  -2.458  -3.186
  102   HG13  VAL  15          3HG1      VAL  15 -23.858  -3.254  -3.192
  103   HG21  VAL  15          3HG2      VAL  15 -23.416  -1.500  -1.154
  104   HG22  VAL  15          1HG2      VAL  15 -23.269  -2.396   0.358
  105   HG23  VAL  15          2HG2      VAL  15 -24.617  -2.720  -0.732
  106    HA   PRO  16           HA       PRO  16 -23.040  -6.511   2.981
  107    HB2  PRO  16           2HB      PRO  16 -21.524  -8.848   1.925
  108    HB3  PRO  16           1HB      PRO  16 -22.805  -8.794   3.141
  109    HG2  PRO  16           2HG      PRO  16 -23.309  -9.676   0.682
  110    HG3  PRO  16           1HG      PRO  16 -24.492  -8.680   1.552
  111    HD2  PRO  16           2HD      PRO  16 -22.645  -7.925  -0.668
  112    HD3  PRO  16           1HD      PRO  16 -24.301  -7.376  -0.339
  113    H    ARG  17           H        ARG  17 -20.278  -7.500   0.943
  114    HA   ARG  17           HA       ARG  17 -18.314  -6.906   2.860
  115    HB2  ARG  17           2HB      ARG  17 -16.723  -7.014   0.951
  116    HB3  ARG  17           1HB      ARG  17 -17.816  -8.389   1.027
  117    HG2  ARG  17           2HG      ARG  17 -18.041  -7.978  -1.169
  118    HG3  ARG  17           1HG      ARG  17 -19.215  -6.785  -0.610
  119    HD2  ARG  17           2HD      ARG  17 -16.920  -5.357  -0.449
  120    HD3  ARG  17           1HD      ARG  17 -16.556  -6.411  -1.815
  121    HE   ARG  17           HE       ARG  17 -18.428  -4.238  -1.755
  122   HH11  ARG  17          1HH1      ARG  17 -17.628  -7.266  -3.297
  123   HH12  ARG  17          2HH1      ARG  17 -18.468  -6.883  -4.764
  124   HH21  ARG  17          1HH2      ARG  17 -19.531  -3.734  -3.683
  125   HH22  ARG  17          2HH2      ARG  17 -19.547  -4.877  -4.983
  126    H    GLY  18           H        GLY  18 -17.336  -5.068   3.452
  127    HA2  GLY  18           2HA      GLY  18 -18.135  -2.606   2.065
  128    HA3  GLY  18           1HA      GLY  18 -17.511  -2.703   3.704
  129    H    SER  19           H        SER  19 -16.009  -4.423   1.068
  130    HA   SER  19           HA       SER  19 -13.555  -2.944   1.512
  131    HB2  SER  19           2HB      SER  19 -13.880  -5.111  -0.546
  132    HB3  SER  19           1HB      SER  19 -12.451  -4.679   0.396
  133    HG   SER  19           HG       SER  19 -13.768  -5.402   2.264
  134    H    HIS  20           H        HIS  20 -12.320  -2.992  -0.917
  135    HA   HIS  20           HA       HIS  20 -12.045  -1.788  -2.827
  136    HB2  HIS  20           2HB      HIS  20 -14.207  -3.239  -3.311
  137    HB3  HIS  20           1HB      HIS  20 -14.994  -1.664  -3.290
  138    HD1  HIS  20           1HD      HIS  20 -13.645  -3.923  -5.607
  139    HD2  HIS  20           2HD      HIS  20 -13.325   0.192  -5.111
  140    HE1  HIS  20           1HE      HIS  20 -12.920  -3.029  -7.844
  141    HE2  HIS  20           2HE      HIS  20 -12.818  -0.531  -7.542
  142    H    MET  21           H        MET  21 -11.405   0.004  -1.468
  143    HA   MET  21           HA       MET  21 -13.133   2.313  -1.892
  144    HB2  MET  21           2HB      MET  21 -12.345   1.225   0.763
  145    HB3  MET  21           1HB      MET  21 -12.342   2.972   0.568
  146    HG2  MET  21           2HG      MET  21 -14.636   3.047   0.137
  147    HG3  MET  21           1HG      MET  21 -14.718   1.317  -0.193
  148    HE1  MET  21           3HE      MET  21 -16.525   0.267   2.473
  149    HE2  MET  21           1HE      MET  21 -16.622   1.078   0.909
  150    HE3  MET  21           2HE      MET  21 -17.070   1.941   2.380
  151    H    SER  22           H        SER  22 -11.932   4.377  -1.256
  152    HA   SER  22           HA       SER  22  -9.184   4.122  -2.214
  153    HB2  SER  22           2HB      SER  22  -9.331   6.297  -3.079
  154    HB3  SER  22           1HB      SER  22 -10.943   5.639  -3.356
  155    HG   SER  22           HG       SER  22 -11.530   6.668  -1.326
  156    H    ASP  23           H        ASP  23 -10.569   4.125   0.622
  157    HA   ASP  23           HA       ASP  23  -8.897   6.078   1.948
  158    HB2  ASP  23           2HB      ASP  23 -10.887   4.134   3.087
  159    HB3  ASP  23           1HB      ASP  23 -10.084   5.414   3.996
  160    H    GLU  24           H        GLU  24  -8.776   2.911   1.079
  161    HA   GLU  24           HA       GLU  24  -7.275   1.792   3.173
  162    HB2  GLU  24           2HB      GLU  24  -7.387   1.009   0.270
  163    HB3  GLU  24           1HB      GLU  24  -6.651   0.033   1.534
  164    HG2  GLU  24           2HG      GLU  24  -9.411   0.821   2.088
  165    HG3  GLU  24           1HG      GLU  24  -9.218  -0.193   0.658
  166    H    LYS  25           H        LYS  25  -6.509   3.980   0.828
  167    HA   LYS  25           HA       LYS  25  -3.643   3.467   0.869
  168    HB2  LYS  25           2HB      LYS  25  -4.730   4.058  -1.269
  169    HB3  LYS  25           1HB      LYS  25  -5.210   5.605  -0.587
  170    HG2  LYS  25           2HG      LYS  25  -2.335   4.981  -0.454
  171    HG3  LYS  25           1HG      LYS  25  -3.002   5.242  -2.068
  172    HD2  LYS  25           2HD      LYS  25  -3.463   7.439  -1.669
  173    HD3  LYS  25           1HD      LYS  25  -3.752   7.179   0.052
  174    HE2  LYS  25           2HE      LYS  25  -1.758   8.197   0.281
  175    HE3  LYS  25           1HE      LYS  25  -1.121   6.597  -0.096
  176    HZ1  LYS  25           3HZ      LYS  25  -1.308   7.443  -2.524
  177    HZ2  LYS  25           1HZ      LYS  25   0.005   7.922  -1.570
  178    HZ3  LYS  25           2HZ      LYS  25  -1.294   8.977  -1.813
  179    H    THR  26           H        THR  26  -6.013   5.613   2.228
  180    HA   THR  26           HA       THR  26  -4.259   7.677   3.027
  181    HB   THR  26           HB       THR  26  -6.339   7.697   4.865
  182    HG1  THR  26           1HG      THR  26  -7.743   6.384   4.019
  183   HG21  THR  26          3HG2      THR  26  -7.211   9.081   2.572
  184   HG22  THR  26          1HG2      THR  26  -5.454   9.246   2.649
  185   HG23  THR  26          2HG2      THR  26  -6.452   9.733   4.023
  186    H    GLN  27           H        GLN  27  -5.035   4.573   4.373
  187    HA   GLN  27           HA       GLN  27  -4.188   4.998   7.018
  188    HB2  GLN  27           2HB      GLN  27  -5.298   2.911   5.860
  189    HB3  GLN  27           1HB      GLN  27  -3.633   2.407   5.618
  190    HG2  GLN  27           2HG      GLN  27  -3.824   1.460   7.621
  191    HG3  GLN  27           1HG      GLN  27  -3.629   3.096   8.254
  192   HE21  GLN  27          1HE2      GLN  27  -5.279   4.035   9.308
  193   HE22  GLN  27          2HE2      GLN  27  -6.826   3.307   9.559
  194    H    LEU  28           H        LEU  28  -2.490   4.759   4.041
  195    HA   LEU  28           HA       LEU  28   0.083   4.280   5.255
  196    HB2  LEU  28           2HB      LEU  28  -0.589   3.301   3.060
  197    HB3  LEU  28           1HB      LEU  28  -0.596   4.928   2.406
  198    HG   LEU  28           HG       LEU  28   1.927   4.166   3.707
  199   HD11  LEU  28          1HD1      LEU  28   1.549   2.967   1.021
  200   HD12  LEU  28          2HD1      LEU  28   0.910   2.091   2.412
  201   HD13  LEU  28          3HD1      LEU  28   2.626   2.492   2.335
  202   HD21  LEU  28          3HD2      LEU  28   0.998   5.613   1.272
  203   HD22  LEU  28          1HD2      LEU  28   2.660   5.024   1.342
  204   HD23  LEU  28          2HD2      LEU  28   2.072   6.152   2.563
  205    H    ILE  29           H        ILE  29  -1.854   6.841   4.644
  206    HA   ILE  29           HA       ILE  29  -0.042   8.857   3.938
  207    HB   ILE  29           HB       ILE  29  -2.677   9.035   5.332
  208   HG12  ILE  29          2HG1      ILE  29  -2.535   8.105   2.973
  209   HG13  ILE  29          1HG1      ILE  29  -3.652   9.440   3.233
  210   HG21  ILE  29          1HG2      ILE  29  -0.962  11.239   4.200
  211   HG22  ILE  29          2HG2      ILE  29  -1.526  11.053   5.860
  212   HG23  ILE  29          3HG2      ILE  29  -2.674  11.434   4.577
  213   HD11  ILE  29          3HD1      ILE  29  -2.570   9.839   1.199
  214   HD12  ILE  29          1HD1      ILE  29  -0.979   9.498   1.886
  215   HD13  ILE  29          2HD1      ILE  29  -1.853  10.954   2.361
  216    H    GLU  30           H        GLU  30  -0.491   7.245   6.697
  217    HA   GLU  30           HA       GLU  30   0.327   9.236   8.559
  218    HB2  GLU  30           2HB      GLU  30  -1.084   7.066   8.981
  219    HB3  GLU  30           1HB      GLU  30   0.496   6.329   9.203
  220    HG2  GLU  30           2HG      GLU  30   0.161   8.816  10.686
  221    HG3  GLU  30           1HG      GLU  30  -0.986   7.558  11.144
  222    H    ALA  31           H        ALA  31   1.965   7.861   6.252
  223    HA   ALA  31           HA       ALA  31   4.440   7.375   7.717
  224    HB1  ALA  31           1HB      ALA  31   3.408   6.092   5.583
  225    HB2  ALA  31           2HB      ALA  31   5.126   6.123   5.972
  226    HB3  ALA  31           3HB      ALA  31   4.473   7.242   4.774
  227    H    PHE  32           H        PHE  32   2.954   9.724   5.617
  228    HA   PHE  32           HA       PHE  32   5.190  11.133   4.738
  229    HB2  PHE  32           2HB      PHE  32   2.505  11.406   4.407
  230    HB3  PHE  32           1HB      PHE  32   2.845  12.776   5.458
  231    HD1  PHE  32           2HD      PHE  32   3.796  11.186   2.252
  232    HD2  PHE  32           1HD      PHE  32   3.817  14.728   4.612
  233    HE1  PHE  32           2HE      PHE  32   4.582  12.472   0.306
  234    HE2  PHE  32           1HE      PHE  32   4.602  16.020   2.670
  235    HZ   PHE  32           HZ       PHE  32   4.986  14.892   0.515
  236    H    TYR  33           H        TYR  33   3.703  11.015   7.868
  237    HA   TYR  33           HA       TYR  33   5.197  13.347   8.795
  238    HB2  TYR  33           2HB      TYR  33   3.232  11.591  10.283
  239    HB3  TYR  33           1HB      TYR  33   3.929  13.097  10.874
  240    HD1  TYR  33           2HD      TYR  33   1.854  11.735   8.091
  241    HD2  TYR  33           1HD      TYR  33   2.811  15.104  10.507
  242    HE1  TYR  33           2HE      TYR  33  -0.004  12.984   7.075
  243    HE2  TYR  33           1HE      TYR  33   0.953  16.362   9.497
  244    HH   TYR  33           HH       TYR  33  -1.442  14.876   7.571
  245    H    ASN  34           H        ASN  34   6.804  11.229   8.011
  246    HA   ASN  34           HA       ASN  34   8.402  10.857  10.315
  247    HB2  ASN  34           2HB      ASN  34   6.507   9.149  10.629
  248    HB3  ASN  34           1HB      ASN  34   7.234   8.280   9.281
  249   HD21  ASN  34          1HD2      ASN  34   8.514   9.990  12.116
  250   HD22  ASN  34          2HD2      ASN  34   9.489   8.679  12.677
  251    H    PHE  35           H        PHE  35   8.674  11.805   7.631
  252    HA   PHE  35           HA       PHE  35  11.106  10.528   6.922
  253    HB2  PHE  35           2HB      PHE  35   9.043   9.093   5.982
  254    HB3  PHE  35           1HB      PHE  35   9.181  10.264   4.675
  255    HD1  PHE  35           1HD      PHE  35  12.112  10.672   4.615
  256    HD2  PHE  35           2HD      PHE  35   9.809   7.117   5.031
  257    HE1  PHE  35           1HE      PHE  35  13.955   9.368   3.637
  258    HE2  PHE  35           2HE      PHE  35  11.649   5.808   4.056
  259    HZ   PHE  35           HZ       PHE  35  13.725   6.932   3.358
  260    H    ASP  36           H        ASP  36  10.329  13.150   7.516
  261    HA   ASP  36           HA       ASP  36  10.482  14.523   4.921
  262    HB2  ASP  36           2HB      ASP  36   9.879  16.569   6.305
  263    HB3  ASP  36           1HB      ASP  36   8.627  15.339   6.158
  264    H    GLY  37           H        GLY  37  12.753  13.222   6.220
  265    HA2  GLY  37           2HA      GLY  37  14.402  15.143   7.496
  266    HA3  GLY  37           1HA      GLY  37  14.946  13.640   6.762
  267    H    ASP  38           H        ASP  38  13.943  14.248   4.125
  268    HA   ASP  38           HA       ASP  38  14.883  16.701   3.140
  269    HB2  ASP  38           2HB      ASP  38  17.016  15.253   3.935
  270    HB3  ASP  38           1HB      ASP  38  16.843  14.646   2.291
  271    H    TYR  39           H        TYR  39  12.693  14.953   2.741
  272    HA   TYR  39           HA       TYR  39  11.369  14.154   1.079
  273    HB2  TYR  39           2HB      TYR  39  13.425  15.590  -0.605
  274    HB3  TYR  39           1HB      TYR  39  11.995  14.822  -1.286
  275    HD1  TYR  39           1HD      TYR  39  13.221  17.592   0.789
  276    HD2  TYR  39           2HD      TYR  39   9.805  15.794  -1.000
  277    HE1  TYR  39           1HE      TYR  39  11.923  19.632   1.231
  278    HE2  TYR  39           2HE      TYR  39   8.497  17.830  -0.564
  279    HH   TYR  39           HH       TYR  39   9.637  20.346   1.468
  280    H    ASP  40           H        ASP  40  14.393  13.857  -0.748
  281    HA   ASP  40           HA       ASP  40  15.413  12.058  -1.696
  282    HB2  ASP  40           2HB      ASP  40  15.442  11.660   0.988
  283    HB3  ASP  40           1HB      ASP  40  14.620  10.195   0.457
  284    H    GLY  41           H        GLY  41  14.934   9.373  -1.773
  285    HA2  GLY  41           2HA      GLY  41  12.124   8.963  -2.436
  286    HA3  GLY  41           1HA      GLY  41  13.263   8.862  -3.772
  287    H    PHE  42           H        PHE  42  15.194   7.371  -3.289
  288    HA   PHE  42           HA       PHE  42  14.235   4.769  -2.936
  289    HB2  PHE  42           2HB      PHE  42  16.354   5.522  -4.144
  290    HB3  PHE  42           1HB      PHE  42  17.116   5.580  -2.558
  291    HD1  PHE  42           1HD      PHE  42  15.493   3.352  -5.012
  292    HD2  PHE  42           2HD      PHE  42  17.859   3.618  -1.484
  293    HE1  PHE  42           1HE      PHE  42  15.989   0.947  -5.167
  294    HE2  PHE  42           2HE      PHE  42  18.360   1.213  -1.634
  295    HZ   PHE  42           HZ       PHE  42  17.425  -0.125  -3.477
  296    H    VAL  43           H        VAL  43  15.108   3.187  -1.317
  297    HA   VAL  43           HA       VAL  43  16.030   3.993   1.215
  298    HB   VAL  43           HB       VAL  43  13.828   5.021   1.454
  299   HG11  VAL  43          1HG1      VAL  43  12.690   2.256   1.073
  300   HG12  VAL  43          2HG1      VAL  43  12.641   3.542  -0.132
  301   HG13  VAL  43          3HG1      VAL  43  11.789   3.737   1.402
  302   HG21  VAL  43          3HG2      VAL  43  14.773   4.221   3.480
  303   HG22  VAL  43          1HG2      VAL  43  14.308   2.559   3.120
  304   HG23  VAL  43          2HG2      VAL  43  13.072   3.759   3.499
  305    H    SER  44           H        SER  44  16.973   2.252   2.046
  306    HA   SER  44           HA       SER  44  16.524  -0.338   0.910
  307    HB2  SER  44           2HB      SER  44  18.117  -0.021   3.412
  308    HB3  SER  44           1HB      SER  44  18.464  -0.975   1.968
  309    HG   SER  44           HG       SER  44  18.883   1.762   2.443
  310    H    VAL  45           H        VAL  45  15.729  -2.184   1.907
  311    HA   VAL  45           HA       VAL  45  13.473  -1.919   3.514
  312    HB   VAL  45           HB       VAL  45  15.239  -4.331   3.090
  313   HG11  VAL  45          1HG1      VAL  45  13.435  -5.702   3.872
  314   HG12  VAL  45          2HG1      VAL  45  12.415  -4.290   4.130
  315   HG13  VAL  45          3HG1      VAL  45  13.847  -4.538   5.128
  316   HG21  VAL  45          3HG2      VAL  45  13.082  -4.872   1.655
  317   HG22  VAL  45          1HG2      VAL  45  14.423  -3.932   1.004
  318   HG23  VAL  45          2HG2      VAL  45  12.983  -3.111   1.603
  319    H    GLU  46           H        GLU  46  16.712  -3.087   4.440
  320    HA   GLU  46           HA       GLU  46  16.319  -3.567   7.108
  321    HB2  GLU  46           2HB      GLU  46  18.787  -2.201   6.047
  322    HB3  GLU  46           1HB      GLU  46  18.668  -3.295   7.417
  323    HG2  GLU  46           2HG      GLU  46  17.916  -5.049   5.720
  324    HG3  GLU  46           1HG      GLU  46  18.515  -3.932   4.494
  325    H    GLU  47           H        GLU  47  16.550  -0.489   5.493
  326    HA   GLU  47           HA       GLU  47  16.628   0.964   8.023
  327    HB2  GLU  47           2HB      GLU  47  17.913   1.578   5.832
  328    HB3  GLU  47           1HB      GLU  47  16.374   2.266   5.331
  329    HG2  GLU  47           2HG      GLU  47  17.154   4.121   6.304
  330    HG3  GLU  47           1HG      GLU  47  16.631   3.344   7.798
  331    H    PHE  48           H        PHE  48  14.451   0.107   5.447
  332    HA   PHE  48           HA       PHE  48  12.397   1.967   5.968
  333    HB2  PHE  48           2HB      PHE  48  12.847   0.067   4.063
  334    HB3  PHE  48           1HB      PHE  48  11.571  -0.694   5.005
  335    HD1  PHE  48           2HD      PHE  48   9.945   1.624   5.795
  336    HD2  PHE  48           1HD      PHE  48  11.841   0.712   2.094
  337    HE1  PHE  48           2HE      PHE  48   8.272   2.983   4.606
  338    HE2  PHE  48           1HE      PHE  48  10.170   2.070   0.900
  339    HZ   PHE  48           HZ       PHE  48   8.384   3.205   2.156
  340    H    ARG  49           H        ARG  49  13.217  -1.135   7.374
  341    HA   ARG  49           HA       ARG  49  10.850  -1.758   8.685
  342    HB2  ARG  49           2HB      ARG  49  13.732  -2.280   9.381
  343    HB3  ARG  49           1HB      ARG  49  12.418  -2.866  10.393
  344    HG2  ARG  49           2HG      ARG  49  11.803  -4.459   8.913
  345    HG3  ARG  49           1HG      ARG  49  12.232  -3.478   7.511
  346    HD2  ARG  49           2HD      ARG  49  14.349  -4.258   7.452
  347    HD3  ARG  49           1HD      ARG  49  14.488  -4.313   9.208
  348    HE   ARG  49           HE       ARG  49  12.770  -6.344   8.593
  349   HH11  ARG  49          1HH1      ARG  49  16.012  -5.487   7.627
  350   HH12  ARG  49          2HH1      ARG  49  16.501  -7.127   7.366
  351   HH21  ARG  49          1HH2      ARG  49  13.413  -8.502   8.251
  352   HH22  ARG  49          2HH2      ARG  49  15.028  -8.838   7.720
  353    H    GLY  50           H        GLY  50  13.614   0.129   9.923
  354    HA2  GLY  50           2HA      GLY  50  12.570   0.738  12.433
  355    HA3  GLY  50           1HA      GLY  50  13.727   1.735  11.561
  356    H    ILE  51           H        ILE  51  11.756   2.041   9.322
  357    HA   ILE  51           HA       ILE  51  10.439   4.378  10.385
  358    HB   ILE  51           HB       ILE  51  10.220   3.237   7.599
  359   HG12  ILE  51          2HG1      ILE  51  12.153   5.330   8.621
  360   HG13  ILE  51          1HG1      ILE  51  12.581   3.656   8.278
  361   HG21  ILE  51          1HG2      ILE  51  10.074   6.129   7.983
  362   HG22  ILE  51          2HG2      ILE  51   8.774   5.241   8.777
  363   HG23  ILE  51          3HG2      ILE  51   9.039   5.053   7.044
  364   HD11  ILE  51          3HD1      ILE  51  12.119   5.908   6.449
  365   HD12  ILE  51          1HD1      ILE  51  11.474   4.350   5.930
  366   HD13  ILE  51          2HD1      ILE  51  13.192   4.516   6.298
  367    H    ILE  52           H        ILE  52   9.579   1.127   9.482
  368    HA   ILE  52           HA       ILE  52   6.726   1.691   9.585
  369    HB   ILE  52           HB       ILE  52   8.170  -0.931   9.166
  370   HG12  ILE  52          2HG1      ILE  52   8.516   0.779   7.378
  371   HG13  ILE  52          1HG1      ILE  52   7.668  -0.660   6.821
  372   HG21  ILE  52          1HG2      ILE  52   6.033  -1.448  10.009
  373   HG22  ILE  52          2HG2      ILE  52   5.908  -1.625   8.258
  374   HG23  ILE  52          3HG2      ILE  52   5.261  -0.186   9.047
  375   HD11  ILE  52          3HD1      ILE  52   6.892   1.993   6.511
  376   HD12  ILE  52          1HD1      ILE  52   5.800   1.326   7.727
  377   HD13  ILE  52          2HD1      ILE  52   5.944   0.549   6.148
  378    H    ARG  53           H        ARG  53   9.244   0.335  11.572
  379    HA   ARG  53           HA       ARG  53   7.794  -1.191  13.369
  380    HB2  ARG  53           2HB      ARG  53  10.234   0.528  13.814
  381    HB3  ARG  53           1HB      ARG  53   9.603  -0.588  15.016
  382    HG2  ARG  53           2HG      ARG  53  10.080  -1.729  12.345
  383    HG3  ARG  53           1HG      ARG  53  11.516  -1.215  13.234
  384    HD2  ARG  53           2HD      ARG  53   9.545  -2.740  14.797
  385    HD3  ARG  53           1HD      ARG  53  10.333  -3.639  13.502
  386    HE   ARG  53           HE       ARG  53  11.522  -2.722  15.949
  387   HH11  ARG  53          1HH1      ARG  53  12.148  -3.635  12.640
  388   HH12  ARG  53          2HH1      ARG  53  13.801  -4.059  12.937
  389   HH21  ARG  53          1HH2      ARG  53  13.696  -3.278  16.343
  390   HH22  ARG  53          2HH2      ARG  53  14.679  -3.857  15.040
  391    H    ASP  54           H        ASP  54   8.656   2.255  13.712
  392    HA   ASP  54           HA       ASP  54   6.453   2.514  15.647
  393    HB2  ASP  54           2HB      ASP  54   8.744   3.004  16.504
  394    HB3  ASP  54           1HB      ASP  54   8.859   4.318  15.337
  395    H    GLY  55           H        GLY  55   6.638   2.835  12.541
  396    HA2  GLY  55           2HA      GLY  55   5.625   5.593  12.391
  397    HA3  GLY  55           1HA      GLY  55   6.199   4.646  11.029
  398    H    LEU  56           H        LEU  56   4.844   3.031  10.140
  399    HA   LEU  56           HA       LEU  56   2.003   3.535  10.667
  400    HB2  LEU  56           2HB      LEU  56   3.285   2.195   8.287
  401    HB3  LEU  56           1HB      LEU  56   1.592   2.620   8.449
  402    HG   LEU  56           HG       LEU  56   2.658   5.054   8.786
  403   HD11  LEU  56          1HD1      LEU  56   4.454   4.171   6.628
  404   HD12  LEU  56          2HD1      LEU  56   4.926   3.695   8.259
  405   HD13  LEU  56          3HD1      LEU  56   4.687   5.399   7.873
  406   HD21  LEU  56          3HD2      LEU  56   2.534   4.257   5.957
  407   HD22  LEU  56          1HD2      LEU  56   1.656   5.517   6.824
  408   HD23  LEU  56          2HD2      LEU  56   1.120   3.840   6.926
  409    HA   PRO  57           HA       PRO  57   1.579  -0.544  12.344
  410    HB2  PRO  57           2HB      PRO  57  -1.093  -0.821  12.224
  411    HB3  PRO  57           1HB      PRO  57  -0.325   0.315  13.341
  412    HG2  PRO  57           2HG      PRO  57  -1.614   0.842  10.690
  413    HG3  PRO  57           1HG      PRO  57  -1.736   1.768  12.198
  414    HD2  PRO  57           2HD      PRO  57  -0.094   2.458  10.121
  415    HD3  PRO  57           1HD      PRO  57   0.229   2.882  11.814
  416    H    MET  58           H        MET  58   2.201  -2.286  11.278
  417    HA   MET  58           HA       MET  58   0.499  -3.464   9.277
  418    HB2  MET  58           2HB      MET  58   2.654  -1.804   8.448
  419    HB3  MET  58           1HB      MET  58   3.108  -3.465   8.094
  420    HG2  MET  58           2HG      MET  58   1.131  -3.782   6.773
  421    HG3  MET  58           1HG      MET  58   0.522  -2.193   7.234
  422    HE1  MET  58           3HE      MET  58   2.926  -3.164   3.627
  423    HE2  MET  58           1HE      MET  58   1.552  -3.955   4.398
  424    HE3  MET  58           2HE      MET  58   3.173  -4.161   5.059
  425    H    THR  59           H        THR  59   0.717  -5.644   9.224
  426    HA   THR  59           HA       THR  59   2.403  -6.868  11.209
  427    HB   THR  59           HB       THR  59   1.351  -8.966   9.818
  428    HG1  THR  59           1HG      THR  59  -0.692  -8.385   9.136
  429   HG21  THR  59          3HG2      THR  59   0.925  -8.963  12.083
  430   HG22  THR  59          1HG2      THR  59  -0.675  -8.701  11.390
  431   HG23  THR  59          2HG2      THR  59   0.232  -7.342  12.058
  432    H    GLU  60           H        GLU  60   4.098  -8.309  10.857
  433    HA   GLU  60           HA       GLU  60   6.035  -7.775   9.050
  434    HB2  GLU  60           2HB      GLU  60   6.696 -10.246   9.282
  435    HB3  GLU  60           1HB      GLU  60   6.607  -9.288  10.752
  436    HG2  GLU  60           2HG      GLU  60   4.218 -10.209  10.959
  437    HG3  GLU  60           1HG      GLU  60   4.730 -11.397   9.760
  438    H    ALA  61           H        ALA  61   3.585 -10.281   8.620
  439    HA   ALA  61           HA       ALA  61   4.230 -11.280   6.174
  440    HB1  ALA  61           1HB      ALA  61   1.863 -11.814   5.891
  441    HB2  ALA  61           2HB      ALA  61   1.455 -10.688   7.186
  442    HB3  ALA  61           3HB      ALA  61   2.404 -12.132   7.541
  443    H    GLU  62           H        GLU  62   2.088  -8.480   6.739
  444    HA   GLU  62           HA       GLU  62   1.651  -7.825   4.064
  445    HB2  GLU  62           2HB      GLU  62   1.973  -5.518   5.888
  446    HB3  GLU  62           1HB      GLU  62   0.648  -5.922   4.809
  447    HG2  GLU  62           2HG      GLU  62   1.174  -6.998   7.558
  448    HG3  GLU  62           1HG      GLU  62  -0.166  -5.981   7.035
  449    H    ILE  63           H        ILE  63   3.967  -6.275   6.273
  450    HA   ILE  63           HA       ILE  63   5.360  -4.833   4.303
  451    HB   ILE  63           HB       ILE  63   6.749  -5.857   6.761
  452   HG12  ILE  63          2HG1      ILE  63   5.593  -3.431   7.483
  453   HG13  ILE  63          1HG1      ILE  63   4.288  -4.305   6.681
  454   HG21  ILE  63          1HG2      ILE  63   7.733  -4.334   4.879
  455   HG22  ILE  63          2HG2      ILE  63   8.068  -3.978   6.574
  456   HG23  ILE  63          3HG2      ILE  63   6.835  -3.062   5.709
  457   HD11  ILE  63          3HD1      ILE  63   3.985  -5.143   8.732
  458   HD12  ILE  63          1HD1      ILE  63   5.650  -4.848   9.227
  459   HD13  ILE  63          2HD1      ILE  63   5.256  -6.254   8.234
  460    H    THR  64           H        THR  64   6.460  -7.760   6.002
  461    HA   THR  64           HA       THR  64   8.712  -8.312   4.527
  462    HB   THR  64           HB       THR  64   6.734 -10.224   5.754
  463    HG1  THR  64           1HG      THR  64   7.670  -8.891   7.274
  464   HG21  THR  64          3HG2      THR  64   9.544 -10.755   4.839
  465   HG22  THR  64          1HG2      THR  64   8.063 -11.504   4.240
  466   HG23  THR  64          2HG2      THR  64   8.607 -11.820   5.889
  467    H    GLU  65           H        GLU  65   5.410  -9.514   3.911
  468    HA   GLU  65           HA       GLU  65   6.111 -10.882   1.549
  469    HB2  GLU  65           2HB      GLU  65   4.009 -11.254   2.896
  470    HB3  GLU  65           1HB      GLU  65   3.391  -9.772   2.178
  471    HG2  GLU  65           2HG      GLU  65   2.475 -11.301   0.769
  472    HG3  GLU  65           1HG      GLU  65   3.999 -10.996  -0.067
  473    H    PHE  66           H        PHE  66   5.763  -7.690   2.247
  474    HA   PHE  66           HA       PHE  66   5.296  -6.905  -0.507
  475    HB2  PHE  66           2HB      PHE  66   5.056  -5.523   2.107
  476    HB3  PHE  66           1HB      PHE  66   5.538  -4.535   0.735
  477    HD1  PHE  66           1HD      PHE  66   4.000  -5.749  -1.450
  478    HD2  PHE  66           2HD      PHE  66   2.874  -4.892   2.563
  479    HE1  PHE  66           1HE      PHE  66   1.650  -5.567  -2.152
  480    HE2  PHE  66           2HE      PHE  66   0.521  -4.709   1.868
  481    HZ   PHE  66           HZ       PHE  66  -0.093  -5.047  -0.492
  482    H    PHE  67           H        PHE  67   7.784  -7.135   1.881
  483    HA   PHE  67           HA       PHE  67   9.633  -5.346   0.632
  484    HB2  PHE  67           2HB      PHE  67   9.716  -7.318   2.857
  485    HB3  PHE  67           1HB      PHE  67  11.251  -6.882   2.113
  486    HD1  PHE  67           2HD      PHE  67  10.615  -3.986   1.498
  487    HD2  PHE  67           1HD      PHE  67   9.974  -6.366   4.970
  488    HE1  PHE  67           2HE      PHE  67  10.685  -1.962   2.895
  489    HE2  PHE  67           1HE      PHE  67  10.048  -4.347   6.371
  490    HZ   PHE  67           HZ       PHE  67  10.403  -2.144   5.336
  491    H    GLU  68           H        GLU  68   8.857  -8.732   0.327
  492    HA   GLU  68           HA       GLU  68  11.192  -9.311  -1.284
  493    HB2  GLU  68           2HB      GLU  68   8.770 -11.066  -0.877
  494    HB3  GLU  68           1HB      GLU  68  10.384 -11.560  -1.371
  495    HG2  GLU  68           2HG      GLU  68  10.890 -10.375   1.022
  496    HG3  GLU  68           1HG      GLU  68   9.294 -11.070   1.299
  497    H    ALA  69           H        ALA  69   7.858  -8.435  -1.759
  498    HA   ALA  69           HA       ALA  69   7.820  -9.170  -4.534
  499    HB1  ALA  69           1HB      ALA  69   5.787  -9.244  -3.146
  500    HB2  ALA  69           2HB      ALA  69   5.595  -8.225  -4.574
  501    HB3  ALA  69           3HB      ALA  69   5.872  -7.489  -2.995
  502    H    ALA  70           H        ALA  70   9.013  -6.658  -2.821
  503    HA   ALA  70           HA       ALA  70   8.750  -4.688  -4.966
  504    HB1  ALA  70           1HB      ALA  70   8.304  -3.591  -3.001
  505    HB2  ALA  70           2HB      ALA  70  10.026  -3.263  -3.185
  506    HB3  ALA  70           3HB      ALA  70   9.483  -4.527  -2.082
  507    H    ASP  71           H        ASP  71  11.069  -6.775  -3.441
  508    HA   ASP  71           HA       ASP  71  13.150  -5.734  -5.247
  509    HB2  ASP  71           2HB      ASP  71  13.606  -5.278  -2.844
  510    HB3  ASP  71           1HB      ASP  71  13.572  -7.013  -2.537
  511    HA   PRO  72           HA       PRO  72  12.727  -9.854  -6.987
  512    HB2  PRO  72           2HB      PRO  72  14.859  -9.640  -8.701
  513    HB3  PRO  72           1HB      PRO  72  13.243  -9.015  -9.045
  514    HG2  PRO  72           2HG      PRO  72  15.657  -7.570  -8.033
  515    HG3  PRO  72           1HG      PRO  72  14.467  -7.054  -9.241
  516    HD2  PRO  72           2HD      PRO  72  14.405  -6.137  -6.718
  517    HD3  PRO  72           1HD      PRO  72  12.916  -6.441  -7.637
  518    H    ASN  73           H        ASN  73  16.059  -8.677  -6.432
  519    HA   ASN  73           HA       ASN  73  17.100 -11.270  -5.944
  520    HB2  ASN  73           2HB      ASN  73  19.074  -9.961  -4.999
  521    HB3  ASN  73           1HB      ASN  73  18.650  -9.638  -6.676
  522   HD21  ASN  73          1HD2      ASN  73  19.159  -7.585  -6.995
  523   HD22  ASN  73          2HD2      ASN  73  18.639  -6.256  -6.020
  524    H    ASN  74           H        ASN  74  15.748  -8.783  -3.892
  525    HA   ASN  74           HA       ASN  74  14.956  -8.876  -1.758
  526    HB2  ASN  74           2HB      ASN  74  15.940 -11.715  -1.524
  527    HB3  ASN  74           1HB      ASN  74  14.636 -10.935  -0.635
  528   HD21  ASN  74          1HD2      ASN  74  12.647 -10.618  -1.641
  529   HD22  ASN  74          2HD2      ASN  74  12.198 -11.479  -3.068
  530    H    THR  75           H        THR  75  17.422  -7.809  -2.291
  531    HA   THR  75           HA       THR  75  19.237  -8.800  -0.240
  532    HB   THR  75           HB       THR  75  20.896  -7.375  -1.190
  533    HG1  THR  75           1HG      THR  75  18.797  -6.159  -2.659
  534   HG21  THR  75          3HG2      THR  75  20.508  -7.745  -3.754
  535   HG22  THR  75          1HG2      THR  75  19.207  -8.788  -3.181
  536   HG23  THR  75          2HG2      THR  75  20.869  -9.097  -2.680
  537    H    GLY  76           H        GLY  76  16.790  -7.719   0.667
  538    HA2  GLY  76           2HA      GLY  76  15.946  -6.237   2.189
  539    HA3  GLY  76           1HA      GLY  76  17.612  -6.033   2.719
  540    H    PHE  77           H        PHE  77  16.786  -5.279  -0.547
  541    HA   PHE  77           HA       PHE  77  16.780  -2.411   0.113
  542    HB2  PHE  77           2HB      PHE  77  18.436  -3.930  -1.830
  543    HB3  PHE  77           1HB      PHE  77  17.803  -2.384  -2.384
  544    HD1  PHE  77           2HD      PHE  77  19.267  -3.667   0.805
  545    HD2  PHE  77           1HD      PHE  77  19.332  -0.691  -2.235
  546    HE1  PHE  77           2HE      PHE  77  21.087  -2.508   1.985
  547    HE2  PHE  77           1HE      PHE  77  21.153   0.474  -1.062
  548    HZ   PHE  77           HZ       PHE  77  22.033  -0.434   1.052
  549    H    ILE  78           H        ILE  78  15.085  -1.318  -0.664
  550    HA   ILE  78           HA       ILE  78  13.395  -2.680  -2.650
  551    HB   ILE  78           HB       ILE  78  12.764  -1.219  -0.173
  552   HG12  ILE  78          2HG1      ILE  78  11.542  -3.380  -1.863
  553   HG13  ILE  78          1HG1      ILE  78  12.170  -3.491  -0.215
  554   HG21  ILE  78          1HG2      ILE  78  10.906  -0.880  -2.514
  555   HG22  ILE  78          2HG2      ILE  78  11.983   0.395  -1.935
  556   HG23  ILE  78          3HG2      ILE  78  10.714  -0.232  -0.888
  557   HD11  ILE  78          3HD1      ILE  78   9.722  -3.635  -0.313
  558   HD12  ILE  78          1HD1      ILE  78   9.660  -2.032  -1.045
  559   HD13  ILE  78          2HD1      ILE  78  10.262  -2.227   0.602
  560    H    ASP  79           H        ASP  79  12.348  -1.450  -4.242
  561    HA   ASP  79           HA       ASP  79  13.823   0.964  -5.007
  562    HB2  ASP  79           2HB      ASP  79  12.333  -1.146  -6.500
  563    HB3  ASP  79           1HB      ASP  79  12.331   0.481  -7.176
  564    H    TYR  80           H        TYR  80  12.863   2.583  -3.877
  565    HA   TYR  80           HA       TYR  80  10.409   2.991  -2.943
  566    HB2  TYR  80           2HB      TYR  80  12.225   4.650  -2.801
  567    HB3  TYR  80           1HB      TYR  80  11.945   5.092  -4.482
  568    HD1  TYR  80           2HD      TYR  80  10.399   5.078  -1.113
  569    HD2  TYR  80           1HD      TYR  80  10.282   6.662  -5.059
  570    HE1  TYR  80           2HE      TYR  80   8.735   6.738  -0.391
  571    HE2  TYR  80           1HE      TYR  80   8.618   8.325  -4.349
  572    HH   TYR  80           HH       TYR  80   7.988   9.446  -2.077
  573    H    LYS  81           H        LYS  81  11.237   3.223  -6.361
  574    HA   LYS  81           HA       LYS  81   8.769   4.315  -7.210
  575    HB2  LYS  81           2HB      LYS  81  11.081   2.986  -8.529
  576    HB3  LYS  81           1HB      LYS  81   9.566   3.035  -9.423
  577    HG2  LYS  81           2HG      LYS  81  10.376   4.996 -10.154
  578    HG3  LYS  81           1HG      LYS  81   9.721   5.600  -8.629
  579    HD2  LYS  81           2HD      LYS  81  12.439   4.483  -8.471
  580    HD3  LYS  81           1HD      LYS  81  12.286   5.949  -9.443
  581    HE2  LYS  81           2HE      LYS  81  11.507   5.565  -6.558
  582    HE3  LYS  81           1HE      LYS  81  12.792   6.593  -7.194
  583    HZ1  LYS  81           3HZ      LYS  81  11.136   8.110  -6.866
  584    HZ2  LYS  81           1HZ      LYS  81   9.890   7.019  -7.210
  585    HZ3  LYS  81           2HZ      LYS  81  10.807   7.679  -8.469
  586    H    ALA  82           H        ALA  82   9.997   0.972  -7.218
  587    HA   ALA  82           HA       ALA  82   7.697  -0.271  -8.201
  588    HB1  ALA  82           1HB      ALA  82   8.886  -2.139  -7.913
  589    HB2  ALA  82           2HB      ALA  82   9.041  -1.866  -6.177
  590    HB3  ALA  82           3HB      ALA  82  10.178  -1.110  -7.295
  591    H    PHE  83           H        PHE  83   8.406   1.081  -5.108
  592    HA   PHE  83           HA       PHE  83   6.136  -0.211  -3.822
  593    HB2  PHE  83           2HB      PHE  83   8.623   0.827  -2.943
  594    HB3  PHE  83           1HB      PHE  83   7.365   1.804  -2.189
  595    HD1  PHE  83           1HD      PHE  83   7.415  -1.803  -3.073
  596    HD2  PHE  83           2HD      PHE  83   7.258   1.114   0.020
  597    HE1  PHE  83           1HE      PHE  83   7.055  -3.585  -1.420
  598    HE2  PHE  83           2HE      PHE  83   6.899  -0.664   1.683
  599    HZ   PHE  83           HZ       PHE  83   6.797  -3.017   0.964
  600    H    ALA  84           H        ALA  84   7.087   2.854  -5.181
  601    HA   ALA  84           HA       ALA  84   4.879   4.321  -4.056
  602    HB1  ALA  84           1HB      ALA  84   7.143   5.280  -4.700
  603    HB2  ALA  84           2HB      ALA  84   5.720   6.197  -5.196
  604    HB3  ALA  84           3HB      ALA  84   6.581   5.200  -6.370
  605    H    ALA  85           H        ALA  85   5.482   2.460  -6.921
  606    HA   ALA  85           HA       ALA  85   3.384   3.559  -8.484
  607    HB1  ALA  85           1HB      ALA  85   4.723   0.892  -8.781
  608    HB2  ALA  85           2HB      ALA  85   5.322   2.401  -9.470
  609    HB3  ALA  85           3HB      ALA  85   3.783   1.731 -10.013
  610    H    MET  86           H        MET  86   3.397   1.594  -5.870
  611    HA   MET  86           HA       MET  86   1.060   0.026  -6.508
  612    HB2  MET  86           2HB      MET  86   3.072  -0.538  -4.894
  613    HB3  MET  86           1HB      MET  86   2.083   0.314  -3.715
  614    HG2  MET  86           2HG      MET  86   1.453  -1.881  -3.417
  615    HG3  MET  86           1HG      MET  86   0.199  -1.263  -4.490
  616    HE1  MET  86           3HE      MET  86   3.622  -2.622  -4.310
  617    HE2  MET  86           1HE      MET  86   3.967  -2.672  -6.039
  618    HE3  MET  86           2HE      MET  86   3.548  -4.155  -5.180
  619    H    LEU  87           H        LEU  87   1.847   2.898  -4.640
  620    HA   LEU  87           HA       LEU  87  -0.847   3.163  -3.662
  621    HB2  LEU  87           2HB      LEU  87   1.562   4.918  -3.425
  622    HB3  LEU  87           1HB      LEU  87   0.019   5.297  -2.683
  623    HG   LEU  87           HG       LEU  87   1.290   2.679  -2.035
  624   HD11  LEU  87          1HD1      LEU  87   2.762   3.561  -0.447
  625   HD12  LEU  87          2HD1      LEU  87   2.056   5.173  -0.554
  626   HD13  LEU  87          3HD1      LEU  87   3.027   4.545  -1.885
  627   HD21  LEU  87          3HD2      LEU  87  -0.035   2.745  -0.179
  628   HD22  LEU  87          1HD2      LEU  87  -1.016   3.722  -1.270
  629   HD23  LEU  87          2HD2      LEU  87   0.012   4.505  -0.070
  630    H    TYR  88           H        TYR  88   0.658   3.807  -6.391
  631    HA   TYR  88           HA       TYR  88  -1.256   5.897  -7.168
  632    HB2  TYR  88           2HB      TYR  88   1.543   5.642  -8.279
  633    HB3  TYR  88           1HB      TYR  88   0.388   6.933  -8.591
  634    HD1  TYR  88           2HD      TYR  88  -0.588   7.526  -5.875
  635    HD2  TYR  88           1HD      TYR  88   3.350   6.692  -7.252
  636    HE1  TYR  88           2HE      TYR  88   0.335   8.811  -3.992
  637    HE2  TYR  88           1HE      TYR  88   4.285   7.974  -5.372
  638    HH   TYR  88           HH       TYR  88   3.650   8.727  -3.160
  639    H    SER  89           H        SER  89  -1.189   2.893  -7.410
  640    HA   SER  89           HA       SER  89  -0.965   2.424 -10.254
  641    HB2  SER  89           2HB      SER  89  -0.309   0.567  -8.959
  642    HB3  SER  89           1HB      SER  89  -1.709   0.703  -7.896
  643    HG   SER  89           HG       SER  89  -1.816   0.011 -10.647
  644    H    VAL  90           H        VAL  90  -2.571   4.098 -10.794
  645    HA   VAL  90           HA       VAL  90  -5.274   2.944 -10.798
  646    HB   VAL  90           HB       VAL  90  -4.770   5.897 -10.440
  647   HG11  VAL  90          1HG1      VAL  90  -7.169   4.159 -10.658
  648   HG12  VAL  90          2HG1      VAL  90  -6.887   5.785 -11.278
  649   HG13  VAL  90          3HG1      VAL  90  -7.245   5.543  -9.568
  650   HG21  VAL  90          3HG2      VAL  90  -5.249   3.750  -8.393
  651   HG22  VAL  90          1HG2      VAL  90  -5.658   5.438  -8.089
  652   HG23  VAL  90          2HG2      VAL  90  -3.988   4.982  -8.425
  653    H    ASP  91           H        ASP  91  -3.181   2.932 -12.808
  654    HA   ASP  91           HA       ASP  91  -4.525   4.514 -14.900
  655    HB2  ASP  91           2HB      ASP  91  -1.615   4.045 -14.379
  656    HB3  ASP  91           1HB      ASP  91  -2.165   4.275 -16.036
  657    H    GLU  92           H        GLU  92  -5.902   2.730 -15.339
  658    HA   GLU  92           HA       GLU  92  -5.041   0.126 -15.902
  659    HB2  GLU  92           2HB      GLU  92  -7.209  -0.054 -17.175
  660    HB3  GLU  92           1HB      GLU  92  -7.361   0.496 -15.513
  661    HG2  GLU  92           2HG      GLU  92  -7.061   2.656 -17.459
  662    HG3  GLU  92           1HG      GLU  92  -8.512   1.679 -17.676
  663    H    SER  93           H        SER  93  -4.267  -0.865 -17.689
  664    HA   SER  93           HA       SER  93  -3.604   0.860 -19.970
  665    HB2  SER  93           2HB      SER  93  -1.934  -0.696 -18.523
  666    HB3  SER  93           1HB      SER  93  -2.405  -1.843 -19.778
  667    HG   SER  93           HG       SER  93  -0.938   0.515 -19.972
  Start of MODEL    7
    1    H1   MET   1           1HT      MET   1 -52.527   8.675 -19.228
    2    H2   MET   1           2HT      MET   1 -53.688   9.182 -18.069
    3    H3   MET   1           3HT      MET   1 -52.922  10.336 -19.083
    4    HA   MET   1           HA       MET   1 -55.242   9.697 -19.658
    5    HB2  MET   1           2HB      MET   1 -54.590   9.553 -22.111
    6    HB3  MET   1           1HB      MET   1 -53.927  10.912 -21.214
    7    HG2  MET   1           2HG      MET   1 -51.839   9.537 -20.904
    8    HG3  MET   1           1HG      MET   1 -52.519   8.400 -22.067
    9    HE1  MET   1           2HE      MET   1 -49.608  11.064 -22.691
   10    HE2  MET   1           3HE      MET   1 -50.581  11.112 -21.220
   11    HE3  MET   1           1HE      MET   1 -50.718  12.405 -22.413
   12    H    GLY   2           H        GLY   2 -54.430   7.338 -18.288
   13    HA2  GLY   2           2HA      GLY   2 -54.872   5.087 -18.271
   14    HA3  GLY   2           1HA      GLY   2 -55.948   5.401 -19.625
   15    H    SER   3           H        SER   3 -52.448   5.880 -19.502
   16    HA   SER   3           HA       SER   3 -52.062   3.581 -21.268
   17    HB2  SER   3           2HB      SER   3 -51.584   6.441 -21.972
   18    HB3  SER   3           1HB      SER   3 -50.436   5.240 -22.562
   19    HG   SER   3           HG       SER   3 -51.895   4.499 -23.897
   20    H    SER   4           H        SER   4 -51.402   3.965 -18.520
   21    HA   SER   4           HA       SER   4 -48.752   4.759 -18.082
   22    HB2  SER   4           2HB      SER   4 -49.054   2.904 -16.160
   23    HB3  SER   4           1HB      SER   4 -49.807   4.496 -16.072
   24    HG   SER   4           HG       SER   4 -51.707   3.615 -16.341
   25    H    HIS   5           H        HIS   5 -47.494   3.950 -19.797
   26    HA   HIS   5           HA       HIS   5 -47.125   1.041 -19.890
   27    HB2  HIS   5           2HB      HIS   5 -45.902   1.477 -22.001
   28    HB3  HIS   5           1HB      HIS   5 -47.553   2.085 -22.043
   29    HD1  HIS   5           1HD      HIS   5 -44.039   3.400 -21.442
   30    HD2  HIS   5           2HD      HIS   5 -47.751   4.686 -22.795
   31    HE1  HIS   5           1HE      HIS   5 -43.684   5.759 -22.237
   32    HE2  HIS   5           2HE      HIS   5 -45.924   6.486 -23.132
   33    H    HIS   6           H        HIS   6 -45.484   4.040 -19.166
   34    HA   HIS   6           HA       HIS   6 -43.486   4.504 -18.184
   35    HB2  HIS   6           2HB      HIS   6 -44.502   2.396 -16.792
   36    HB3  HIS   6           1HB      HIS   6 -42.954   1.737 -17.306
   37    HD1  HIS   6           1HD      HIS   6 -41.896   4.947 -17.060
   38    HD2  HIS   6           2HD      HIS   6 -43.281   2.315 -14.160
   39    HE1  HIS   6           1HE      HIS   6 -40.970   5.799 -14.884
   40    HE2  HIS   6           2HE      HIS   6 -41.892   4.241 -13.133
   41    H    HIS   7           H        HIS   7 -41.133   3.171 -17.884
   42    HA   HIS   7           HA       HIS   7 -40.352   1.693 -20.184
   43    HB2  HIS   7           2HB      HIS   7 -38.849   3.422 -21.162
   44    HB3  HIS   7           1HB      HIS   7 -40.558   3.816 -21.324
   45    HD1  HIS   7           1HD      HIS   7 -37.516   5.404 -20.578
   46    HD2  HIS   7           2HD      HIS   7 -41.317   5.569 -18.908
   47    HE1  HIS   7           1HE      HIS   7 -37.600   7.574 -19.311
   48    HE2  HIS   7           2HE      HIS   7 -39.879   7.612 -18.239
   49    H    HIS   8           H        HIS   8 -39.426   0.361 -18.624
   50    HA   HIS   8           HA       HIS   8 -37.508   1.374 -16.740
   51    HB2  HIS   8           2HB      HIS   8 -37.155  -1.019 -16.185
   52    HB3  HIS   8           1HB      HIS   8 -38.851  -0.552 -16.136
   53    HD1  HIS   8           1HD      HIS   8 -38.101  -0.856 -19.582
   54    HD2  HIS   8           2HD      HIS   8 -38.797  -3.573 -16.519
   55    HE1  HIS   8           1HE      HIS   8 -38.728  -3.007 -20.723
   56    HE2  HIS   8           2HE      HIS   8 -39.228  -4.613 -18.847
   57    H    HIS   9           H        HIS   9 -35.284   1.086 -16.743
   58    HA   HIS   9           HA       HIS   9 -34.128   0.455 -19.376
   59    HB2  HIS   9           2HB      HIS   9 -32.865   2.106 -17.183
   60    HB3  HIS   9           1HB      HIS   9 -32.308   1.935 -18.845
   61    HD1  HIS   9           1HD      HIS   9 -34.909   3.652 -16.768
   62    HD2  HIS   9           2HD      HIS   9 -33.612   3.545 -20.712
   63    HE1  HIS   9           1HE      HIS   9 -36.044   5.589 -17.902
   64    HE2  HIS   9           2HE      HIS   9 -35.311   5.451 -20.308
   65    H    HIS  10           H        HIS  10 -33.000   0.482 -15.991
   66    HA   HIS  10           HA       HIS  10 -32.510  -2.276 -15.829
   67    HB2  HIS  10           2HB      HIS  10 -30.782  -1.661 -17.552
   68    HB3  HIS  10           1HB      HIS  10 -30.002  -0.666 -16.328
   69    HD1  HIS  10           1HD      HIS  10 -31.418  -3.941 -15.281
   70    HD2  HIS  10           2HD      HIS  10 -27.744  -2.362 -16.407
   71    HE1  HIS  10           1HE      HIS  10 -29.715  -5.678 -14.641
   72    HE2  HIS  10           2HE      HIS  10 -27.492  -4.663 -15.254
   73    H    SER  11           H        SER  11 -33.562  -1.622 -13.848
   74    HA   SER  11           HA       SER  11 -32.117   0.026 -11.976
   75    HB2  SER  11           2HB      SER  11 -34.650  -0.127 -12.138
   76    HB3  SER  11           1HB      SER  11 -34.512  -1.713 -11.376
   77    HG   SER  11           HG       SER  11 -34.637   0.589 -10.167
   78    H    SER  12           H        SER  12 -30.145  -1.162 -11.829
   79    HA   SER  12           HA       SER  12 -30.212  -3.841 -10.731
   80    HB2  SER  12           2HB      SER  12 -27.893  -1.996 -11.353
   81    HB3  SER  12           1HB      SER  12 -27.732  -3.666 -10.811
   82    HG   SER  12           HG       SER  12 -28.228  -2.712 -13.289
   83    H    GLY  13           H        GLY  13 -28.346  -0.989  -9.685
   84    HA2  GLY  13           2HA      GLY  13 -27.879  -0.173  -7.592
   85    HA3  GLY  13           1HA      GLY  13 -29.469  -0.761  -7.129
   86    H    LEU  14           H        LEU  14 -26.060  -1.425  -7.173
   87    HA   LEU  14           HA       LEU  14 -26.501  -3.883  -5.623
   88    HB2  LEU  14           2HB      LEU  14 -24.937  -3.585  -7.777
   89    HB3  LEU  14           1HB      LEU  14 -23.782  -3.125  -6.541
   90    HG   LEU  14           HG       LEU  14 -23.504  -5.460  -7.019
   91   HD11  LEU  14          1HD1      LEU  14 -24.059  -6.448  -4.778
   92   HD12  LEU  14          2HD1      LEU  14 -24.873  -4.931  -4.392
   93   HD13  LEU  14          3HD1      LEU  14 -23.142  -4.943  -4.731
   94   HD21  LEU  14          3HD2      LEU  14 -26.464  -5.478  -6.838
   95   HD22  LEU  14          1HD2      LEU  14 -25.602  -6.916  -6.288
   96   HD23  LEU  14          2HD2      LEU  14 -25.389  -6.337  -7.941
   97    H    VAL  15           H        VAL  15 -24.022  -1.317  -5.701
   98    HA   VAL  15           HA       VAL  15 -24.453  -0.683  -2.923
   99    HB   VAL  15           HB       VAL  15 -22.030  -1.142  -2.328
  100   HG11  VAL  15          1HG1      VAL  15 -23.645  -3.619  -2.886
  101   HG12  VAL  15          2HG1      VAL  15 -24.030  -2.485  -1.590
  102   HG13  VAL  15          3HG1      VAL  15 -22.489  -3.346  -1.582
  103   HG21  VAL  15          3HG2      VAL  15 -21.571  -1.600  -4.875
  104   HG22  VAL  15          1HG2      VAL  15 -22.044  -3.243  -4.441
  105   HG23  VAL  15          2HG2      VAL  15 -20.684  -2.471  -3.625
  106    HA   PRO  16           HA       PRO  16 -23.067   3.319  -4.126
  107    HB2  PRO  16           2HB      PRO  16 -21.450   3.291  -1.622
  108    HB3  PRO  16           1HB      PRO  16 -22.614   4.490  -2.195
  109    HG2  PRO  16           2HG      PRO  16 -23.263   2.795  -0.249
  110    HG3  PRO  16           1HG      PRO  16 -24.442   3.243  -1.495
  111    HD2  PRO  16           2HD      PRO  16 -22.881   0.720  -1.179
  112    HD3  PRO  16           1HD      PRO  16 -24.537   0.956  -1.773
  113    H    ARG  17           H        ARG  17 -20.381   1.769  -2.356
  114    HA   ARG  17           HA       ARG  17 -18.440   2.854  -4.172
  115    HB2  ARG  17           2HB      ARG  17 -18.371   1.177  -1.710
  116    HB3  ARG  17           1HB      ARG  17 -16.971   1.134  -2.773
  117    HG2  ARG  17           2HG      ARG  17 -16.726   2.772  -0.969
  118    HG3  ARG  17           1HG      ARG  17 -16.691   3.525  -2.565
  119    HD2  ARG  17           2HD      ARG  17 -19.275   3.318  -1.082
  120    HD3  ARG  17           1HD      ARG  17 -18.118   4.573  -0.642
  121    HE   ARG  17           HE       ARG  17 -19.825   4.572  -2.896
  122   HH11  ARG  17          1HH1      ARG  17 -16.592   5.451  -1.919
  123   HH12  ARG  17          2HH1      ARG  17 -16.437   6.698  -3.111
  124   HH21  ARG  17          1HH2      ARG  17 -19.623   6.212  -4.462
  125   HH22  ARG  17          2HH2      ARG  17 -18.158   7.131  -4.554
  126    H    GLY  18           H        GLY  18 -18.787  -0.542  -3.160
  127    HA2  GLY  18           2HA      GLY  18 -19.511  -1.894  -5.324
  128    HA3  GLY  18           1HA      GLY  18 -17.904  -1.377  -5.812
  129    H    SER  19           H        SER  19 -16.140  -1.899  -4.186
  130    HA   SER  19           HA       SER  19 -16.582  -4.112  -2.420
  131    HB2  SER  19           2HB      SER  19 -14.646  -4.863  -4.534
  132    HB3  SER  19           1HB      SER  19 -15.775  -5.870  -3.628
  133    HG   SER  19           HG       SER  19 -16.076  -4.660  -6.057
  134    H    HIS  20           H        HIS  20 -14.031  -2.602  -4.403
  135    HA   HIS  20           HA       HIS  20 -12.135  -2.797  -2.227
  136    HB2  HIS  20           2HB      HIS  20 -12.035  -2.011  -5.091
  137    HB3  HIS  20           1HB      HIS  20 -10.820  -1.309  -4.028
  138    HD1  HIS  20           1HD      HIS  20  -9.193  -3.017  -2.829
  139    HD2  HIS  20           2HD      HIS  20 -11.628  -4.648  -5.775
  140    HE1  HIS  20           1HE      HIS  20  -8.187  -5.257  -3.368
  141    HE2  HIS  20           2HE      HIS  20  -9.728  -6.262  -5.089
  142    H    MET  21           H        MET  21 -11.717  -1.273  -0.765
  143    HA   MET  21           HA       MET  21 -13.152   1.249  -0.919
  144    HB2  MET  21           2HB      MET  21 -11.388   0.156   1.281
  145    HB3  MET  21           1HB      MET  21 -12.427   1.570   1.394
  146    HG2  MET  21           2HG      MET  21 -14.363   0.025   0.892
  147    HG3  MET  21           1HG      MET  21 -13.238  -1.307   1.148
  148    HE1  MET  21           3HE      MET  21 -11.978  -0.703   4.685
  149    HE2  MET  21           1HE      MET  21 -11.615  -1.229   3.041
  150    HE3  MET  21           2HE      MET  21 -12.738  -2.155   4.038
  151    H    SER  22           H        SER  22 -12.160   3.294  -0.731
  152    HA   SER  22           HA       SER  22  -9.449   3.353  -1.813
  153    HB2  SER  22           2HB      SER  22  -9.940   5.658  -2.503
  154    HB3  SER  22           1HB      SER  22 -11.168   4.548  -3.108
  155    HG   SER  22           HG       SER  22 -11.344   6.447  -1.043
  156    H    ASP  23           H        ASP  23 -10.682   3.320   1.092
  157    HA   ASP  23           HA       ASP  23  -9.116   5.500   2.210
  158    HB2  ASP  23           2HB      ASP  23 -11.030   3.605   3.543
  159    HB3  ASP  23           1HB      ASP  23 -10.243   4.969   4.334
  160    H    GLU  24           H        GLU  24  -8.910   2.274   1.617
  161    HA   GLU  24           HA       GLU  24  -7.335   1.387   3.766
  162    HB2  GLU  24           2HB      GLU  24  -7.486   0.354   0.946
  163    HB3  GLU  24           1HB      GLU  24  -6.679  -0.484   2.265
  164    HG2  GLU  24           2HG      GLU  24  -9.451   0.248   2.835
  165    HG3  GLU  24           1HG      GLU  24  -9.258  -0.877   1.492
  166    H    LYS  25           H        LYS  25  -6.684   3.385   1.227
  167    HA   LYS  25           HA       LYS  25  -3.803   2.968   1.244
  168    HB2  LYS  25           2HB      LYS  25  -4.943   3.338  -0.912
  169    HB3  LYS  25           1HB      LYS  25  -5.479   4.916  -0.352
  170    HG2  LYS  25           2HG      LYS  25  -2.836   5.178   0.030
  171    HG3  LYS  25           1HG      LYS  25  -2.837   4.042  -1.320
  172    HD2  LYS  25           2HD      LYS  25  -3.627   5.575  -2.777
  173    HD3  LYS  25           1HD      LYS  25  -4.688   6.318  -1.578
  174    HE2  LYS  25           2HE      LYS  25  -2.756   7.440  -0.572
  175    HE3  LYS  25           1HE      LYS  25  -1.702   6.701  -1.775
  176    HZ1  LYS  25           3HZ      LYS  25  -3.949   8.536  -2.405
  177    HZ2  LYS  25           1HZ      LYS  25  -2.831   7.899  -3.504
  178    HZ3  LYS  25           2HZ      LYS  25  -2.326   8.998  -2.322
  179    H    THR  26           H        THR  26  -6.211   5.126   2.500
  180    HA   THR  26           HA       THR  26  -4.505   7.309   3.074
  181    HB   THR  26           HB       THR  26  -6.567   7.393   4.952
  182    HG1  THR  26           1HG      THR  26  -8.137   6.268   4.176
  183   HG21  THR  26          3HG2      THR  26  -7.474   8.627   2.581
  184   HG22  THR  26          1HG2      THR  26  -5.723   8.849   2.662
  185   HG23  THR  26          2HG2      THR  26  -6.748   9.376   4.002
  186    H    GLN  27           H        GLN  27  -5.201   4.318   4.705
  187    HA   GLN  27           HA       GLN  27  -4.303   4.984   7.281
  188    HB2  GLN  27           2HB      GLN  27  -5.470   2.872   6.736
  189    HB3  GLN  27           1HB      GLN  27  -4.056   2.334   5.841
  190    HG2  GLN  27           2HG      GLN  27  -2.762   2.147   7.797
  191    HG3  GLN  27           1HG      GLN  27  -3.940   3.044   8.752
  192   HE21  GLN  27          1HE2      GLN  27  -2.775   0.349   9.095
  193   HE22  GLN  27          2HE2      GLN  27  -4.124  -0.723   9.206
  194    H    LEU  28           H        LEU  28  -2.660   4.498   4.303
  195    HA   LEU  28           HA       LEU  28  -0.059   4.161   5.504
  196    HB2  LEU  28           2HB      LEU  28  -0.957   3.101   3.315
  197    HB3  LEU  28           1HB      LEU  28  -0.571   4.659   2.610
  198    HG   LEU  28           HG       LEU  28   1.540   3.184   4.135
  199   HD11  LEU  28          1HD1      LEU  28   0.226   1.872   2.161
  200   HD12  LEU  28          2HD1      LEU  28   1.925   1.628   2.565
  201   HD13  LEU  28          3HD1      LEU  28   1.480   2.703   1.241
  202   HD21  LEU  28          3HD2      LEU  28   2.510   5.119   3.518
  203   HD22  LEU  28          1HD2      LEU  28   1.348   5.413   2.225
  204   HD23  LEU  28          2HD2      LEU  28   2.699   4.308   1.965
  205    H    ILE  29           H        ILE  29  -2.040   6.632   4.705
  206    HA   ILE  29           HA       ILE  29  -0.266   8.597   3.787
  207    HB   ILE  29           HB       ILE  29  -2.882   8.881   5.203
  208   HG12  ILE  29          2HG1      ILE  29  -2.771   7.701   2.957
  209   HG13  ILE  29          1HG1      ILE  29  -3.900   9.043   3.095
  210   HG21  ILE  29          1HG2      ILE  29  -1.238  10.971   3.781
  211   HG22  ILE  29          2HG2      ILE  29  -1.720  10.955   5.478
  212   HG23  ILE  29          3HG2      ILE  29  -2.932  11.183   4.217
  213   HD11  ILE  29          3HD1      ILE  29  -1.390  10.014   2.173
  214   HD12  ILE  29          1HD1      ILE  29  -2.968  10.036   1.380
  215   HD13  ILE  29          2HD1      ILE  29  -1.901   8.644   1.185
  216    H    GLU  30           H        GLU  30  -0.661   7.243   6.689
  217    HA   GLU  30           HA       GLU  30   0.178   9.417   8.334
  218    HB2  GLU  30           2HB      GLU  30   0.169   6.515   9.124
  219    HB3  GLU  30           1HB      GLU  30   0.098   7.911  10.190
  220    HG2  GLU  30           2HG      GLU  30  -2.119   8.317   9.738
  221    HG3  GLU  30           1HG      GLU  30  -2.062   7.490   8.181
  222    H    ALA  31           H        ALA  31   1.769   7.801   6.156
  223    HA   ALA  31           HA       ALA  31   4.262   7.431   7.627
  224    HB1  ALA  31           1HB      ALA  31   3.885   5.641   6.173
  225    HB2  ALA  31           2HB      ALA  31   5.071   6.638   5.329
  226    HB3  ALA  31           3HB      ALA  31   3.374   6.699   4.857
  227    H    PHE  32           H        PHE  32   2.805   9.524   5.228
  228    HA   PHE  32           HA       PHE  32   5.092  10.831   4.294
  229    HB2  PHE  32           2HB      PHE  32   2.292  11.921   4.644
  230    HB3  PHE  32           1HB      PHE  32   3.557  12.673   3.680
  231    HD1  PHE  32           2HD      PHE  32   4.474  11.401   1.699
  232    HD2  PHE  32           1HD      PHE  32   0.928  10.250   3.750
  233    HE1  PHE  32           2HE      PHE  32   3.787  10.061  -0.248
  234    HE2  PHE  32           1HE      PHE  32   0.235   8.907   1.807
  235    HZ   PHE  32           HZ       PHE  32   1.666   8.812  -0.194
  236    H    TYR  33           H        TYR  33   3.302  11.184   7.262
  237    HA   TYR  33           HA       TYR  33   4.820  13.581   7.982
  238    HB2  TYR  33           2HB      TYR  33   2.638  12.232   9.577
  239    HB3  TYR  33           1HB      TYR  33   3.275  13.859   9.797
  240    HD1  TYR  33           1HD      TYR  33   2.930  15.521   7.858
  241    HD2  TYR  33           2HD      TYR  33   0.764  11.878   8.237
  242    HE1  TYR  33           1HE      TYR  33   1.188  16.408   6.365
  243    HE2  TYR  33           2HE      TYR  33  -0.983  12.754   6.745
  244    HH   TYR  33           HH       TYR  33  -0.917  14.697   4.774
  245    H    ASN  34           H        ASN  34   6.218  11.107   7.767
  246    HA   ASN  34           HA       ASN  34   7.542  11.101  10.292
  247    HB2  ASN  34           2HB      ASN  34   5.380   9.481  10.327
  248    HB3  ASN  34           1HB      ASN  34   6.581   8.365   9.686
  249   HD21  ASN  34          1HD2      ASN  34   8.838   9.069  10.978
  250   HD22  ASN  34          2HD2      ASN  34   8.664   8.821  12.679
  251    H    PHE  35           H        PHE  35   8.150  11.494   7.487
  252    HA   PHE  35           HA       PHE  35  10.603  10.144   7.337
  253    HB2  PHE  35           2HB      PHE  35   9.154   8.192   6.837
  254    HB3  PHE  35           1HB      PHE  35   8.507   9.055   5.445
  255    HD1  PHE  35           1HD      PHE  35  11.987   8.669   6.722
  256    HD2  PHE  35           2HD      PHE  35   9.242   7.993   3.543
  257    HE1  PHE  35           1HE      PHE  35  13.818   7.792   5.334
  258    HE2  PHE  35           2HE      PHE  35  11.068   7.114   2.148
  259    HZ   PHE  35           HZ       PHE  35  13.360   7.012   3.044
  260    H    ASP  36           H        ASP  36   9.692  12.776   7.052
  261    HA   ASP  36           HA       ASP  36  10.533  13.321   4.289
  262    HB2  ASP  36           2HB      ASP  36   8.947  15.261   4.264
  263    HB3  ASP  36           1HB      ASP  36   8.153  13.689   4.290
  264    H    GLY  37           H        GLY  37  12.459  13.328   6.029
  265    HA2  GLY  37           2HA      GLY  37  12.728  15.996   7.208
  266    HA3  GLY  37           1HA      GLY  37  13.779  14.621   7.510
  267    H    ASP  38           H        ASP  38  12.863  15.512   4.270
  268    HA   ASP  38           HA       ASP  38  14.060  16.254   2.486
  269    HB2  ASP  38           2HB      ASP  38  14.184  18.322   3.850
  270    HB3  ASP  38           1HB      ASP  38  15.681  17.737   4.568
  271    H    TYR  39           H        TYR  39  14.725  13.886   2.566
  272    HA   TYR  39           HA       TYR  39  17.660  13.725   2.778
  273    HB2  TYR  39           2HB      TYR  39  15.566  11.675   3.487
  274    HB3  TYR  39           1HB      TYR  39  17.242  11.229   3.180
  275    HD1  TYR  39           1HD      TYR  39  15.034  13.206   5.395
  276    HD2  TYR  39           2HD      TYR  39  18.915  11.561   4.828
  277    HE1  TYR  39           1HE      TYR  39  15.593  13.733   7.732
  278    HE2  TYR  39           2HE      TYR  39  19.484  12.082   7.163
  279    HH   TYR  39           HH       TYR  39  17.539  14.098   9.123
  280    H    ASP  40           H        ASP  40  15.213  11.514   1.457
  281    HA   ASP  40           HA       ASP  40  15.609  12.103  -1.250
  282    HB2  ASP  40           2HB      ASP  40  16.961  10.065  -1.877
  283    HB3  ASP  40           1HB      ASP  40  17.863  11.331  -1.048
  284    H    GLY  41           H        GLY  41  15.105   9.915  -2.599
  285    HA2  GLY  41           2HA      GLY  41  12.598   8.961  -1.422
  286    HA3  GLY  41           1HA      GLY  41  13.044   8.868  -3.119
  287    H    PHE  42           H        PHE  42  15.628   7.722  -2.739
  288    HA   PHE  42           HA       PHE  42  14.961   4.994  -2.707
  289    HB2  PHE  42           2HB      PHE  42  17.624   6.398  -2.474
  290    HB3  PHE  42           1HB      PHE  42  17.463   4.649  -2.606
  291    HD1  PHE  42           2HD      PHE  42  15.914   3.884  -4.635
  292    HD2  PHE  42           1HD      PHE  42  18.017   7.575  -4.397
  293    HE1  PHE  42           2HE      PHE  42  15.849   4.073  -7.087
  294    HE2  PHE  42           1HE      PHE  42  17.956   7.772  -6.850
  295    HZ   PHE  42           HZ       PHE  42  16.871   6.020  -8.197
  296    H    VAL  43           H        VAL  43  14.611   3.645  -1.084
  297    HA   VAL  43           HA       VAL  43  15.998   4.015   1.455
  298    HB   VAL  43           HB       VAL  43  13.897   5.222   1.769
  299   HG11  VAL  43          1HG1      VAL  43  12.685   3.800   0.026
  300   HG12  VAL  43          2HG1      VAL  43  11.772   4.298   1.451
  301   HG13  VAL  43          3HG1      VAL  43  12.404   2.656   1.339
  302   HG21  VAL  43          3HG2      VAL  43  14.739   4.173   3.724
  303   HG22  VAL  43          1HG2      VAL  43  14.128   2.596   3.226
  304   HG23  VAL  43          2HG2      VAL  43  13.002   3.870   3.698
  305    H    SER  44           H        SER  44  17.004   2.133   1.696
  306    HA   SER  44           HA       SER  44  16.174  -0.292   0.512
  307    HB2  SER  44           2HB      SER  44  17.995  -0.226   2.895
  308    HB3  SER  44           1HB      SER  44  18.080  -1.241   1.457
  309    HG   SER  44           HG       SER  44  18.489   0.864   0.338
  310    H    VAL  45           H        VAL  45  15.661  -2.293   1.666
  311    HA   VAL  45           HA       VAL  45  13.369  -2.076   3.240
  312    HB   VAL  45           HB       VAL  45  15.255  -4.429   3.034
  313   HG11  VAL  45          1HG1      VAL  45  13.431  -5.799   3.758
  314   HG12  VAL  45          2HG1      VAL  45  12.343  -4.417   3.794
  315   HG13  VAL  45          3HG1      VAL  45  13.671  -4.524   4.949
  316   HG21  VAL  45          3HG2      VAL  45  13.978  -5.197   1.210
  317   HG22  VAL  45          1HG2      VAL  45  14.284  -3.493   0.885
  318   HG23  VAL  45          2HG2      VAL  45  12.711  -4.005   1.493
  319    H    GLU  46           H        GLU  46  16.627  -3.115   4.225
  320    HA   GLU  46           HA       GLU  46  16.259  -3.457   6.911
  321    HB2  GLU  46           2HB      GLU  46  18.703  -2.078   5.817
  322    HB3  GLU  46           1HB      GLU  46  18.595  -3.171   7.190
  323    HG2  GLU  46           2HG      GLU  46  17.877  -4.941   5.491
  324    HG3  GLU  46           1HG      GLU  46  18.470  -3.818   4.268
  325    H    GLU  47           H        GLU  47  16.811  -0.411   5.203
  326    HA   GLU  47           HA       GLU  47  16.786   1.152   7.621
  327    HB2  GLU  47           2HB      GLU  47  17.273   1.610   4.779
  328    HB3  GLU  47           1HB      GLU  47  16.339   2.904   5.517
  329    HG2  GLU  47           2HG      GLU  47  18.752   1.963   6.955
  330    HG3  GLU  47           1HG      GLU  47  18.985   2.902   5.480
  331    H    PHE  48           H        PHE  48  14.488   0.062   5.265
  332    HA   PHE  48           HA       PHE  48  12.426   1.930   5.790
  333    HB2  PHE  48           2HB      PHE  48  12.823  -0.058   3.952
  334    HB3  PHE  48           1HB      PHE  48  11.587  -0.771   4.980
  335    HD1  PHE  48           2HD      PHE  48  10.000   1.590   5.727
  336    HD2  PHE  48           1HD      PHE  48  11.729   0.494   1.995
  337    HE1  PHE  48           2HE      PHE  48   8.278   2.894   4.550
  338    HE2  PHE  48           1HE      PHE  48  10.010   1.797   0.812
  339    HZ   PHE  48           HZ       PHE  48   8.281   2.999   2.089
  340    H    ARG  49           H        ARG  49  13.457  -1.014   7.350
  341    HA   ARG  49           HA       ARG  49  11.168  -1.704   8.766
  342    HB2  ARG  49           2HB      ARG  49  13.985  -1.902   9.833
  343    HB3  ARG  49           1HB      ARG  49  12.607  -2.900  10.276
  344    HG2  ARG  49           2HG      ARG  49  14.064  -2.870   7.644
  345    HG3  ARG  49           1HG      ARG  49  14.029  -4.167   8.841
  346    HD2  ARG  49           2HD      ARG  49  11.570  -3.149   7.433
  347    HD3  ARG  49           1HD      ARG  49  12.545  -4.488   6.826
  348    HE   ARG  49           HE       ARG  49  10.639  -4.588   8.928
  349   HH11  ARG  49          1HH1      ARG  49  13.701  -5.915   7.904
  350   HH12  ARG  49          2HH1      ARG  49  13.496  -7.394   8.783
  351   HH21  ARG  49          1HH2      ARG  49  10.369  -6.532  10.085
  352   HH22  ARG  49          2HH2      ARG  49  11.605  -7.744  10.021
  353    H    GLY  50           H        GLY  50  13.878   0.322   9.910
  354    HA2  GLY  50           2HA      GLY  50  12.795   1.056  12.359
  355    HA3  GLY  50           1HA      GLY  50  13.936   2.028  11.446
  356    H    ILE  51           H        ILE  51  11.920   2.134   9.188
  357    HA   ILE  51           HA       ILE  51  10.569   4.511  10.134
  358    HB   ILE  51           HB       ILE  51  10.351   3.267   7.397
  359   HG12  ILE  51          2HG1      ILE  51  12.345   5.337   8.344
  360   HG13  ILE  51          1HG1      ILE  51  12.727   3.649   8.023
  361   HG21  ILE  51          1HG2      ILE  51   8.742   4.880   7.412
  362   HG22  ILE  51          2HG2      ILE  51  10.129   5.866   6.951
  363   HG23  ILE  51          3HG2      ILE  51   9.572   5.854   8.625
  364   HD11  ILE  51          3HD1      ILE  51  13.413   4.843   6.126
  365   HD12  ILE  51          1HD1      ILE  51  11.917   5.775   6.070
  366   HD13  ILE  51          2HD1      ILE  51  11.901   4.059   5.669
  367    H    ILE  52           H        ILE  52   9.800   1.193   9.519
  368    HA   ILE  52           HA       ILE  52   6.928   1.713   9.496
  369    HB   ILE  52           HB       ILE  52   8.461  -0.879   9.235
  370   HG12  ILE  52          2HG1      ILE  52   8.694   0.693   7.330
  371   HG13  ILE  52          1HG1      ILE  52   7.834  -0.779   6.888
  372   HG21  ILE  52          1HG2      ILE  52   6.431  -1.577  10.091
  373   HG22  ILE  52          2HG2      ILE  52   6.135  -1.629   8.353
  374   HG23  ILE  52          3HG2      ILE  52   5.533  -0.276   9.309
  375   HD11  ILE  52          3HD1      ILE  52   6.989   1.952   6.707
  376   HD12  ILE  52          1HD1      ILE  52   5.862   1.025   7.699
  377   HD13  ILE  52          2HD1      ILE  52   6.233   0.497   6.056
  378    H    ARG  53           H        ARG  53   9.411   0.279  11.541
  379    HA   ARG  53           HA       ARG  53   7.842  -0.990  13.437
  380    HB2  ARG  53           2HB      ARG  53  10.472  -0.690  13.154
  381    HB3  ARG  53           1HB      ARG  53  10.215   0.538  14.386
  382    HG2  ARG  53           2HG      ARG  53   9.849  -0.974  16.002
  383    HG3  ARG  53           1HG      ARG  53   8.929  -2.040  14.938
  384    HD2  ARG  53           2HD      ARG  53  10.701  -3.387  14.942
  385    HD3  ARG  53           1HD      ARG  53  11.518  -2.175  13.957
  386    HE   ARG  53           HE       ARG  53  11.991  -2.768  16.734
  387   HH11  ARG  53          1HH1      ARG  53  12.305  -0.371  14.216
  388   HH12  ARG  53          2HH1      ARG  53  13.607   0.460  14.998
  389   HH21  ARG  53          1HH2      ARG  53  13.702  -1.675  17.764
  390   HH22  ARG  53          2HH2      ARG  53  14.400  -0.279  17.012
  391    H    ASP  54           H        ASP  54   8.876   2.407  13.347
  392    HA   ASP  54           HA       ASP  54   6.923   2.977  15.475
  393    HB2  ASP  54           2HB      ASP  54   9.444   4.438  14.682
  394    HB3  ASP  54           1HB      ASP  54   8.265   5.080  15.822
  395    H    GLY  55           H        GLY  55   6.753   2.884  12.353
  396    HA2  GLY  55           2HA      GLY  55   5.667   5.606  12.006
  397    HA3  GLY  55           1HA      GLY  55   6.226   4.579  10.696
  398    H    LEU  56           H        LEU  56   4.913   2.865   9.977
  399    HA   LEU  56           HA       LEU  56   2.080   3.261  10.606
  400    HB2  LEU  56           2HB      LEU  56   3.178   1.634   8.331
  401    HB3  LEU  56           1HB      LEU  56   1.573   2.323   8.496
  402    HG   LEU  56           HG       LEU  56   3.048   4.584   8.531
  403   HD11  LEU  56          1HD1      LEU  56   4.997   2.802   7.984
  404   HD12  LEU  56          2HD1      LEU  56   5.014   4.481   7.446
  405   HD13  LEU  56          3HD1      LEU  56   4.466   3.210   6.352
  406   HD21  LEU  56          3HD2      LEU  56   1.962   5.033   6.610
  407   HD22  LEU  56          1HD2      LEU  56   1.166   3.492   6.928
  408   HD23  LEU  56          2HD2      LEU  56   2.536   3.566   5.820
  409    HA   PRO  57           HA       PRO  57   2.074  -0.669  12.681
  410    HB2  PRO  57           2HB      PRO  57  -0.554  -0.894  13.152
  411    HB3  PRO  57           1HB      PRO  57   0.429   0.323  13.976
  412    HG2  PRO  57           2HG      PRO  57  -1.401   0.633  11.629
  413    HG3  PRO  57           1HG      PRO  57  -1.186   1.698  13.030
  414    HD2  PRO  57           2HD      PRO  57  -0.028   2.119  10.568
  415    HD3  PRO  57           1HD      PRO  57   0.611   2.755  12.095
  416    H    MET  58           H        MET  58   2.583  -1.184  10.142
  417    HA   MET  58           HA       MET  58   0.451  -2.739   8.944
  418    HB2  MET  58           2HB      MET  58   2.736  -1.399   7.985
  419    HB3  MET  58           1HB      MET  58   3.021  -3.106   7.684
  420    HG2  MET  58           2HG      MET  58   1.105  -3.296   6.336
  421    HG3  MET  58           1HG      MET  58   0.471  -1.744   6.883
  422    HE1  MET  58           3HE      MET  58   1.797  -3.405   3.894
  423    HE2  MET  58           1HE      MET  58   3.270  -3.550   4.854
  424    HE3  MET  58           2HE      MET  58   3.257  -2.544   3.406
  425    H    THR  59           H        THR  59   0.396  -4.954   8.776
  426    HA   THR  59           HA       THR  59   1.822  -6.429  10.781
  427    HB   THR  59           HB       THR  59   0.621  -8.353   9.278
  428    HG1  THR  59           1HG      THR  59  -1.128  -6.148   9.066
  429   HG21  THR  59          3HG2      THR  59  -0.582  -6.613  11.406
  430   HG22  THR  59          1HG2      THR  59   0.125  -8.221  11.570
  431   HG23  THR  59          2HG2      THR  59  -1.411  -8.014  10.729
  432    H    GLU  60           H        GLU  60   3.355  -8.043  10.490
  433    HA   GLU  60           HA       GLU  60   5.456  -7.717   8.828
  434    HB2  GLU  60           2HB      GLU  60   5.775 -10.266   9.011
  435    HB3  GLU  60           1HB      GLU  60   5.731  -9.335  10.501
  436    HG2  GLU  60           2HG      GLU  60   3.238  -9.936  10.565
  437    HG3  GLU  60           1HG      GLU  60   3.643 -11.147   9.349
  438    H    ALA  61           H        ALA  61   2.741  -9.871   8.156
  439    HA   ALA  61           HA       ALA  61   3.425 -10.878   5.720
  440    HB1  ALA  61           1HB      ALA  61   1.388 -11.747   5.862
  441    HB2  ALA  61           2HB      ALA  61   0.650 -10.158   5.653
  442    HB3  ALA  61           3HB      ALA  61   1.092 -10.721   7.266
  443    H    GLU  62           H        GLU  62   1.620  -7.845   6.254
  444    HA   GLU  62           HA       GLU  62   1.436  -7.062   3.586
  445    HB2  GLU  62           2HB      GLU  62   1.943  -4.879   5.518
  446    HB3  GLU  62           1HB      GLU  62   0.652  -5.059   4.342
  447    HG2  GLU  62           2HG      GLU  62   0.840  -6.282   7.071
  448    HG3  GLU  62           1HG      GLU  62  -0.319  -5.088   6.498
  449    H    ILE  63           H        ILE  63   3.789  -5.885   5.977
  450    HA   ILE  63           HA       ILE  63   5.473  -4.574   4.154
  451    HB   ILE  63           HB       ILE  63   6.541  -5.870   6.646
  452   HG12  ILE  63          2HG1      ILE  63   5.744  -3.335   7.412
  453   HG13  ILE  63          1HG1      ILE  63   4.386  -3.910   6.446
  454   HG21  ILE  63          1HG2      ILE  63   7.799  -4.385   4.825
  455   HG22  ILE  63          2HG2      ILE  63   8.202  -4.327   6.541
  456   HG23  ILE  63          3HG2      ILE  63   7.163  -3.090   5.838
  457   HD11  ILE  63          3HD1      ILE  63   5.318  -4.760   9.077
  458   HD12  ILE  63          1HD1      ILE  63   4.913  -6.079   7.976
  459   HD13  ILE  63          2HD1      ILE  63   3.716  -4.842   8.347
  460    H    THR  64           H        THR  64   6.078  -7.685   5.767
  461    HA   THR  64           HA       THR  64   8.323  -8.468   4.380
  462    HB   THR  64           HB       THR  64   6.065 -10.151   5.444
  463    HG1  THR  64           1HG      THR  64   7.063  -8.997   7.061
  464   HG21  THR  64          3HG2      THR  64   8.833 -10.994   4.644
  465   HG22  THR  64          1HG2      THR  64   7.301 -11.550   3.966
  466   HG23  THR  64          2HG2      THR  64   7.732 -11.964   5.625
  467    H    GLU  65           H        GLU  65   4.933  -9.253   3.586
  468    HA   GLU  65           HA       GLU  65   5.585 -10.600   1.193
  469    HB2  GLU  65           2HB      GLU  65   3.402 -10.778   2.473
  470    HB3  GLU  65           1HB      GLU  65   2.967  -9.236   1.744
  471    HG2  GLU  65           2HG      GLU  65   1.948 -10.798   0.371
  472    HG3  GLU  65           1HG      GLU  65   3.427 -10.391  -0.497
  473    H    PHE  66           H        PHE  66   5.557  -7.425   2.022
  474    HA   PHE  66           HA       PHE  66   5.231  -6.459  -0.692
  475    HB2  PHE  66           2HB      PHE  66   5.241  -5.151   1.992
  476    HB3  PHE  66           1HB      PHE  66   5.702  -4.188   0.594
  477    HD1  PHE  66           2HD      PHE  66   3.212  -6.885   0.404
  478    HD2  PHE  66           1HD      PHE  66   3.851  -2.690   0.734
  479    HE1  PHE  66           2HE      PHE  66   0.840  -6.487  -0.112
  480    HE2  PHE  66           1HE      PHE  66   1.479  -2.286   0.218
  481    HZ   PHE  66           HZ       PHE  66  -0.029  -4.186  -0.205
  482    H    PHE  67           H        PHE  67   7.658  -7.110   1.688
  483    HA   PHE  67           HA       PHE  67   9.718  -5.542   0.412
  484    HB2  PHE  67           2HB      PHE  67   9.595  -7.443   2.719
  485    HB3  PHE  67           1HB      PHE  67  11.162  -7.065   2.013
  486    HD1  PHE  67           1HD      PHE  67  10.303  -4.116   1.323
  487    HD2  PHE  67           2HD      PHE  67  10.149  -6.508   4.846
  488    HE1  PHE  67           1HE      PHE  67  10.410  -2.086   2.705
  489    HE2  PHE  67           2HE      PHE  67  10.255  -4.477   6.230
  490    HZ   PHE  67           HZ       PHE  67  10.385  -2.265   5.160
  491    H    GLU  68           H        GLU  68   8.519  -8.804   0.239
  492    HA   GLU  68           HA       GLU  68  10.815  -9.755  -1.257
  493    HB2  GLU  68           2HB      GLU  68   8.194 -11.179  -0.787
  494    HB3  GLU  68           1HB      GLU  68   9.730 -11.895  -1.257
  495    HG2  GLU  68           2HG      GLU  68   9.809 -10.389   1.253
  496    HG3  GLU  68           1HG      GLU  68   8.761 -11.807   1.273
  497    H    ALA  69           H        ALA  69   7.566  -8.617  -1.845
  498    HA   ALA  69           HA       ALA  69   7.548  -9.441  -4.595
  499    HB1  ALA  69           1HB      ALA  69   5.478  -9.337  -3.266
  500    HB2  ALA  69           2HB      ALA  69   5.394  -8.347  -4.725
  501    HB3  ALA  69           3HB      ALA  69   5.679  -7.588  -3.157
  502    H    ALA  70           H        ALA  70   8.864  -6.965  -2.924
  503    HA   ALA  70           HA       ALA  70   8.841  -5.097  -5.183
  504    HB1  ALA  70           1HB      ALA  70   8.224  -4.364  -2.816
  505    HB2  ALA  70           2HB      ALA  70   9.382  -3.370  -3.696
  506    HB3  ALA  70           3HB      ALA  70   9.946  -4.491  -2.457
  507    H    ASP  71           H        ASP  71  10.909  -7.170  -3.313
  508    HA   ASP  71           HA       ASP  71  13.188  -6.351  -4.990
  509    HB2  ASP  71           2HB      ASP  71  13.444  -5.705  -2.588
  510    HB3  ASP  71           1HB      ASP  71  13.351  -7.412  -2.162
  511    HA   PRO  72           HA       PRO  72  12.572 -10.670  -6.222
  512    HB2  PRO  72           2HB      PRO  72  14.375 -10.599  -8.267
  513    HB3  PRO  72           1HB      PRO  72  12.714 -10.017  -8.414
  514    HG2  PRO  72           2HG      PRO  72  15.228  -8.467  -7.938
  515    HG3  PRO  72           1HG      PRO  72  13.866  -8.091  -9.010
  516    HD2  PRO  72           2HD      PRO  72  14.164  -6.915  -6.601
  517    HD3  PRO  72           1HD      PRO  72  12.564  -7.284  -7.279
  518    H    ASN  73           H        ASN  73  15.773  -9.128  -6.009
  519    HA   ASN  73           HA       ASN  73  17.196 -11.550  -5.611
  520    HB2  ASN  73           2HB      ASN  73  18.067  -8.790  -4.751
  521    HB3  ASN  73           1HB      ASN  73  19.096 -10.169  -5.123
  522   HD21  ASN  73          1HD2      ASN  73  17.247  -7.554  -6.384
  523   HD22  ASN  73          2HD2      ASN  73  17.721  -7.733  -8.036
  524    H    ASN  74           H        ASN  74  15.614  -9.284  -3.476
  525    HA   ASN  74           HA       ASN  74  14.973  -9.474  -1.298
  526    HB2  ASN  74           2HB      ASN  74  16.358 -12.150  -1.154
  527    HB3  ASN  74           1HB      ASN  74  15.030 -11.557  -0.161
  528   HD21  ASN  74          1HD2      ASN  74  15.594 -13.820  -2.239
  529   HD22  ASN  74          2HD2      ASN  74  14.136 -13.839  -3.165
  530    H    THR  75           H        THR  75  17.674  -8.609  -2.345
  531    HA   THR  75           HA       THR  75  19.633  -9.178  -0.417
  532    HB   THR  75           HB       THR  75  20.437  -8.291  -2.431
  533    HG1  THR  75           1HG      THR  75  20.475  -6.043  -0.714
  534   HG21  THR  75          3HG2      THR  75  18.385  -6.135  -2.116
  535   HG22  THR  75          1HG2      THR  75  18.623  -7.253  -3.459
  536   HG23  THR  75          2HG2      THR  75  19.780  -5.952  -3.178
  537    H    GLY  76           H        GLY  76  16.900  -7.089  -0.370
  538    HA2  GLY  76           2HA      GLY  76  16.102  -6.338   1.791
  539    HA3  GLY  76           1HA      GLY  76  17.776  -6.065   2.253
  540    H    PHE  77           H        PHE  77  16.867  -5.122  -0.928
  541    HA   PHE  77           HA       PHE  77  16.517  -2.335  -0.066
  542    HB2  PHE  77           2HB      PHE  77  18.327  -3.279  -2.300
  543    HB3  PHE  77           1HB      PHE  77  17.963  -1.596  -1.933
  544    HD1  PHE  77           2HD      PHE  77  19.177  -4.644  -0.145
  545    HD2  PHE  77           1HD      PHE  77  19.535  -0.445  -0.737
  546    HE1  PHE  77           2HE      PHE  77  21.064  -4.587   1.433
  547    HE2  PHE  77           1HE      PHE  77  21.424  -0.381   0.836
  548    HZ   PHE  77           HZ       PHE  77  22.191  -2.453   1.925
  549    H    ILE  78           H        ILE  78  15.210  -1.058  -1.383
  550    HA   ILE  78           HA       ILE  78  13.912  -2.410  -3.654
  551    HB   ILE  78           HB       ILE  78  12.302  -0.604  -1.898
  552   HG12  ILE  78          2HG1      ILE  78  11.887  -3.467  -1.418
  553   HG13  ILE  78          1HG1      ILE  78  13.409  -2.847  -0.782
  554   HG21  ILE  78          1HG2      ILE  78  10.478  -1.485  -2.972
  555   HG22  ILE  78          2HG2      ILE  78  11.302  -2.990  -3.376
  556   HG23  ILE  78          3HG2      ILE  78  11.692  -1.509  -4.249
  557   HD11  ILE  78          3HD1      ILE  78  12.272  -2.141   0.982
  558   HD12  ILE  78          1HD1      ILE  78  10.733  -2.527   0.210
  559   HD13  ILE  78          2HD1      ILE  78  11.491  -0.958  -0.070
  560    H    ASP  79           H        ASP  79  13.238  -1.086  -5.327
  561    HA   ASP  79           HA       ASP  79  14.533   1.484  -5.494
  562    HB2  ASP  79           2HB      ASP  79  13.038  -0.301  -7.346
  563    HB3  ASP  79           1HB      ASP  79  12.972   1.424  -7.698
  564    H    TYR  80           H        TYR  80  13.650   3.095  -4.357
  565    HA   TYR  80           HA       TYR  80  11.400   3.438  -3.066
  566    HB2  TYR  80           2HB      TYR  80  13.079   5.208  -3.277
  567    HB3  TYR  80           1HB      TYR  80  12.513   5.567  -4.905
  568    HD1  TYR  80           1HD      TYR  80  10.732   5.004  -1.664
  569    HD2  TYR  80           2HD      TYR  80  11.477   7.628  -4.929
  570    HE1  TYR  80           1HE      TYR  80   9.109   6.603  -0.740
  571    HE2  TYR  80           2HE      TYR  80   9.856   9.234  -4.015
  572    HH   TYR  80           HH       TYR  80   8.821   9.288  -0.994
  573    H    LYS  81           H        LYS  81  11.527   3.777  -6.593
  574    HA   LYS  81           HA       LYS  81   8.858   4.625  -6.918
  575    HB2  LYS  81           2HB      LYS  81  10.894   3.381  -8.732
  576    HB3  LYS  81           1HB      LYS  81   9.235   3.568  -9.283
  577    HG2  LYS  81           2HG      LYS  81  10.450   5.967  -8.093
  578    HG3  LYS  81           1HG      LYS  81  11.157   5.422  -9.615
  579    HD2  LYS  81           2HD      LYS  81   9.491   6.793 -10.396
  580    HD3  LYS  81           1HD      LYS  81   8.637   5.250 -10.348
  581    HE2  LYS  81           2HE      LYS  81   7.295   5.895  -8.650
  582    HE3  LYS  81           1HE      LYS  81   8.565   6.829  -7.861
  583    HZ1  LYS  81           3HZ      LYS  81   6.610   7.662  -9.847
  584    HZ2  LYS  81           1HZ      LYS  81   8.161   8.318 -10.012
  585    HZ3  LYS  81           2HZ      LYS  81   7.299   8.535  -8.574
  586    H    ALA  82           H        ALA  82  10.309   1.387  -7.288
  587    HA   ALA  82           HA       ALA  82   8.043  -0.063  -7.890
  588    HB1  ALA  82           1HB      ALA  82   9.666  -1.535  -6.015
  589    HB2  ALA  82           2HB      ALA  82  10.675  -0.655  -7.164
  590    HB3  ALA  82           3HB      ALA  82   9.450  -1.781  -7.750
  591    H    PHE  83           H        PHE  83   9.001   1.345  -4.868
  592    HA   PHE  83           HA       PHE  83   6.933  -0.074  -3.388
  593    HB2  PHE  83           2HB      PHE  83   9.452   1.013  -2.734
  594    HB3  PHE  83           1HB      PHE  83   8.259   1.970  -1.855
  595    HD1  PHE  83           1HD      PHE  83   8.516  -1.637  -2.748
  596    HD2  PHE  83           2HD      PHE  83   8.129   1.271   0.332
  597    HE1  PHE  83           1HE      PHE  83   8.346  -3.433  -1.085
  598    HE2  PHE  83           2HE      PHE  83   7.957  -0.523   2.009
  599    HZ   PHE  83           HZ       PHE  83   8.066  -2.881   1.302
  600    H    ALA  84           H        ALA  84   7.696   3.140  -4.588
  601    HA   ALA  84           HA       ALA  84   5.506   4.427  -3.259
  602    HB1  ALA  84           1HB      ALA  84   7.394   5.773  -3.772
  603    HB2  ALA  84           2HB      ALA  84   6.073   6.332  -4.798
  604    HB3  ALA  84           3HB      ALA  84   7.344   5.310  -5.473
  605    H    ALA  85           H        ALA  85   5.891   2.658  -6.197
  606    HA   ALA  85           HA       ALA  85   3.680   3.773  -7.580
  607    HB1  ALA  85           1HB      ALA  85   3.958   1.962  -9.155
  608    HB2  ALA  85           2HB      ALA  85   4.994   1.112  -8.009
  609    HB3  ALA  85           3HB      ALA  85   5.534   2.630  -8.728
  610    H    MET  86           H        MET  86   3.896   1.778  -4.999
  611    HA   MET  86           HA       MET  86   1.633   0.095  -5.431
  612    HB2  MET  86           2HB      MET  86   3.062   0.842  -2.873
  613    HB3  MET  86           1HB      MET  86   1.837  -0.411  -3.008
  614    HG2  MET  86           2HG      MET  86   4.287  -0.502  -4.715
  615    HG3  MET  86           1HG      MET  86   4.336  -1.059  -3.043
  616    HE1  MET  86           3HE      MET  86   4.147  -2.293  -6.495
  617    HE2  MET  86           1HE      MET  86   3.960  -3.978  -6.010
  618    HE3  MET  86           2HE      MET  86   5.189  -2.972  -5.245
  619    H    LEU  87           H        LEU  87   2.151   3.264  -4.059
  620    HA   LEU  87           HA       LEU  87  -0.632   3.414  -3.226
  621    HB2  LEU  87           2HB      LEU  87   1.679   5.248  -2.733
  622    HB3  LEU  87           1HB      LEU  87   0.053   5.550  -2.149
  623    HG   LEU  87           HG       LEU  87   1.160   2.942  -1.358
  624   HD11  LEU  87          1HD1      LEU  87   2.814   3.642   0.085
  625   HD12  LEU  87          2HD1      LEU  87   2.244   5.310   0.101
  626   HD13  LEU  87          3HD1      LEU  87   3.093   4.680  -1.311
  627   HD21  LEU  87          3HD2      LEU  87   0.244   4.869   0.651
  628   HD22  LEU  87          1HD2      LEU  87  -0.249   3.200   0.368
  629   HD23  LEU  87          2HD2      LEU  87  -0.938   4.499  -0.603
  630    H    TYR  88           H        TYR  88   1.188   4.058  -5.755
  631    HA   TYR  88           HA       TYR  88  -0.654   6.100  -6.792
  632    HB2  TYR  88           2HB      TYR  88   2.325   5.896  -7.264
  633    HB3  TYR  88           1HB      TYR  88   1.257   6.959  -8.175
  634    HD1  TYR  88           2HD      TYR  88  -0.468   8.157  -6.231
  635    HD2  TYR  88           1HD      TYR  88   3.652   7.159  -5.862
  636    HE1  TYR  88           2HE      TYR  88  -0.205   9.897  -4.513
  637    HE2  TYR  88           1HE      TYR  88   3.926   8.895  -4.143
  638    HH   TYR  88           HH       TYR  88   1.528  10.230  -2.479
  639    H    SER  89           H        SER  89  -0.504   3.097  -6.989
  640    HA   SER  89           HA       SER  89   0.095   2.596  -9.769
  641    HB2  SER  89           2HB      SER  89  -1.152   0.339  -8.997
  642    HB3  SER  89           1HB      SER  89   0.547   0.659  -8.647
  643    HG   SER  89           HG       SER  89  -0.954   0.008  -6.849
  644    H    VAL  90           H        VAL  90  -1.304   3.774 -11.021
  645    HA   VAL  90           HA       VAL  90  -4.108   2.899 -10.944
  646    HB   VAL  90           HB       VAL  90  -3.324   5.764 -11.476
  647   HG11  VAL  90          1HG1      VAL  90  -5.906   5.827 -10.751
  648   HG12  VAL  90          2HG1      VAL  90  -5.841   4.222 -11.475
  649   HG13  VAL  90          3HG1      VAL  90  -5.373   5.634 -12.421
  650   HG21  VAL  90          3HG2      VAL  90  -4.546   6.050  -9.181
  651   HG22  VAL  90          1HG2      VAL  90  -2.831   5.644  -9.230
  652   HG23  VAL  90          2HG2      VAL  90  -4.027   4.384  -8.925
  653    H    ASP  91           H        ASP  91  -1.885   2.079 -12.615
  654    HA   ASP  91           HA       ASP  91  -1.906   3.322 -15.132
  655    HB2  ASP  91           2HB      ASP  91  -0.360   1.441 -14.097
  656    HB3  ASP  91           1HB      ASP  91  -1.490   0.370 -14.919
  657    H    GLU  92           H        GLU  92  -3.444   3.443 -16.616
  658    HA   GLU  92           HA       GLU  92  -5.904   2.022 -16.350
  659    HB2  GLU  92           2HB      GLU  92  -5.804   4.305 -17.255
  660    HB3  GLU  92           1HB      GLU  92  -4.879   3.721 -18.632
  661    HG2  GLU  92           2HG      GLU  92  -7.019   3.886 -19.477
  662    HG3  GLU  92           1HG      GLU  92  -6.898   2.179 -19.053
  663    H    SER  93           H        SER  93  -3.727   2.158 -19.172
  664    HA   SER  93           HA       SER  93  -4.670  -0.448 -20.029
  665    HB2  SER  93           2HB      SER  93  -4.212   1.582 -21.558
  666    HB3  SER  93           1HB      SER  93  -2.508   1.155 -21.383
  667    HG   SER  93           HG       SER  93  -3.777   0.212 -23.214
  Start of MODEL    8
    1    H1   MET   1           1HT      MET   1 -21.469   2.292   1.794
    2    H2   MET   1           2HT      MET   1 -22.907   2.405   2.726
    3    H3   MET   1           3HT      MET   1 -21.435   3.050   3.332
    4    HA   MET   1           HA       MET   1 -21.426   4.525   1.344
    5    HB2  MET   1           2HB      MET   1 -24.050   3.137   1.140
    6    HB3  MET   1           1HB      MET   1 -24.023   4.853   0.757
    7    HG2  MET   1           2HG      MET   1 -21.917   4.050  -0.685
    8    HG3  MET   1           1HG      MET   1 -22.864   2.563  -0.694
    9    HE1  MET   1           2HE      MET   1 -24.099   2.878  -3.771
   10    HE2  MET   1           3HE      MET   1 -25.507   2.716  -2.721
   11    HE3  MET   1           1HE      MET   1 -23.978   1.967  -2.267
   12    H    GLY   2           H        GLY   2 -23.702   3.785   3.933
   13    HA2  GLY   2           2HA      GLY   2 -23.791   6.653   4.618
   14    HA3  GLY   2           1HA      GLY   2 -25.001   5.469   5.091
   15    H    SER   3           H        SER   3 -24.878   4.673   7.084
   16    HA   SER   3           HA       SER   3 -22.501   5.286   8.668
   17    HB2  SER   3           2HB      SER   3 -23.855   5.062  10.597
   18    HB3  SER   3           1HB      SER   3 -24.879   5.880   9.417
   19    HG   SER   3           HG       SER   3 -26.213   4.312   9.827
   20    H    SER   4           H        SER   4 -22.109   3.257   6.836
   21    HA   SER   4           HA       SER   4 -22.608   0.660   7.748
   22    HB2  SER   4           2HB      SER   4 -20.035   1.106   6.353
   23    HB3  SER   4           1HB      SER   4 -21.345  -0.012   5.975
   24    HG   SER   4           HG       SER   4 -21.031   2.680   5.255
   25    H    HIS   5           H        HIS   5 -21.506  -0.749   9.052
   26    HA   HIS   5           HA       HIS   5 -19.579   0.474  10.881
   27    HB2  HIS   5           2HB      HIS   5 -21.753  -1.041  11.420
   28    HB3  HIS   5           1HB      HIS   5 -20.516  -2.293  11.362
   29    HD1  HIS   5           1HD      HIS   5 -20.112  -2.820  13.759
   30    HD2  HIS   5           2HD      HIS   5 -20.174   1.273  13.043
   31    HE1  HIS   5           1HE      HIS   5 -19.456  -1.747  15.936
   32    HE2  HIS   5           2HE      HIS   5 -19.413   0.726  15.454
   33    H    HIS   6           H        HIS   6 -18.155  -1.605  11.816
   34    HA   HIS   6           HA       HIS   6 -16.810  -2.743   9.457
   35    HB2  HIS   6           2HB      HIS   6 -15.513  -1.511  11.897
   36    HB3  HIS   6           1HB      HIS   6 -14.646  -2.422  10.666
   37    HD1  HIS   6           1HD      HIS   6 -17.055   0.537  10.610
   38    HD2  HIS   6           2HD      HIS   6 -13.474  -0.733   8.927
   39    HE1  HIS   6           1HE      HIS   6 -16.325   2.407   9.095
   40    HE2  HIS   6           2HE      HIS   6 -14.112   1.650   8.153
   41    H    HIS   7           H        HIS   7 -16.911  -4.880   9.520
   42    HA   HIS   7           HA       HIS   7 -15.984  -6.434  11.665
   43    HB2  HIS   7           2HB      HIS   7 -18.199  -7.534  12.241
   44    HB3  HIS   7           1HB      HIS   7 -17.961  -5.908  12.873
   45    HD1  HIS   7           1HD      HIS   7 -19.787  -7.709  10.090
   46    HD2  HIS   7           2HD      HIS   7 -19.876  -4.097  12.143
   47    HE1  HIS   7           1HE      HIS   7 -21.879  -6.547   9.316
   48    HE2  HIS   7           2HE      HIS   7 -21.866  -4.327  10.507
   49    H    HIS   8           H        HIS   8 -18.182  -6.312   8.900
   50    HA   HIS   8           HA       HIS   8 -17.728  -9.078   8.222
   51    HB2  HIS   8           2HB      HIS   8 -19.780  -7.388   7.717
   52    HB3  HIS   8           1HB      HIS   8 -18.900  -7.263   6.198
   53    HD1  HIS   8           1HD      HIS   8 -20.224 -10.040   8.446
   54    HD2  HIS   8           2HD      HIS   8 -19.603  -9.179   4.429
   55    HE1  HIS   8           1HE      HIS   8 -21.154 -12.006   7.187
   56    HE2  HIS   8           2HE      HIS   8 -20.688 -11.504   4.762
   57    H    HIS   9           H        HIS   9 -17.435  -9.144   5.540
   58    HA   HIS   9           HA       HIS   9 -15.879  -9.132   3.882
   59    HB2  HIS   9           2HB      HIS   9 -15.712  -6.381   5.008
   60    HB3  HIS   9           1HB      HIS   9 -14.416  -6.892   3.932
   61    HD1  HIS   9           1HD      HIS   9 -15.489  -4.900   2.424
   62    HD2  HIS   9           2HD      HIS   9 -17.728  -8.378   2.807
   63    HE1  HIS   9           1HE      HIS   9 -17.167  -4.828   0.552
   64    HE2  HIS   9           2HE      HIS   9 -18.567  -6.901   0.857
   65    H    HIS  10           H        HIS  10 -14.338 -10.612   4.105
   66    HA   HIS  10           HA       HIS  10 -11.881  -9.918   5.468
   67    HB2  HIS  10           2HB      HIS  10 -13.686 -11.197   7.009
   68    HB3  HIS  10           1HB      HIS  10 -12.910 -12.585   6.256
   69    HD1  HIS  10           1HD      HIS  10 -12.440 -10.038   8.863
   70    HD2  HIS  10           2HD      HIS  10 -10.094 -12.797   6.827
   71    HE1  HIS  10           1HE      HIS  10 -10.318 -10.230  10.199
   72    HE2  HIS  10           2HE      HIS  10  -8.880 -11.842   8.901
   73    H    SER  11           H        SER  11 -13.428 -12.934   4.356
   74    HA   SER  11           HA       SER  11 -12.024 -13.115   1.933
   75    HB2  SER  11           2HB      SER  11 -10.067 -13.374   3.441
   76    HB3  SER  11           1HB      SER  11 -10.831 -14.797   4.150
   77    HG   SER  11           HG       SER  11 -10.299 -14.556   1.379
   78    H    SER  12           H        SER  12 -12.209 -15.308   0.945
   79    HA   SER  12           HA       SER  12 -13.479 -17.088   0.322
   80    HB2  SER  12           2HB      SER  12 -14.203 -17.407   3.237
   81    HB3  SER  12           1HB      SER  12 -14.116 -18.659   1.998
   82    HG   SER  12           HG       SER  12 -12.073 -17.414   3.428
   83    H    GLY  13           H        GLY  13 -15.775 -18.013   0.417
   84    HA2  GLY  13           2HA      GLY  13 -18.101 -17.604   0.905
   85    HA3  GLY  13           1HA      GLY  13 -17.725 -15.892   1.037
   86    H    LEU  14           H        LEU  14 -18.405 -14.703  -0.604
   87    HA   LEU  14           HA       LEU  14 -18.043 -15.560  -3.327
   88    HB2  LEU  14           2HB      LEU  14 -20.539 -15.110  -3.811
   89    HB3  LEU  14           1HB      LEU  14 -20.065 -16.673  -3.179
   90    HG   LEU  14           HG       LEU  14 -22.151 -15.670  -2.181
   91   HD11  LEU  14          1HD1      LEU  14 -21.806 -16.834  -0.287
   92   HD12  LEU  14          2HD1      LEU  14 -20.300 -15.992   0.086
   93   HD13  LEU  14          3HD1      LEU  14 -20.310 -17.301  -1.096
   94   HD21  LEU  14          3HD2      LEU  14 -21.403 -13.357  -2.044
   95   HD22  LEU  14          1HD2      LEU  14 -20.155 -13.816  -0.886
   96   HD23  LEU  14          2HD2      LEU  14 -21.858 -13.963  -0.452
   97    H    VAL  15           H        VAL  15 -16.963 -13.435  -1.931
   98    HA   VAL  15           HA       VAL  15 -18.385 -11.109  -3.051
   99    HB   VAL  15           HB       VAL  15 -16.999  -9.770  -1.406
  100   HG11  VAL  15          1HG1      VAL  15 -19.268 -11.555  -0.799
  101   HG12  VAL  15          2HG1      VAL  15 -19.137  -9.800  -0.674
  102   HG13  VAL  15          3HG1      VAL  15 -18.456 -10.828   0.588
  103   HG21  VAL  15          3HG2      VAL  15 -15.601 -12.049  -1.042
  104   HG22  VAL  15          1HG2      VAL  15 -16.721 -12.143   0.318
  105   HG23  VAL  15          2HG2      VAL  15 -15.669 -10.739   0.137
  106    HA   PRO  16           HA       PRO  16 -14.726 -11.627  -5.829
  107    HB2  PRO  16           2HB      PRO  16 -16.377  -9.573  -7.223
  108    HB3  PRO  16           1HB      PRO  16 -15.555 -10.993  -7.881
  109    HG2  PRO  16           2HG      PRO  16 -18.194 -10.994  -7.536
  110    HG3  PRO  16           1HG      PRO  16 -17.229 -12.444  -7.195
  111    HD2  PRO  16           2HD      PRO  16 -18.455 -10.492  -5.300
  112    HD3  PRO  16           1HD      PRO  16 -18.245 -12.247  -5.136
  113    H    ARG  17           H        ARG  17 -16.325  -8.725  -4.618
  114    HA   ARG  17           HA       ARG  17 -13.845  -7.196  -4.944
  115    HB2  ARG  17           2HB      ARG  17 -16.686  -6.380  -4.346
  116    HB3  ARG  17           1HB      ARG  17 -15.336  -5.261  -4.215
  117    HG2  ARG  17           2HG      ARG  17 -15.875  -4.783  -6.340
  118    HG3  ARG  17           1HG      ARG  17 -14.913  -6.219  -6.695
  119    HD2  ARG  17           2HD      ARG  17 -16.910  -7.585  -6.742
  120    HD3  ARG  17           1HD      ARG  17 -17.899  -6.203  -6.272
  121    HE   ARG  17           HE       ARG  17 -17.006  -6.848  -8.894
  122   HH11  ARG  17          1HH1      ARG  17 -17.723  -4.160  -6.788
  123   HH12  ARG  17          2HH1      ARG  17 -18.098  -3.079  -8.088
  124   HH21  ARG  17          1HH2      ARG  17 -17.498  -5.428 -10.605
  125   HH22  ARG  17          2HH2      ARG  17 -17.973  -3.800 -10.255
  126    H    GLY  18           H        GLY  18 -12.516  -6.905  -3.284
  127    HA2  GLY  18           2HA      GLY  18 -13.496  -7.553  -0.587
  128    HA3  GLY  18           1HA      GLY  18 -11.814  -7.582  -1.096
  129    H    SER  19           H        SER  19 -10.859  -5.444  -1.678
  130    HA   SER  19           HA       SER  19 -11.821  -3.417   0.220
  131    HB2  SER  19           2HB      SER  19  -9.369  -2.520  -0.412
  132    HB3  SER  19           1HB      SER  19  -9.644  -3.710   0.859
  133    HG   SER  19           HG       SER  19  -8.035  -4.077  -1.019
  134    H    HIS  20           H        HIS  20 -13.322  -2.321  -0.998
  135    HA   HIS  20           HA       HIS  20 -12.349  -1.069  -3.479
  136    HB2  HIS  20           2HB      HIS  20 -14.721  -0.780  -4.083
  137    HB3  HIS  20           1HB      HIS  20 -14.320  -2.473  -3.815
  138    HD1  HIS  20           1HD      HIS  20 -16.726   0.053  -2.891
  139    HD2  HIS  20           2HD      HIS  20 -15.172  -3.373  -1.123
  140    HE1  HIS  20           1HE      HIS  20 -18.347  -0.557  -1.065
  141    HE2  HIS  20           2HE      HIS  20 -17.341  -2.583   0.043
  142    H    MET  21           H        MET  21 -11.775  -0.116  -0.791
  143    HA   MET  21           HA       MET  21 -13.278   2.416  -0.788
  144    HB2  MET  21           2HB      MET  21 -11.745   1.100   1.463
  145    HB3  MET  21           1HB      MET  21 -12.586   2.640   1.571
  146    HG2  MET  21           2HG      MET  21 -14.176   1.300   2.461
  147    HG3  MET  21           1HG      MET  21 -14.628   1.174   0.762
  148    HE1  MET  21           3HE      MET  21 -15.300  -2.408   2.271
  149    HE2  MET  21           1HE      MET  21 -16.020  -0.869   1.798
  150    HE3  MET  21           2HE      MET  21 -15.210  -1.021   3.357
  151    H    SER  22           H        SER  22 -12.107   4.373  -0.362
  152    HA   SER  22           HA       SER  22  -9.387   4.260  -1.420
  153    HB2  SER  22           2HB      SER  22 -10.782   6.864  -1.056
  154    HB3  SER  22           1HB      SER  22  -9.702   6.341  -2.349
  155    HG   SER  22           HG       SER  22 -12.415   6.203  -2.191
  156    H    ASP  23           H        ASP  23 -10.661   4.123   1.465
  157    HA   ASP  23           HA       ASP  23  -8.994   6.094   2.780
  158    HB2  ASP  23           2HB      ASP  23 -10.898   4.088   3.953
  159    HB3  ASP  23           1HB      ASP  23 -10.108   5.388   4.845
  160    H    GLU  24           H        GLU  24  -8.847   2.951   1.839
  161    HA   GLU  24           HA       GLU  24  -7.268   1.809   3.860
  162    HB2  GLU  24           2HB      GLU  24  -7.479   1.087   0.949
  163    HB3  GLU  24           1HB      GLU  24  -6.664   0.099   2.155
  164    HG2  GLU  24           2HG      GLU  24  -8.973   0.221   3.375
  165    HG3  GLU  24           1HG      GLU  24  -9.572   0.598   1.761
  166    H    LYS  25           H        LYS  25  -6.593   4.056   1.544
  167    HA   LYS  25           HA       LYS  25  -3.726   3.564   1.482
  168    HB2  LYS  25           2HB      LYS  25  -4.802   4.183  -0.617
  169    HB3  LYS  25           1HB      LYS  25  -5.397   5.672   0.105
  170    HG2  LYS  25           2HG      LYS  25  -2.558   5.518   0.428
  171    HG3  LYS  25           1HG      LYS  25  -2.984   5.259  -1.264
  172    HD2  LYS  25           2HD      LYS  25  -4.084   7.336  -1.412
  173    HD3  LYS  25           1HD      LYS  25  -4.127   7.528   0.342
  174    HE2  LYS  25           2HE      LYS  25  -1.712   7.793   0.391
  175    HE3  LYS  25           1HE      LYS  25  -1.630   7.526  -1.350
  176    HZ1  LYS  25           3HZ      LYS  25  -1.665   9.929  -0.353
  177    HZ2  LYS  25           1HZ      LYS  25  -3.339   9.688  -0.352
  178    HZ3  LYS  25           2HZ      LYS  25  -2.469   9.582  -1.799
  179    H    THR  26           H        THR  26  -6.063   5.736   2.897
  180    HA   THR  26           HA       THR  26  -4.379   7.814   3.669
  181    HB   THR  26           HB       THR  26  -6.292   7.476   5.727
  182    HG1  THR  26           1HG      THR  26  -7.562   6.122   4.652
  183   HG21  THR  26          3HG2      THR  26  -7.400   9.195   3.856
  184   HG22  THR  26          1HG2      THR  26  -5.655   9.367   3.641
  185   HG23  THR  26          2HG2      THR  26  -6.383   9.631   5.230
  186    H    GLN  27           H        GLN  27  -4.739   4.620   4.966
  187    HA   GLN  27           HA       GLN  27  -3.595   5.064   7.509
  188    HB2  GLN  27           2HB      GLN  27  -4.798   2.970   6.702
  189    HB3  GLN  27           1HB      GLN  27  -3.306   2.542   5.875
  190    HG2  GLN  27           2HG      GLN  27  -2.408   3.060   8.390
  191    HG3  GLN  27           1HG      GLN  27  -4.005   2.381   8.707
  192   HE21  GLN  27          1HE2      GLN  27  -0.824   1.783   7.478
  193   HE22  GLN  27          2HE2      GLN  27  -0.966   0.066   7.354
  194    H    LEU  28           H        LEU  28  -2.310   4.911   4.325
  195    HA   LEU  28           HA       LEU  28   0.422   4.537   5.172
  196    HB2  LEU  28           2HB      LEU  28  -0.412   3.499   3.107
  197    HB3  LEU  28           1HB      LEU  28  -0.760   5.093   2.470
  198    HG   LEU  28           HG       LEU  28   1.374   3.856   1.685
  199   HD11  LEU  28          1HD1      LEU  28   2.326   6.473   2.435
  200   HD12  LEU  28          2HD1      LEU  28   0.655   6.532   1.871
  201   HD13  LEU  28          3HD1      LEU  28   1.909   5.836   0.844
  202   HD21  LEU  28          3HD2      LEU  28   3.360   4.426   3.085
  203   HD22  LEU  28          1HD2      LEU  28   2.295   3.209   3.788
  204   HD23  LEU  28          2HD2      LEU  28   2.252   4.868   4.383
  205    H    ILE  29           H        ILE  29  -1.692   7.011   4.856
  206    HA   ILE  29           HA       ILE  29  -0.094   9.114   3.934
  207    HB   ILE  29           HB       ILE  29  -2.491   9.170   5.714
  208   HG12  ILE  29          2HG1      ILE  29  -2.667   8.247   3.350
  209   HG13  ILE  29          1HG1      ILE  29  -3.792   9.524   3.795
  210   HG21  ILE  29          1HG2      ILE  29  -1.326  11.234   6.057
  211   HG22  ILE  29          2HG2      ILE  29  -2.712  11.562   5.017
  212   HG23  ILE  29          3HG2      ILE  29  -1.095  11.450   4.322
  213   HD11  ILE  29          3HD1      ILE  29  -2.095   9.418   1.592
  214   HD12  ILE  29          1HD1      ILE  29  -1.439  10.664   2.657
  215   HD13  ILE  29          2HD1      ILE  29  -3.120  10.755   2.114
  216    H    GLU  30           H        GLU  30  -0.065   7.465   6.710
  217    HA   GLU  30           HA       GLU  30   0.963   9.483   8.440
  218    HB2  GLU  30           2HB      GLU  30   1.159   6.531   8.951
  219    HB3  GLU  30           1HB      GLU  30   1.112   7.830  10.135
  220    HG2  GLU  30           2HG      GLU  30  -1.230   8.312   9.318
  221    HG3  GLU  30           1HG      GLU  30  -1.136   6.785   8.442
  222    H    ALA  31           H        ALA  31   2.263   8.143   5.909
  223    HA   ALA  31           HA       ALA  31   4.939   7.701   6.983
  224    HB1  ALA  31           1HB      ALA  31   3.673   6.341   5.085
  225    HB2  ALA  31           2HB      ALA  31   5.425   6.541   5.086
  226    HB3  ALA  31           3HB      ALA  31   4.421   7.570   4.064
  227    H    PHE  32           H        PHE  32   3.124  10.002   5.082
  228    HA   PHE  32           HA       PHE  32   5.232  11.458   3.960
  229    HB2  PHE  32           2HB      PHE  32   2.540  11.618   3.798
  230    HB3  PHE  32           1HB      PHE  32   2.858  12.989   4.854
  231    HD1  PHE  32           2HD      PHE  32   3.456  11.562   1.523
  232    HD2  PHE  32           1HD      PHE  32   3.918  14.963   4.039
  233    HE1  PHE  32           2HE      PHE  32   4.049  12.927  -0.436
  234    HE2  PHE  32           1HE      PHE  32   4.511  16.334   2.085
  235    HZ   PHE  32           HZ       PHE  32   4.578  15.315  -0.158
  236    H    TYR  33           H        TYR  33   3.878  11.472   7.177
  237    HA   TYR  33           HA       TYR  33   5.502  13.787   7.928
  238    HB2  TYR  33           2HB      TYR  33   3.468  12.251   9.559
  239    HB3  TYR  33           1HB      TYR  33   4.256  13.752  10.033
  240    HD1  TYR  33           1HD      TYR  33   2.075  12.326   7.364
  241    HD2  TYR  33           2HD      TYR  33   3.226  15.783   9.561
  242    HE1  TYR  33           1HE      TYR  33   0.268  13.602   6.292
  243    HE2  TYR  33           2HE      TYR  33   1.422  17.068   8.495
  244    HH   TYR  33           HH       TYR  33   0.037  17.013   6.524
  245    H    ASN  34           H        ASN  34   6.894  11.433   7.259
  246    HA   ASN  34           HA       ASN  34   8.628  11.187   9.449
  247    HB2  ASN  34           2HB      ASN  34   6.521   9.791  10.134
  248    HB3  ASN  34           1HB      ASN  34   7.181   8.595   9.023
  249   HD21  ASN  34          1HD2      ASN  34   8.592  10.811  11.411
  250   HD22  ASN  34          2HD2      ASN  34   9.478   9.595  12.264
  251    H    PHE  35           H        PHE  35   8.800  11.652   6.667
  252    HA   PHE  35           HA       PHE  35  10.976  10.016   5.987
  253    HB2  PHE  35           2HB      PHE  35   9.241   8.306   5.622
  254    HB3  PHE  35           1HB      PHE  35   8.429   9.376   4.485
  255    HD1  PHE  35           1HD      PHE  35  11.653   7.627   5.076
  256    HD2  PHE  35           2HD      PHE  35   8.974   9.314   2.231
  257    HE1  PHE  35           1HE      PHE  35  13.024   6.713   3.248
  258    HE2  PHE  35           2HE      PHE  35  10.339   8.403   0.399
  259    HZ   PHE  35           HZ       PHE  35  12.366   7.100   0.907
  260    H    ASP  36           H        ASP  36  11.589  12.280   5.755
  261    HA   ASP  36           HA       ASP  36  11.476  13.101   3.011
  262    HB2  ASP  36           2HB      ASP  36   9.949  14.605   5.114
  263    HB3  ASP  36           1HB      ASP  36  10.659  15.469   3.752
  264    H    GLY  37           H        GLY  37  13.744  12.549   3.683
  265    HA2  GLY  37           2HA      GLY  37  15.043  14.797   5.082
  266    HA3  GLY  37           1HA      GLY  37  15.721  13.184   4.918
  267    H    ASP  38           H        ASP  38  14.189  14.792   2.231
  268    HA   ASP  38           HA       ASP  38  14.977  15.507   0.222
  269    HB2  ASP  38           2HB      ASP  38  17.167  16.368   2.085
  270    HB3  ASP  38           1HB      ASP  38  17.349  16.590   0.347
  271    H    TYR  39           H        TYR  39  15.301  12.761   0.872
  272    HA   TYR  39           HA       TYR  39  17.902  11.862   0.107
  273    HB2  TYR  39           2HB      TYR  39  15.794  10.686   1.360
  274    HB3  TYR  39           1HB      TYR  39  15.632  10.008  -0.256
  275    HD1  TYR  39           1HD      TYR  39  18.260  10.602   2.335
  276    HD2  TYR  39           2HD      TYR  39  16.779   8.061  -0.738
  277    HE1  TYR  39           1HE      TYR  39  20.012   8.959   2.859
  278    HE2  TYR  39           2HE      TYR  39  18.527   6.410  -0.223
  279    HH   TYR  39           HH       TYR  39  20.340   6.464   2.580
  280    H    ASP  40           H        ASP  40  17.710   9.981  -1.744
  281    HA   ASP  40           HA       ASP  40  17.045  11.494  -4.162
  282    HB2  ASP  40           2HB      ASP  40  18.499   9.893  -5.331
  283    HB3  ASP  40           1HB      ASP  40  19.342  10.656  -3.985
  284    H    GLY  41           H        GLY  41  14.957  10.246  -2.619
  285    HA2  GLY  41           2HA      GLY  41  13.061   9.000  -2.970
  286    HA3  GLY  41           1HA      GLY  41  13.481   9.039  -4.675
  287    H    PHE  42           H        PHE  42  15.219   7.574  -1.949
  288    HA   PHE  42           HA       PHE  42  14.529   4.909  -2.866
  289    HB2  PHE  42           2HB      PHE  42  17.306   6.052  -3.042
  290    HB3  PHE  42           1HB      PHE  42  17.044   4.322  -2.850
  291    HD1  PHE  42           2HD      PHE  42  15.039   3.490  -4.542
  292    HD2  PHE  42           1HD      PHE  42  17.761   6.698  -5.182
  293    HE1  PHE  42           2HE      PHE  42  14.723   3.268  -6.972
  294    HE2  PHE  42           1HE      PHE  42  17.450   6.483  -7.614
  295    HZ   PHE  42           HZ       PHE  42  15.929   4.766  -8.511
  296    H    VAL  43           H        VAL  43  14.165   3.682  -1.149
  297    HA   VAL  43           HA       VAL  43  15.695   4.193   1.313
  298    HB   VAL  43           HB       VAL  43  13.471   5.186   1.586
  299   HG11  VAL  43          1HG1      VAL  43  12.279   3.741  -0.011
  300   HG12  VAL  43          2HG1      VAL  43  11.460   3.839   1.548
  301   HG13  VAL  43          3HG1      VAL  43  12.399   2.404   1.133
  302   HG21  VAL  43          3HG2      VAL  43  14.633   4.143   3.507
  303   HG22  VAL  43          1HG2      VAL  43  13.737   2.654   3.204
  304   HG23  VAL  43          2HG2      VAL  43  12.877   4.123   3.667
  305    H    SER  44           H        SER  44  16.611   2.426   2.137
  306    HA   SER  44           HA       SER  44  16.171  -0.128   0.890
  307    HB2  SER  44           2HB      SER  44  17.875  -0.831   2.735
  308    HB3  SER  44           1HB      SER  44  18.419   0.210   1.418
  309    HG   SER  44           HG       SER  44  18.451   1.919   2.761
  310    H    VAL  45           H        VAL  45  15.807  -2.105   2.175
  311    HA   VAL  45           HA       VAL  45  13.416  -1.939   3.658
  312    HB   VAL  45           HB       VAL  45  15.370  -4.243   3.575
  313   HG11  VAL  45          1HG1      VAL  45  13.615  -5.630   4.285
  314   HG12  VAL  45          2HG1      VAL  45  12.403  -4.381   4.007
  315   HG13  VAL  45          3HG1      VAL  45  13.542  -4.223   5.345
  316   HG21  VAL  45          3HG2      VAL  45  14.344  -5.033   1.643
  317   HG22  VAL  45          1HG2      VAL  45  14.487  -3.301   1.349
  318   HG23  VAL  45          2HG2      VAL  45  12.939  -3.985   1.845
  319    H    GLU  46           H        GLU  46  16.716  -2.791   4.694
  320    HA   GLU  46           HA       GLU  46  16.325  -3.152   7.375
  321    HB2  GLU  46           2HB      GLU  46  18.689  -1.630   6.288
  322    HB3  GLU  46           1HB      GLU  46  18.637  -2.683   7.695
  323    HG2  GLU  46           2HG      GLU  46  18.069  -4.553   6.055
  324    HG3  GLU  46           1HG      GLU  46  18.585  -3.432   4.794
  325    H    GLU  47           H        GLU  47  16.310  -0.151   5.607
  326    HA   GLU  47           HA       GLU  47  16.238   1.425   8.063
  327    HB2  GLU  47           2HB      GLU  47  15.993   2.473   5.247
  328    HB3  GLU  47           1HB      GLU  47  16.483   3.349   6.690
  329    HG2  GLU  47           2HG      GLU  47  18.068   1.106   5.468
  330    HG3  GLU  47           1HG      GLU  47  18.332   2.812   5.118
  331    H    PHE  48           H        PHE  48  14.169   0.278   5.506
  332    HA   PHE  48           HA       PHE  48  11.971   1.995   5.947
  333    HB2  PHE  48           2HB      PHE  48  12.607  -0.012   4.145
  334    HB3  PHE  48           1HB      PHE  48  11.249  -0.686   5.041
  335    HD1  PHE  48           1HD      PHE  48   9.761   1.862   5.592
  336    HD2  PHE  48           2HD      PHE  48  11.633   0.391   2.063
  337    HE1  PHE  48           1HE      PHE  48   8.204   3.185   4.219
  338    HE2  PHE  48           2HE      PHE  48  10.078   1.711   0.686
  339    HZ   PHE  48           HZ       PHE  48   8.362   3.110   1.763
  340    H    ARG  49           H        ARG  49  12.906  -1.109   7.334
  341    HA   ARG  49           HA       ARG  49  10.568  -1.775   8.667
  342    HB2  ARG  49           2HB      ARG  49  13.388  -2.209   9.665
  343    HB3  ARG  49           1HB      ARG  49  11.960  -3.109  10.157
  344    HG2  ARG  49           2HG      ARG  49  11.940  -4.377   8.290
  345    HG3  ARG  49           1HG      ARG  49  12.556  -3.077   7.267
  346    HD2  ARG  49           2HD      ARG  49  14.402  -4.401   7.289
  347    HD3  ARG  49           1HD      ARG  49  14.727  -3.467   8.750
  348    HE   ARG  49           HE       ARG  49  14.413  -5.364   9.996
  349   HH11  ARG  49          1HH1      ARG  49  13.191  -5.909   6.773
  350   HH12  ARG  49          2HH1      ARG  49  12.935  -7.603   7.023
  351   HH21  ARG  49          1HH2      ARG  49  14.078  -7.591  10.325
  352   HH22  ARG  49          2HH2      ARG  49  13.438  -8.559   9.039
  353    H    GLY  50           H        GLY  50  13.312   0.143   9.897
  354    HA2  GLY  50           2HA      GLY  50  12.274   0.692  12.429
  355    HA3  GLY  50           1HA      GLY  50  13.422   1.711  11.573
  356    H    ILE  51           H        ILE  51  11.333   1.946   9.357
  357    HA   ILE  51           HA       ILE  51   9.963   4.233  10.541
  358    HB   ILE  51           HB       ILE  51   9.936   3.408   7.643
  359   HG12  ILE  51          2HG1      ILE  51  11.833   5.364   8.944
  360   HG13  ILE  51          1HG1      ILE  51  12.265   3.703   8.554
  361   HG21  ILE  51          1HG2      ILE  51   9.264   5.634   7.196
  362   HG22  ILE  51          2HG2      ILE  51   9.608   6.144   8.847
  363   HG23  ILE  51          3HG2      ILE  51   8.252   5.065   8.523
  364   HD11  ILE  51          3HD1      ILE  51  11.828   6.023   6.759
  365   HD12  ILE  51          1HD1      ILE  51  11.435   4.411   6.160
  366   HD13  ILE  51          2HD1      ILE  51  13.070   4.770   6.718
  367    H    ILE  52           H        ILE  52   9.311   1.045   9.355
  368    HA   ILE  52           HA       ILE  52   6.434   1.520   9.244
  369    HB   ILE  52           HB       ILE  52   8.022  -0.983   8.658
  370   HG12  ILE  52          2HG1      ILE  52   8.397   0.887   7.071
  371   HG13  ILE  52          1HG1      ILE  52   7.587  -0.486   6.319
  372   HG21  ILE  52          1HG2      ILE  52   5.837  -1.633   9.346
  373   HG22  ILE  52          2HG2      ILE  52   5.890  -1.742   7.587
  374   HG23  ILE  52          3HG2      ILE  52   5.089  -0.375   8.362
  375   HD11  ILE  52          3HD1      ILE  52   6.089   0.958   5.564
  376   HD12  ILE  52          1HD1      ILE  52   6.721   2.249   6.586
  377   HD13  ILE  52          2HD1      ILE  52   5.522   1.125   7.226
  378    H    ARG  53           H        ARG  53   8.724  -0.603  10.952
  379    HA   ARG  53           HA       ARG  53   7.043  -2.019  12.567
  380    HB2  ARG  53           2HB      ARG  53   9.476  -2.336  12.498
  381    HB3  ARG  53           1HB      ARG  53   9.700  -0.827  13.371
  382    HG2  ARG  53           2HG      ARG  53   8.793  -1.709  15.349
  383    HG3  ARG  53           1HG      ARG  53   8.110  -3.101  14.509
  384    HD2  ARG  53           2HD      ARG  53   9.949  -4.106  15.383
  385    HD3  ARG  53           1HD      ARG  53  10.672  -3.486  13.898
  386    HE   ARG  53           HE       ARG  53  10.859  -1.610  16.036
  387   HH11  ARG  53          1HH1      ARG  53  12.297  -4.511  14.729
  388   HH12  ARG  53          2HH1      ARG  53  13.850  -4.205  15.430
  389   HH21  ARG  53          1HH2      ARG  53  12.903  -1.207  16.956
  390   HH22  ARG  53          2HH2      ARG  53  14.196  -2.330  16.694
  391    H    ASP  54           H        ASP  54   8.712   0.886  13.789
  392    HA   ASP  54           HA       ASP  54   6.585   1.234  15.752
  393    HB2  ASP  54           2HB      ASP  54   9.046   1.346  16.346
  394    HB3  ASP  54           1HB      ASP  54   9.103   2.875  15.474
  395    H    GLY  55           H        GLY  55   6.539   1.991  12.717
  396    HA2  GLY  55           2HA      GLY  55   5.579   4.749  13.168
  397    HA3  GLY  55           1HA      GLY  55   6.370   4.246  11.685
  398    H    LEU  56           H        LEU  56   5.242   2.972  10.190
  399    HA   LEU  56           HA       LEU  56   2.399   3.410  10.222
  400    HB2  LEU  56           2HB      LEU  56   4.394   2.418   8.254
  401    HB3  LEU  56           1HB      LEU  56   2.720   1.955   8.014
  402    HG   LEU  56           HG       LEU  56   3.398   3.976   6.736
  403   HD11  LEU  56          1HD1      LEU  56   1.415   5.244   7.219
  404   HD12  LEU  56          2HD1      LEU  56   1.298   4.529   8.827
  405   HD13  LEU  56          3HD1      LEU  56   1.051   3.528   7.395
  406   HD21  LEU  56          3HD2      LEU  56   3.607   5.230   9.473
  407   HD22  LEU  56          1HD2      LEU  56   3.699   6.083   7.932
  408   HD23  LEU  56          2HD2      LEU  56   4.948   4.918   8.370
  409    HA   PRO  57           HA       PRO  57   1.436  -0.590  11.932
  410    HB2  PRO  57           2HB      PRO  57  -1.236  -0.523  11.625
  411    HB3  PRO  57           1HB      PRO  57  -0.410   0.478  12.825
  412    HG2  PRO  57           2HG      PRO  57  -1.432   1.226  10.113
  413    HG3  PRO  57           1HG      PRO  57  -1.546   2.124  11.639
  414    HD2  PRO  57           2HD      PRO  57   0.312   2.662   9.710
  415    HD3  PRO  57           1HD      PRO  57   0.573   2.980  11.437
  416    H    MET  58           H        MET  58   2.020  -2.312  10.776
  417    HA   MET  58           HA       MET  58   0.272  -3.272   8.690
  418    HB2  MET  58           2HB      MET  58   2.594  -1.807   7.992
  419    HB3  MET  58           1HB      MET  58   2.931  -3.493   7.628
  420    HG2  MET  58           2HG      MET  58   1.113  -3.638   6.141
  421    HG3  MET  58           1HG      MET  58   0.431  -2.116   6.706
  422    HE1  MET  58           3HE      MET  58   3.451  -3.792   4.882
  423    HE2  MET  58           1HE      MET  58   3.537  -2.749   3.463
  424    HE3  MET  58           2HE      MET  58   2.072  -3.674   3.790
  425    H    THR  59           H        THR  59   0.265  -5.454   8.570
  426    HA   THR  59           HA       THR  59   1.636  -6.923  10.610
  427    HB   THR  59           HB       THR  59   0.578  -8.863   9.046
  428    HG1  THR  59           1HG      THR  59  -1.217  -8.113   8.019
  429   HG21  THR  59          3HG2      THR  59   0.012  -8.232  11.443
  430   HG22  THR  59          1HG2      THR  59  -1.268  -8.952  10.466
  431   HG23  THR  59          2HG2      THR  59  -1.247  -7.211  10.749
  432    H    GLU  60           H        GLU  60   3.236  -8.471  10.396
  433    HA   GLU  60           HA       GLU  60   5.421  -8.084   8.877
  434    HB2  GLU  60           2HB      GLU  60   5.668 -10.700   8.974
  435    HB3  GLU  60           1HB      GLU  60   5.744  -9.741  10.445
  436    HG2  GLU  60           2HG      GLU  60   3.457 -10.296  10.971
  437    HG3  GLU  60           1HG      GLU  60   3.276 -11.145   9.436
  438    H    ALA  61           H        ALA  61   2.734 -10.169   7.952
  439    HA   ALA  61           HA       ALA  61   3.610 -11.148   5.553
  440    HB1  ALA  61           1HB      ALA  61   1.539 -11.966   5.412
  441    HB2  ALA  61           2HB      ALA  61   0.813 -10.357   5.449
  442    HB3  ALA  61           3HB      ALA  61   1.244 -11.168   6.957
  443    H    GLU  62           H        GLU  62   1.695  -8.167   6.016
  444    HA   GLU  62           HA       GLU  62   1.704  -7.291   3.385
  445    HB2  GLU  62           2HB      GLU  62   2.098  -5.165   5.404
  446    HB3  GLU  62           1HB      GLU  62   0.871  -5.315   4.157
  447    HG2  GLU  62           2HG      GLU  62  -0.018  -7.228   5.711
  448    HG3  GLU  62           1HG      GLU  62   0.899  -6.354   6.936
  449    H    ILE  63           H        ILE  63   3.910  -6.164   5.939
  450    HA   ILE  63           HA       ILE  63   5.707  -4.813   4.271
  451    HB   ILE  63           HB       ILE  63   6.608  -6.230   6.768
  452   HG12  ILE  63          2HG1      ILE  63   5.838  -3.736   7.620
  453   HG13  ILE  63          1HG1      ILE  63   4.546  -4.159   6.500
  454   HG21  ILE  63          1HG2      ILE  63   8.022  -4.730   5.088
  455   HG22  ILE  63          2HG2      ILE  63   8.305  -4.720   6.829
  456   HG23  ILE  63          3HG2      ILE  63   7.347  -3.441   6.084
  457   HD11  ILE  63          3HD1      ILE  63   5.131  -5.184   9.148
  458   HD12  ILE  63          1HD1      ILE  63   4.875  -6.456   7.952
  459   HD13  ILE  63          2HD1      ILE  63   3.638  -5.229   8.212
  460    H    THR  64           H        THR  64   6.238  -7.980   5.802
  461    HA   THR  64           HA       THR  64   8.536  -8.727   4.497
  462    HB   THR  64           HB       THR  64   6.223 -10.456   5.352
  463    HG1  THR  64           1HG      THR  64   7.068  -9.359   7.085
  464   HG21  THR  64          3HG2      THR  64   9.054 -11.230   4.722
  465   HG22  THR  64          1HG2      THR  64   7.581 -11.797   3.935
  466   HG23  THR  64          2HG2      THR  64   7.916 -12.246   5.608
  467    H    GLU  65           H        GLU  65   5.196  -9.514   3.500
  468    HA   GLU  65           HA       GLU  65   5.989 -10.758   1.097
  469    HB2  GLU  65           2HB      GLU  65   3.338  -9.491   1.748
  470    HB3  GLU  65           1HB      GLU  65   3.637 -10.590   0.410
  471    HG2  GLU  65           2HG      GLU  65   4.418 -11.654   3.017
  472    HG3  GLU  65           1HG      GLU  65   2.697 -11.311   2.861
  473    H    PHE  66           H        PHE  66   5.867  -7.611   2.027
  474    HA   PHE  66           HA       PHE  66   5.679  -6.566  -0.671
  475    HB2  PHE  66           2HB      PHE  66   5.557  -5.324   2.045
  476    HB3  PHE  66           1HB      PHE  66   6.037  -4.326   0.680
  477    HD1  PHE  66           2HD      PHE  66   3.631  -7.070   0.312
  478    HD2  PHE  66           1HD      PHE  66   4.132  -2.877   0.847
  479    HE1  PHE  66           2HE      PHE  66   1.266  -6.717  -0.267
  480    HE2  PHE  66           1HE      PHE  66   1.768  -2.518   0.271
  481    HZ   PHE  66           HZ       PHE  66   0.332  -4.438  -0.288
  482    H    PHE  67           H        PHE  67   7.974  -7.246   1.826
  483    HA   PHE  67           HA       PHE  67  10.087  -5.623   0.734
  484    HB2  PHE  67           2HB      PHE  67   9.882  -7.668   2.916
  485    HB3  PHE  67           1HB      PHE  67  11.464  -7.162   2.344
  486    HD1  PHE  67           1HD      PHE  67  10.023  -4.238   1.820
  487    HD2  PHE  67           2HD      PHE  67  10.713  -6.838   5.124
  488    HE1  PHE  67           1HE      PHE  67   9.938  -2.317   3.349
  489    HE2  PHE  67           2HE      PHE  67  10.630  -4.914   6.655
  490    HZ   PHE  67           HZ       PHE  67  10.242  -2.651   5.767
  491    H    GLU  68           H        GLU  68   8.896  -8.847   0.275
  492    HA   GLU  68           HA       GLU  68  11.297  -9.685  -1.146
  493    HB2  GLU  68           2HB      GLU  68   8.720 -11.216  -0.786
  494    HB3  GLU  68           1HB      GLU  68  10.285 -11.861  -1.262
  495    HG2  GLU  68           2HG      GLU  68  10.100 -10.469   1.348
  496    HG3  GLU  68           1HG      GLU  68   9.367 -12.066   1.206
  497    H    ALA  69           H        ALA  69   8.057  -8.575  -1.774
  498    HA   ALA  69           HA       ALA  69   8.186  -9.278  -4.574
  499    HB1  ALA  69           1HB      ALA  69   5.938  -8.401  -4.725
  500    HB2  ALA  69           2HB      ALA  69   6.083  -7.731  -3.100
  501    HB3  ALA  69           3HB      ALA  69   6.070  -9.479  -3.334
  502    H    ALA  70           H        ALA  70   9.176  -6.809  -2.678
  503    HA   ALA  70           HA       ALA  70   8.928  -4.718  -4.693
  504    HB1  ALA  70           1HB      ALA  70   8.467  -3.908  -2.539
  505    HB2  ALA  70           2HB      ALA  70  10.091  -3.326  -2.901
  506    HB3  ALA  70           3HB      ALA  70   9.869  -4.716  -1.839
  507    H    ASP  71           H        ASP  71  11.302  -6.873  -3.337
  508    HA   ASP  71           HA       ASP  71  13.308  -5.745  -5.173
  509    HB2  ASP  71           2HB      ASP  71  13.783  -5.274  -2.746
  510    HB3  ASP  71           1HB      ASP  71  13.925  -7.012  -2.499
  511    HA   PRO  72           HA       PRO  72  13.024  -9.930  -6.785
  512    HB2  PRO  72           2HB      PRO  72  14.989  -9.651  -8.660
  513    HB3  PRO  72           1HB      PRO  72  13.337  -9.070  -8.888
  514    HG2  PRO  72           2HG      PRO  72  15.779  -7.554  -8.057
  515    HG3  PRO  72           1HG      PRO  72  14.505  -7.086  -9.198
  516    HD2  PRO  72           2HD      PRO  72  14.577  -6.142  -6.676
  517    HD3  PRO  72           1HD      PRO  72  13.046  -6.471  -7.514
  518    H    ASN  73           H        ASN  73  16.142  -8.381  -6.087
  519    HA   ASN  73           HA       ASN  73  17.519 -10.877  -5.766
  520    HB2  ASN  73           2HB      ASN  73  18.374  -8.108  -4.903
  521    HB3  ASN  73           1HB      ASN  73  19.415  -9.518  -5.068
  522   HD21  ASN  73          1HD2      ASN  73  20.362  -7.572  -6.398
  523   HD22  ASN  73          2HD2      ASN  73  20.006  -7.635  -8.087
  524    H    ASN  74           H        ASN  74  15.858  -8.630  -3.682
  525    HA   ASN  74           HA       ASN  74  15.130  -8.822  -1.535
  526    HB2  ASN  74           2HB      ASN  74  16.424 -11.543  -1.385
  527    HB3  ASN  74           1HB      ASN  74  15.085 -10.922  -0.425
  528   HD21  ASN  74          1HD2      ASN  74  13.033 -10.946  -1.253
  529   HD22  ASN  74          2HD2      ASN  74  12.615 -11.760  -2.719
  530    H    THR  75           H        THR  75  17.540  -7.586  -2.195
  531    HA   THR  75           HA       THR  75  19.458  -8.345  -0.156
  532    HB   THR  75           HB       THR  75  20.483  -7.745  -2.192
  533    HG1  THR  75           1HG      THR  75  21.797  -6.155  -1.543
  534   HG21  THR  75          3HG2      THR  75  18.596  -5.433  -2.236
  535   HG22  THR  75          1HG2      THR  75  18.926  -6.635  -3.483
  536   HG23  THR  75          2HG2      THR  75  20.118  -5.382  -3.129
  537    H    GLY  76           H        GLY  76  17.018  -7.561   0.913
  538    HA2  GLY  76           2HA      GLY  76  16.029  -6.098   2.378
  539    HA3  GLY  76           1HA      GLY  76  17.678  -5.828   2.928
  540    H    PHE  77           H        PHE  77  16.713  -5.028  -0.317
  541    HA   PHE  77           HA       PHE  77  16.640  -2.178   0.408
  542    HB2  PHE  77           2HB      PHE  77  18.678  -2.091  -0.596
  543    HB3  PHE  77           1HB      PHE  77  18.429  -3.599  -1.463
  544    HD1  PHE  77           1HD      PHE  77  17.278  -0.053  -1.476
  545    HD2  PHE  77           2HD      PHE  77  18.187  -3.536  -3.745
  546    HE1  PHE  77           1HE      PHE  77  16.910   1.211  -3.555
  547    HE2  PHE  77           2HE      PHE  77  17.822  -2.278  -5.828
  548    HZ   PHE  77           HZ       PHE  77  17.182   0.098  -5.735
  549    H    ILE  78           H        ILE  78  14.945  -1.095  -0.373
  550    HA   ILE  78           HA       ILE  78  13.182  -2.478  -2.272
  551    HB   ILE  78           HB       ILE  78  12.636  -0.174  -0.393
  552   HG12  ILE  78          2HG1      ILE  78  11.601  -3.011  -0.436
  553   HG13  ILE  78          1HG1      ILE  78  12.758  -2.350   0.720
  554   HG21  ILE  78          1HG2      ILE  78  10.782  -1.517  -2.356
  555   HG22  ILE  78          2HG2      ILE  78  11.346   0.154  -2.412
  556   HG23  ILE  78          3HG2      ILE  78  10.282  -0.376  -1.110
  557   HD11  ILE  78          3HD1      ILE  78  11.129  -1.537   1.985
  558   HD12  ILE  78          1HD1      ILE  78  10.001  -2.444   0.978
  559   HD13  ILE  78          2HD1      ILE  78  10.356  -0.755   0.602
  560    H    ASP  79           H        ASP  79  12.212  -1.349  -3.982
  561    HA   ASP  79           HA       ASP  79  13.829   0.872  -5.014
  562    HB2  ASP  79           2HB      ASP  79  12.997  -1.416  -6.280
  563    HB3  ASP  79           1HB      ASP  79  11.728  -0.283  -6.742
  564    H    TYR  80           H        TYR  80  12.983   2.599  -3.941
  565    HA   TYR  80           HA       TYR  80  10.669   3.252  -2.915
  566    HB2  TYR  80           2HB      TYR  80  12.577   4.825  -3.231
  567    HB3  TYR  80           1HB      TYR  80  12.013   5.125  -4.872
  568    HD1  TYR  80           2HD      TYR  80  10.754   5.210  -1.353
  569    HD2  TYR  80           1HD      TYR  80  10.627   6.937  -5.240
  570    HE1  TYR  80           2HE      TYR  80   9.270   6.980  -0.513
  571    HE2  TYR  80           1HE      TYR  80   9.143   8.712  -4.410
  572    HH   TYR  80           HH       TYR  80   7.575   9.094  -2.574
  573    H    LYS  81           H        LYS  81  11.141   3.212  -6.432
  574    HA   LYS  81           HA       LYS  81   8.570   4.193  -7.081
  575    HB2  LYS  81           2HB      LYS  81  10.578   2.564  -8.631
  576    HB3  LYS  81           1HB      LYS  81   9.045   3.072  -9.326
  577    HG2  LYS  81           2HG      LYS  81  10.506   5.262  -8.088
  578    HG3  LYS  81           1HG      LYS  81  11.401   4.480  -9.393
  579    HD2  LYS  81           2HD      LYS  81  10.181   6.128 -10.495
  580    HD3  LYS  81           1HD      LYS  81   9.198   4.681 -10.721
  581    HE2  LYS  81           2HE      LYS  81   7.920   6.734 -10.067
  582    HE3  LYS  81           1HE      LYS  81   7.683   5.343  -9.012
  583    HZ1  LYS  81           3HZ      LYS  81   9.819   7.152  -8.247
  584    HZ2  LYS  81           1HZ      LYS  81   8.660   6.376  -7.289
  585    HZ3  LYS  81           2HZ      LYS  81   8.256   7.787  -8.130
  586    H    ALA  82           H        ALA  82   9.852   0.861  -7.137
  587    HA   ALA  82           HA       ALA  82   7.502  -0.471  -7.752
  588    HB1  ALA  82           1HB      ALA  82   9.171  -1.830  -5.752
  589    HB2  ALA  82           2HB      ALA  82  10.042  -1.246  -7.172
  590    HB3  ALA  82           3HB      ALA  82   8.679  -2.349  -7.365
  591    H    PHE  83           H        PHE  83   8.499   1.024  -4.792
  592    HA   PHE  83           HA       PHE  83   6.376  -0.221  -3.242
  593    HB2  PHE  83           2HB      PHE  83   8.899   0.921  -2.646
  594    HB3  PHE  83           1HB      PHE  83   7.687   1.917  -1.844
  595    HD1  PHE  83           1HD      PHE  83   8.331  -1.710  -2.430
  596    HD2  PHE  83           2HD      PHE  83   7.197   1.334   0.316
  597    HE1  PHE  83           1HE      PHE  83   8.151  -3.393  -0.650
  598    HE2  PHE  83           2HE      PHE  83   7.014  -0.345   2.107
  599    HZ   PHE  83           HZ       PHE  83   7.492  -2.712   1.625
  600    H    ALA  84           H        ALA  84   7.158   2.822  -4.779
  601    HA   ALA  84           HA       ALA  84   4.999   4.279  -3.568
  602    HB1  ALA  84           1HB      ALA  84   6.584   5.028  -6.018
  603    HB2  ALA  84           2HB      ALA  84   7.117   5.329  -4.364
  604    HB3  ALA  84           3HB      ALA  84   5.652   6.101  -4.972
  605    H    ALA  85           H        ALA  85   5.453   2.365  -6.442
  606    HA   ALA  85           HA       ALA  85   3.147   3.315  -7.807
  607    HB1  ALA  85           1HB      ALA  85   4.647   0.753  -8.235
  608    HB2  ALA  85           2HB      ALA  85   5.060   2.299  -8.977
  609    HB3  ALA  85           3HB      ALA  85   3.530   1.512  -9.371
  610    H    MET  86           H        MET  86   3.553   1.368  -5.212
  611    HA   MET  86           HA       MET  86   1.460  -0.517  -5.569
  612    HB2  MET  86           2HB      MET  86   3.398  -0.665  -3.921
  613    HB3  MET  86           1HB      MET  86   2.500   0.463  -2.916
  614    HG2  MET  86           2HG      MET  86   1.264  -2.091  -3.864
  615    HG3  MET  86           1HG      MET  86   2.294  -2.044  -2.436
  616    HE1  MET  86           3HE      MET  86   0.707  -0.822   0.257
  617    HE2  MET  86           1HE      MET  86   0.862   0.759  -0.508
  618    HE3  MET  86           2HE      MET  86   2.128  -0.451  -0.718
  619    H    LEU  87           H        LEU  87   1.639   2.719  -4.225
  620    HA   LEU  87           HA       LEU  87  -1.189   2.621  -3.542
  621    HB2  LEU  87           2HB      LEU  87   0.917   4.651  -2.914
  622    HB3  LEU  87           1HB      LEU  87  -0.756   4.783  -2.405
  623    HG   LEU  87           HG       LEU  87   0.005   2.300  -1.439
  624   HD11  LEU  87          1HD1      LEU  87   2.140   2.280  -0.733
  625   HD12  LEU  87          2HD1      LEU  87   2.162   4.014  -0.408
  626   HD13  LEU  87          3HD1      LEU  87   2.380   3.422  -2.056
  627   HD21  LEU  87          3HD2      LEU  87   0.164   4.878   0.107
  628   HD22  LEU  87          1HD2      LEU  87  -0.265   3.274   0.704
  629   HD23  LEU  87          2HD2      LEU  87  -1.360   4.134  -0.380
  630    H    TYR  88           H        TYR  88   0.695   3.438  -5.970
  631    HA   TYR  88           HA       TYR  88  -1.242   5.354  -7.076
  632    HB2  TYR  88           2HB      TYR  88   1.743   5.345  -7.572
  633    HB3  TYR  88           1HB      TYR  88   0.583   6.455  -8.291
  634    HD1  TYR  88           1HD      TYR  88  -1.093   7.233  -6.048
  635    HD2  TYR  88           2HD      TYR  88   3.111   6.594  -6.181
  636    HE1  TYR  88           1HE      TYR  88  -0.807   8.766  -4.147
  637    HE2  TYR  88           2HE      TYR  88   3.409   8.126  -4.280
  638    HH   TYR  88           HH       TYR  88   0.920   9.118  -2.309
  639    H    SER  89           H        SER  89  -0.886   2.368  -7.287
  640    HA   SER  89           HA       SER  89   0.029   1.733  -9.882
  641    HB2  SER  89           2HB      SER  89  -0.555   0.214  -7.787
  642    HB3  SER  89           1HB      SER  89  -2.117   0.099  -8.597
  643    HG   SER  89           HG       SER  89  -0.390  -1.502  -9.142
  644    H    VAL  90           H        VAL  90  -0.959   3.457 -11.122
  645    HA   VAL  90           HA       VAL  90  -3.592   2.663 -12.113
  646    HB   VAL  90           HB       VAL  90  -2.982   5.556 -11.518
  647   HG11  VAL  90          1HG1      VAL  90  -4.940   6.044 -12.485
  648   HG12  VAL  90          2HG1      VAL  90  -5.756   4.670 -11.741
  649   HG13  VAL  90          3HG1      VAL  90  -4.818   4.445 -13.217
  650   HG21  VAL  90          3HG2      VAL  90  -3.136   4.678  -9.371
  651   HG22  VAL  90          1HG2      VAL  90  -4.338   3.477  -9.841
  652   HG23  VAL  90          2HG2      VAL  90  -4.793   5.177  -9.715
  653    H    ASP  91           H        ASP  91  -0.974   2.329 -13.208
  654    HA   ASP  91           HA       ASP  91  -1.190   4.060 -15.583
  655    HB2  ASP  91           2HB      ASP  91   1.229   3.179 -14.045
  656    HB3  ASP  91           1HB      ASP  91   1.364   3.520 -15.767
  657    H    GLU  92           H        GLU  92   0.153   2.988 -17.455
  658    HA   GLU  92           HA       GLU  92   0.377   1.292 -18.956
  659    HB2  GLU  92           2HB      GLU  92   1.144   0.145 -16.622
  660    HB3  GLU  92           1HB      GLU  92  -0.215  -0.885 -17.048
  661    HG2  GLU  92           2HG      GLU  92   0.830  -1.263 -19.261
  662    HG3  GLU  92           1HG      GLU  92   2.227  -0.337 -18.716
  663    H    SER  93           H        SER  93  -1.987  -0.070 -16.659
  664    HA   SER  93           HA       SER  93  -4.131  -0.781 -16.927
  665    HB2  SER  93           2HB      SER  93  -4.147   1.740 -17.831
  666    HB3  SER  93           1HB      SER  93  -4.577   0.916 -19.330
  667    HG   SER  93           HG       SER  93  -6.311  -0.057 -18.211
  Start of MODEL    9
    1    H1   MET   1           1HT      MET   1 -27.438 -21.127   9.175
    2    H2   MET   1           2HT      MET   1 -28.516 -21.563  10.438
    3    H3   MET   1           3HT      MET   1 -27.751 -22.780   9.502
    4    HA   MET   1           HA       MET   1 -26.249 -20.835  11.100
    5    HB2  MET   1           2HB      MET   1 -27.891 -22.072  12.503
    6    HB3  MET   1           1HB      MET   1 -27.206 -23.585  11.927
    7    HG2  MET   1           2HG      MET   1 -25.394 -23.431  13.253
    8    HG3  MET   1           1HG      MET   1 -25.297 -21.677  13.101
    9    HE1  MET   1           2HE      MET   1 -28.915 -23.039  14.337
   10    HE2  MET   1           3HE      MET   1 -28.310 -23.860  15.776
   11    HE3  MET   1           1HE      MET   1 -27.746 -24.349  14.177
   12    H    GLY   2           H        GLY   2 -25.683 -21.787   8.481
   13    HA2  GLY   2           2HA      GLY   2 -23.125 -23.034   9.008
   14    HA3  GLY   2           1HA      GLY   2 -24.239 -24.033   8.085
   15    H    SER   3           H        SER   3 -22.135 -21.293   8.042
   16    HA   SER   3           HA       SER   3 -22.911 -20.470   5.377
   17    HB2  SER   3           2HB      SER   3 -20.685 -19.556   7.212
   18    HB3  SER   3           1HB      SER   3 -21.002 -18.860   5.622
   19    HG   SER   3           HG       SER   3 -22.744 -17.893   6.375
   20    H    SER   4           H        SER   4 -19.756 -21.404   6.757
   21    HA   SER   4           HA       SER   4 -18.005 -22.570   5.896
   22    HB2  SER   4           2HB      SER   4 -20.056 -24.223   5.612
   23    HB3  SER   4           1HB      SER   4 -19.763 -23.931   3.897
   24    HG   SER   4           HG       SER   4 -17.712 -24.743   4.118
   25    H    HIS   5           H        HIS   5 -17.115 -20.658   4.985
   26    HA   HIS   5           HA       HIS   5 -17.290 -20.586   2.044
   27    HB2  HIS   5           2HB      HIS   5 -17.405 -18.353   4.030
   28    HB3  HIS   5           1HB      HIS   5 -16.633 -18.060   2.475
   29    HD1  HIS   5           1HD      HIS   5 -19.264 -16.638   3.323
   30    HD2  HIS   5           2HD      HIS   5 -19.067 -20.075   0.996
   31    HE1  HIS   5           1HE      HIS   5 -21.416 -16.694   2.023
   32    HE2  HIS   5           2HE      HIS   5 -21.236 -18.735   0.557
   33    H    HIS   6           H        HIS   6 -15.429 -22.081   3.607
   34    HA   HIS   6           HA       HIS   6 -12.938 -20.707   2.849
   35    HB2  HIS   6           2HB      HIS   6 -13.201 -22.560   5.220
   36    HB3  HIS   6           1HB      HIS   6 -11.814 -21.567   4.783
   37    HD1  HIS   6           1HD      HIS   6 -12.489 -18.844   4.764
   38    HD2  HIS   6           2HD      HIS   6 -14.702 -21.425   7.153
   39    HE1  HIS   6           1HE      HIS   6 -13.609 -17.382   6.476
   40    HE2  HIS   6           2HE      HIS   6 -14.875 -18.975   7.963
   41    H    HIS   7           H        HIS   7 -11.138 -22.696   3.278
   42    HA   HIS   7           HA       HIS   7 -10.217 -24.545   2.327
   43    HB2  HIS   7           2HB      HIS   7 -13.053 -25.361   2.753
   44    HB3  HIS   7           1HB      HIS   7 -12.041 -26.392   1.746
   45    HD1  HIS   7           1HD      HIS   7 -12.041 -28.296   3.476
   46    HD2  HIS   7           2HD      HIS   7 -10.485 -24.718   4.908
   47    HE1  HIS   7           1HE      HIS   7 -10.915 -28.874   5.651
   48    HE2  HIS   7           2HE      HIS   7 -10.055 -26.678   6.539
   49    H    HIS   8           H        HIS   8  -9.372 -24.347   0.370
   50    HA   HIS   8           HA       HIS   8  -9.143 -24.158  -1.885
   51    HB2  HIS   8           2HB      HIS   8 -11.792 -25.559  -1.669
   52    HB3  HIS   8           1HB      HIS   8 -11.163 -25.077  -3.241
   53    HD1  HIS   8           1HD      HIS   8 -11.525 -28.050  -1.867
   54    HD2  HIS   8           2HD      HIS   8  -8.022 -25.986  -2.722
   55    HE1  HIS   8           1HE      HIS   8  -9.738 -29.809  -2.054
   56    HE2  HIS   8           2HE      HIS   8  -7.611 -28.529  -2.486
   57    H    HIS   9           H        HIS   9  -9.108 -21.864  -1.724
   58    HA   HIS   9           HA       HIS   9 -11.584 -20.417  -2.192
   59    HB2  HIS   9           2HB      HIS   9  -8.788 -19.285  -2.022
   60    HB3  HIS   9           1HB      HIS   9 -10.306 -18.419  -1.827
   61    HD1  HIS   9           1HD      HIS   9 -11.507 -20.710   0.113
   62    HD2  HIS   9           2HD      HIS   9  -7.933 -18.638   0.558
   63    HE1  HIS   9           1HE      HIS   9 -10.961 -20.829   2.565
   64    HE2  HIS   9           2HE      HIS   9  -8.840 -19.496   2.823
   65    H    HIS  10           H        HIS  10 -11.240 -18.470  -3.820
   66    HA   HIS  10           HA       HIS  10 -10.405 -19.697  -6.360
   67    HB2  HIS  10           2HB      HIS  10 -11.914 -17.896  -7.363
   68    HB3  HIS  10           1HB      HIS  10 -12.712 -19.193  -6.480
   69    HD1  HIS  10           1HD      HIS  10 -11.793 -15.554  -6.155
   70    HD2  HIS  10           2HD      HIS  10 -14.171 -18.397  -4.277
   71    HE1  HIS  10           1HE      HIS  10 -13.201 -14.273  -4.512
   72    HE2  HIS  10           2HE      HIS  10 -14.570 -16.025  -3.327
   73    H    SER  11           H        SER  11 -10.384 -16.634  -4.566
   74    HA   SER  11           HA       SER  11  -8.987 -14.841  -4.625
   75    HB2  SER  11           2HB      SER  11  -7.337 -16.899  -4.470
   76    HB3  SER  11           1HB      SER  11  -6.907 -16.400  -6.106
   77    HG   SER  11           HG       SER  11  -5.923 -15.417  -3.959
   78    H    SER  12           H        SER  12  -7.725 -13.377  -6.137
   79    HA   SER  12           HA       SER  12  -9.043 -13.417  -8.761
   80    HB2  SER  12           2HB      SER  12  -8.197 -10.944  -8.741
   81    HB3  SER  12           1HB      SER  12  -9.596 -11.385  -7.761
   82    HG   SER  12           HG       SER  12  -6.951 -11.374  -6.752
   83    H    GLY  13           H        GLY  13  -7.781 -14.407 -10.217
   84    HA2  GLY  13           2HA      GLY  13  -5.371 -13.222 -11.085
   85    HA3  GLY  13           1HA      GLY  13  -4.997 -14.641 -10.121
   86    H    LEU  14           H        LEU  14  -7.244 -16.208 -10.903
   87    HA   LEU  14           HA       LEU  14  -6.252 -17.146 -13.448
   88    HB2  LEU  14           2HB      LEU  14  -7.026 -18.551 -11.411
   89    HB3  LEU  14           1HB      LEU  14  -8.643 -18.261 -12.021
   90    HG   LEU  14           HG       LEU  14  -7.755 -19.223 -14.248
   91   HD11  LEU  14          1HD1      LEU  14  -5.971 -21.019 -13.637
   92   HD12  LEU  14          2HD1      LEU  14  -5.559 -19.894 -12.343
   93   HD13  LEU  14          3HD1      LEU  14  -5.469 -19.374 -14.026
   94   HD21  LEU  14          3HD2      LEU  14  -9.328 -20.284 -12.542
   95   HD22  LEU  14          1HD2      LEU  14  -7.919 -21.185 -11.981
   96   HD23  LEU  14          2HD2      LEU  14  -8.480 -21.369 -13.644
   97    H    VAL  15           H        VAL  15  -9.052 -15.455 -12.221
   98    HA   VAL  15           HA       VAL  15 -10.122 -15.323 -14.966
   99    HB   VAL  15           HB       VAL  15 -12.345 -14.840 -13.855
  100   HG11  VAL  15          1HG1      VAL  15 -12.432 -16.918 -14.737
  101   HG12  VAL  15          2HG1      VAL  15 -12.432 -17.398 -13.041
  102   HG13  VAL  15          3HG1      VAL  15 -10.929 -17.426 -13.966
  103   HG21  VAL  15          3HG2      VAL  15 -11.393 -14.300 -11.631
  104   HG22  VAL  15          1HG2      VAL  15 -10.977 -16.001 -11.432
  105   HG23  VAL  15          2HG2      VAL  15 -12.667 -15.517 -11.566
  106    HA   PRO  16           HA       PRO  16  -9.596 -10.954 -15.079
  107    HB2  PRO  16           2HB      PRO  16 -12.440 -10.815 -15.955
  108    HB3  PRO  16           1HB      PRO  16 -10.993 -10.147 -16.719
  109    HG2  PRO  16           2HG      PRO  16 -12.168 -12.321 -17.709
  110    HG3  PRO  16           1HG      PRO  16 -10.400 -12.176 -17.675
  111    HD2  PRO  16           2HD      PRO  16 -12.208 -13.775 -15.916
  112    HD3  PRO  16           1HD      PRO  16 -10.587 -14.168 -16.527
  113    H    ARG  17           H        ARG  17 -11.107  -8.884 -14.566
  114    HA   ARG  17           HA       ARG  17 -12.033  -7.607 -12.929
  115    HB2  ARG  17           2HB      ARG  17 -13.413 -10.101 -11.946
  116    HB3  ARG  17           1HB      ARG  17 -13.950  -8.434 -11.789
  117    HG2  ARG  17           2HG      ARG  17 -13.800 -10.035 -14.334
  118    HG3  ARG  17           1HG      ARG  17 -15.262  -9.574 -13.459
  119    HD2  ARG  17           2HD      ARG  17 -14.349  -7.151 -13.783
  120    HD3  ARG  17           1HD      ARG  17 -13.407  -7.885 -15.081
  121    HE   ARG  17           HE       ARG  17 -15.315  -8.031 -16.328
  122   HH11  ARG  17          1HH1      ARG  17 -16.201  -7.523 -12.990
  123   HH12  ARG  17          2HH1      ARG  17 -17.884  -7.315 -13.339
  124   HH21  ARG  17          1HH2      ARG  17 -17.529  -7.757 -16.787
  125   HH22  ARG  17          2HH2      ARG  17 -18.640  -7.449 -15.495
  126    H    GLY  18           H        GLY  18 -11.909  -7.103 -10.663
  127    HA2  GLY  18           2HA      GLY  18 -11.196  -8.408  -8.490
  128    HA3  GLY  18           1HA      GLY  18  -9.687  -8.513  -9.382
  129    H    SER  19           H        SER  19 -11.918  -6.375  -7.746
  130    HA   SER  19           HA       SER  19  -9.843  -4.280  -7.765
  131    HB2  SER  19           2HB      SER  19 -12.633  -3.527  -7.096
  132    HB3  SER  19           1HB      SER  19 -11.422  -2.654  -8.035
  133    HG   SER  19           HG       SER  19 -13.432  -3.860  -9.028
  134    H    HIS  20           H        HIS  20 -10.450  -2.679  -5.795
  135    HA   HIS  20           HA       HIS  20 -11.302  -3.994  -3.400
  136    HB2  HIS  20           2HB      HIS  20  -8.406  -3.795  -4.047
  137    HB3  HIS  20           1HB      HIS  20  -8.886  -3.425  -2.394
  138    HD1  HIS  20           1HD      HIS  20  -7.169  -5.923  -3.181
  139    HD2  HIS  20           2HD      HIS  20 -11.279  -5.931  -2.561
  140    HE1  HIS  20           1HE      HIS  20  -7.756  -8.297  -2.593
  141    HE2  HIS  20           2HE      HIS  20 -10.233  -8.258  -2.137
  142    H    MET  21           H        MET  21 -10.701  -2.538  -1.432
  143    HA   MET  21           HA       MET  21 -11.762   0.034  -1.952
  144    HB2  MET  21           2HB      MET  21 -10.717  -1.404   0.433
  145    HB3  MET  21           1HB      MET  21 -10.821   0.350   0.526
  146    HG2  MET  21           2HG      MET  21 -13.067   0.350   0.600
  147    HG3  MET  21           1HG      MET  21 -13.213  -1.016  -0.505
  148    HE1  MET  21           3HE      MET  21 -15.139  -1.482   0.702
  149    HE2  MET  21           1HE      MET  21 -15.305  -1.902   2.406
  150    HE3  MET  21           2HE      MET  21 -14.863  -3.140   1.232
  151    H    SER  22           H        SER  22 -10.792   2.080  -1.751
  152    HA   SER  22           HA       SER  22  -7.935   2.070  -2.368
  153    HB2  SER  22           2HB      SER  22  -8.353   4.408  -3.203
  154    HB3  SER  22           1HB      SER  22  -9.229   3.153  -4.079
  155    HG   SER  22           HG       SER  22 -10.825   4.504  -3.657
  156    H    ASP  23           H        ASP  23  -9.654   2.268   0.271
  157    HA   ASP  23           HA       ASP  23  -8.473   4.608   1.468
  158    HB2  ASP  23           2HB      ASP  23 -10.168   2.451   2.695
  159    HB3  ASP  23           1HB      ASP  23  -9.720   3.963   3.481
  160    H    GLU  24           H        GLU  24  -7.678   1.447   1.034
  161    HA   GLU  24           HA       GLU  24  -6.213   0.894   3.365
  162    HB2  GLU  24           2HB      GLU  24  -5.885  -0.226   0.593
  163    HB3  GLU  24           1HB      GLU  24  -5.112  -0.884   2.028
  164    HG2  GLU  24           2HG      GLU  24  -7.016  -1.843   2.786
  165    HG3  GLU  24           1HG      GLU  24  -8.051  -0.586   2.109
  166    H    LYS  25           H        LYS  25  -5.639   2.905   0.817
  167    HA   LYS  25           HA       LYS  25  -2.746   2.978   1.138
  168    HB2  LYS  25           2HB      LYS  25  -3.660   3.091  -1.135
  169    HB3  LYS  25           1HB      LYS  25  -4.562   4.539  -0.709
  170    HG2  LYS  25           2HG      LYS  25  -1.961   5.177  -0.040
  171    HG3  LYS  25           1HG      LYS  25  -1.797   4.242  -1.528
  172    HD2  LYS  25           2HD      LYS  25  -2.997   5.766  -2.775
  173    HD3  LYS  25           1HD      LYS  25  -3.867   6.387  -1.370
  174    HE2  LYS  25           2HE      LYS  25  -1.806   7.457  -0.580
  175    HE3  LYS  25           1HE      LYS  25  -0.953   6.850  -1.997
  176    HZ1  LYS  25           3HZ      LYS  25  -2.244   8.209  -3.411
  177    HZ2  LYS  25           1HZ      LYS  25  -1.746   9.205  -2.137
  178    HZ3  LYS  25           2HZ      LYS  25  -3.330   8.612  -2.178
  179    H    THR  26           H        THR  26  -5.595   4.743   2.041
  180    HA   THR  26           HA       THR  26  -4.338   7.192   2.686
  181    HB   THR  26           HB       THR  26  -6.567   7.025   4.333
  182    HG1  THR  26           1HG      THR  26  -7.724   5.476   3.552
  183   HG21  THR  26          3HG2      THR  26  -7.423   7.937   1.805
  184   HG22  THR  26          1HG2      THR  26  -5.746   8.451   2.016
  185   HG23  THR  26          2HG2      THR  26  -6.966   8.886   3.219
  186    H    GLN  27           H        GLN  27  -4.683   4.175   4.370
  187    HA   GLN  27           HA       GLN  27  -4.190   5.070   6.990
  188    HB2  GLN  27           2HB      GLN  27  -3.829   2.477   5.546
  189    HB3  GLN  27           1HB      GLN  27  -3.084   2.669   7.128
  190    HG2  GLN  27           2HG      GLN  27  -5.073   2.688   8.220
  191    HG3  GLN  27           1HG      GLN  27  -5.937   3.415   6.867
  192   HE21  GLN  27          1HE2      GLN  27  -4.088   0.441   7.471
  193   HE22  GLN  27          2HE2      GLN  27  -5.256  -0.628   6.780
  194    H    LEU  28           H        LEU  28  -2.191   4.749   4.213
  195    HA   LEU  28           HA       LEU  28   0.292   4.904   5.673
  196    HB2  LEU  28           2HB      LEU  28  -0.040   3.545   3.579
  197    HB3  LEU  28           1HB      LEU  28  -0.151   5.067   2.714
  198    HG   LEU  28           HG       LEU  28   2.271   4.763   4.368
  199   HD11  LEU  28          1HD1      LEU  28   3.250   3.011   3.351
  200   HD12  LEU  28          2HD1      LEU  28   2.460   3.326   1.806
  201   HD13  LEU  28          3HD1      LEU  28   1.585   2.492   3.090
  202   HD21  LEU  28          3HD2      LEU  28   3.143   5.453   1.963
  203   HD22  LEU  28          1HD2      LEU  28   2.405   6.622   3.056
  204   HD23  LEU  28          2HD2      LEU  28   1.452   5.910   1.754
  205    H    ILE  29           H        ILE  29  -1.969   6.976   4.541
  206    HA   ILE  29           HA       ILE  29  -0.475   9.159   3.650
  207    HB   ILE  29           HB       ILE  29  -3.192   9.060   4.886
  208   HG12  ILE  29          2HG1      ILE  29  -2.739   7.904   2.678
  209   HG13  ILE  29          1HG1      ILE  29  -4.061   9.066   2.698
  210   HG21  ILE  29          1HG2      ILE  29  -2.366  11.296   5.209
  211   HG22  ILE  29          2HG2      ILE  29  -3.550  11.318   3.901
  212   HG23  ILE  29          3HG2      ILE  29  -1.827  11.384   3.532
  213   HD11  ILE  29          3HD1      ILE  29  -2.890   9.383   0.696
  214   HD12  ILE  29          1HD1      ILE  29  -1.327   9.389   1.519
  215   HD13  ILE  29          2HD1      ILE  29  -2.451  10.732   1.744
  216    H    GLU  30           H        GLU  30  -0.854   7.899   6.603
  217    HA   GLU  30           HA       GLU  30  -0.388  10.266   8.140
  218    HB2  GLU  30           2HB      GLU  30  -1.698   8.220   8.940
  219    HB3  GLU  30           1HB      GLU  30  -0.130   7.462   9.182
  220    HG2  GLU  30           2HG      GLU  30   0.313   9.701  10.537
  221    HG3  GLU  30           1HG      GLU  30  -1.442   9.642  10.694
  222    H    ALA  31           H        ALA  31   1.501   8.670   6.198
  223    HA   ALA  31           HA       ALA  31   3.909   8.664   7.846
  224    HB1  ALA  31           1HB      ALA  31   4.025   8.005   4.954
  225    HB2  ALA  31           2HB      ALA  31   3.165   6.893   6.019
  226    HB3  ALA  31           3HB      ALA  31   4.861   7.266   6.319
  227    H    PHE  32           H        PHE  32   2.391  10.461   5.270
  228    HA   PHE  32           HA       PHE  32   4.558  11.887   4.270
  229    HB2  PHE  32           2HB      PHE  32   1.657  12.658   4.581
  230    HB3  PHE  32           1HB      PHE  32   2.828  13.668   3.740
  231    HD1  PHE  32           1HD      PHE  32   1.141  10.385   3.702
  232    HD2  PHE  32           2HD      PHE  32   3.490  13.189   1.529
  233    HE1  PHE  32           1HE      PHE  32   0.755   9.103   1.638
  234    HE2  PHE  32           2HE      PHE  32   3.108  11.914  -0.539
  235    HZ   PHE  32           HZ       PHE  32   1.738   9.868  -0.487
  236    H    TYR  33           H        TYR  33   2.834  12.239   7.270
  237    HA   TYR  33           HA       TYR  33   4.179  14.776   7.837
  238    HB2  TYR  33           2HB      TYR  33   2.174  13.339   9.580
  239    HB3  TYR  33           1HB      TYR  33   2.669  15.026   9.676
  240    HD1  TYR  33           1HD      TYR  33   0.856  12.581   7.555
  241    HD2  TYR  33           2HD      TYR  33   1.542  16.685   8.442
  242    HE1  TYR  33           1HE      TYR  33  -1.014  13.204   6.086
  243    HE2  TYR  33           2HE      TYR  33  -0.327  17.320   6.975
  244    HH   TYR  33           HH       TYR  33  -1.636  15.380   4.720
  245    H    ASN  34           H        ASN  34   5.600  12.192   7.721
  246    HA   ASN  34           HA       ASN  34   7.292  12.514   9.925
  247    HB2  ASN  34           2HB      ASN  34   5.044  11.324  10.810
  248    HB3  ASN  34           1HB      ASN  34   5.943   9.899  10.296
  249   HD21  ASN  34          1HD2      ASN  34   8.469  10.407  10.919
  250   HD22  ASN  34          2HD2      ASN  34   8.661  10.673  12.615
  251    H    PHE  35           H        PHE  35   7.489  12.149   7.121
  252    HA   PHE  35           HA       PHE  35   9.628  10.344   6.971
  253    HB2  PHE  35           2HB      PHE  35   7.806   8.659   7.123
  254    HB3  PHE  35           1HB      PHE  35   7.101   9.326   5.655
  255    HD1  PHE  35           1HD      PHE  35  10.625   8.528   6.572
  256    HD2  PHE  35           2HD      PHE  35   7.335   7.767   3.981
  257    HE1  PHE  35           1HE      PHE  35  12.038   7.036   5.221
  258    HE2  PHE  35           2HE      PHE  35   8.743   6.272   2.626
  259    HZ   PHE  35           HZ       PHE  35  11.099   5.904   3.246
  260    H    ASP  36           H        ASP  36   9.042  13.002   6.197
  261    HA   ASP  36           HA       ASP  36   9.749  12.826   3.372
  262    HB2  ASP  36           2HB      ASP  36   8.158  14.586   2.739
  263    HB3  ASP  36           1HB      ASP  36   7.320  13.170   3.367
  264    H    GLY  37           H        GLY  37  11.484  13.325   5.425
  265    HA2  GLY  37           2HA      GLY  37  11.786  16.176   5.803
  266    HA3  GLY  37           1HA      GLY  37  12.865  14.924   6.395
  267    H    ASP  38           H        ASP  38  14.363  13.954   4.860
  268    HA   ASP  38           HA       ASP  38  14.787  14.925   2.266
  269    HB2  ASP  38           2HB      ASP  38  15.373  16.929   3.936
  270    HB3  ASP  38           1HB      ASP  38  16.914  16.079   3.999
  271    H    TYR  39           H        TYR  39  15.002  12.580   2.271
  272    HA   TYR  39           HA       TYR  39  17.791  11.805   2.602
  273    HB2  TYR  39           2HB      TYR  39  15.999  11.123   4.565
  274    HB3  TYR  39           1HB      TYR  39  15.950   9.709   3.519
  275    HD1  TYR  39           1HD      TYR  39  17.974   8.355   3.165
  276    HD2  TYR  39           2HD      TYR  39  17.951  11.642   5.866
  277    HE1  TYR  39           1HE      TYR  39  20.054   7.525   4.184
  278    HE2  TYR  39           2HE      TYR  39  20.030  10.822   6.892
  279    HH   TYR  39           HH       TYR  39  21.209   8.580   7.122
  280    H    ASP  40           H        ASP  40  16.167  12.357   0.303
  281    HA   ASP  40           HA       ASP  40  15.740  11.524  -1.769
  282    HB2  ASP  40           2HB      ASP  40  18.079  10.397  -1.040
  283    HB3  ASP  40           1HB      ASP  40  17.107   8.944  -1.258
  284    H    GLY  41           H        GLY  41  15.075   9.196  -2.855
  285    HA2  GLY  41           2HA      GLY  41  12.706   8.414  -1.302
  286    HA3  GLY  41           1HA      GLY  41  12.902   8.231  -3.039
  287    H    PHE  42           H        PHE  42  15.506   7.041  -2.953
  288    HA   PHE  42           HA       PHE  42  14.814   4.339  -2.741
  289    HB2  PHE  42           2HB      PHE  42  16.657   5.128  -4.148
  290    HB3  PHE  42           1HB      PHE  42  17.564   5.599  -2.715
  291    HD1  PHE  42           2HD      PHE  42  18.524   3.902  -1.240
  292    HD2  PHE  42           1HD      PHE  42  16.523   2.846  -4.843
  293    HE1  PHE  42           2HE      PHE  42  19.526   1.656  -1.135
  294    HE2  PHE  42           1HE      PHE  42  17.520   0.599  -4.745
  295    HZ   PHE  42           HZ       PHE  42  19.025   0.002  -2.888
  296    H    VAL  43           H        VAL  43  14.603   3.049  -1.052
  297    HA   VAL  43           HA       VAL  43  16.185   3.552   1.361
  298    HB   VAL  43           HB       VAL  43  14.048   4.617   1.805
  299   HG11  VAL  43          1HG1      VAL  43  12.709   3.371   0.173
  300   HG12  VAL  43          2HG1      VAL  43  11.954   3.386   1.768
  301   HG13  VAL  43          3HG1      VAL  43  12.795   1.941   1.203
  302   HG21  VAL  43          3HG2      VAL  43  15.148   3.469   3.657
  303   HG22  VAL  43          1HG2      VAL  43  14.291   1.981   3.255
  304   HG23  VAL  43          2HG2      VAL  43  13.394   3.392   3.819
  305    H    SER  44           H        SER  44  17.093   1.751   2.102
  306    HA   SER  44           HA       SER  44  16.713  -0.740   0.815
  307    HB2  SER  44           2HB      SER  44  18.121  -1.526   2.897
  308    HB3  SER  44           1HB      SER  44  18.860  -0.514   1.656
  309    HG   SER  44           HG       SER  44  19.272   0.259   3.778
  310    H    VAL  45           H        VAL  45  15.993  -2.729   1.730
  311    HA   VAL  45           HA       VAL  45  13.500  -2.585   3.014
  312    HB   VAL  45           HB       VAL  45  15.328  -4.981   2.814
  313   HG11  VAL  45          1HG1      VAL  45  13.766  -6.089   3.913
  314   HG12  VAL  45          2HG1      VAL  45  12.605  -5.695   2.649
  315   HG13  VAL  45          3HG1      VAL  45  12.783  -4.633   4.046
  316   HG21  VAL  45          3HG2      VAL  45  14.527  -5.429   0.706
  317   HG22  VAL  45          1HG2      VAL  45  14.611  -3.668   0.674
  318   HG23  VAL  45          2HG2      VAL  45  13.065  -4.472   0.942
  319    H    GLU  46           H        GLU  46  16.740  -2.869   4.233
  320    HA   GLU  46           HA       GLU  46  16.061  -3.818   6.832
  321    HB2  GLU  46           2HB      GLU  46  18.538  -2.267   6.085
  322    HB3  GLU  46           1HB      GLU  46  18.343  -3.415   7.402
  323    HG2  GLU  46           2HG      GLU  46  18.388  -5.250   5.981
  324    HG3  GLU  46           1HG      GLU  46  17.995  -4.282   4.561
  325    H    GLU  47           H        GLU  47  17.175  -0.612   5.718
  326    HA   GLU  47           HA       GLU  47  16.715   0.740   8.118
  327    HB2  GLU  47           2HB      GLU  47  16.541   1.868   5.318
  328    HB3  GLU  47           1HB      GLU  47  16.789   2.791   6.793
  329    HG2  GLU  47           2HG      GLU  47  18.685   0.697   5.759
  330    HG3  GLU  47           1HG      GLU  47  18.846   2.426   5.462
  331    H    PHE  48           H        PHE  48  14.541  -0.200   5.572
  332    HA   PHE  48           HA       PHE  48  12.398   1.529   6.115
  333    HB2  PHE  48           2HB      PHE  48  12.912  -0.513   4.315
  334    HB3  PHE  48           1HB      PHE  48  11.582  -1.147   5.278
  335    HD1  PHE  48           1HD      PHE  48   9.919   1.107   5.839
  336    HD2  PHE  48           2HD      PHE  48  12.110   0.218   2.302
  337    HE1  PHE  48           1HE      PHE  48   8.330   2.448   4.524
  338    HE2  PHE  48           2HE      PHE  48  10.524   1.558   0.978
  339    HZ   PHE  48           HZ       PHE  48   8.631   2.674   2.091
  340    H    ARG  49           H        ARG  49  13.352  -1.548   7.531
  341    HA   ARG  49           HA       ARG  49  11.038  -2.121   8.981
  342    HB2  ARG  49           2HB      ARG  49  13.937  -2.789   9.374
  343    HB3  ARG  49           1HB      ARG  49  12.749  -3.257  10.583
  344    HG2  ARG  49           2HG      ARG  49  11.856  -4.867   9.283
  345    HG3  ARG  49           1HG      ARG  49  12.097  -3.953   7.794
  346    HD2  ARG  49           2HD      ARG  49  14.421  -4.533   7.741
  347    HD3  ARG  49           1HD      ARG  49  14.324  -5.268   9.341
  348    HE   ARG  49           HE       ARG  49  13.559  -6.452   6.836
  349   HH11  ARG  49          1HH1      ARG  49  13.075  -6.507  10.292
  350   HH12  ARG  49          2HH1      ARG  49  12.536  -8.152  10.317
  351   HH21  ARG  49          1HH2      ARG  49  12.850  -8.617   6.866
  352   HH22  ARG  49          2HH2      ARG  49  12.408  -9.350   8.372
  353    H    GLY  50           H        GLY  50  13.945  -0.329  10.004
  354    HA2  GLY  50           2HA      GLY  50  13.120   0.279  12.599
  355    HA3  GLY  50           1HA      GLY  50  14.247   1.238  11.653
  356    H    ILE  51           H        ILE  51  12.144   1.670   9.567
  357    HA   ILE  51           HA       ILE  51  11.010   4.041  10.751
  358    HB   ILE  51           HB       ILE  51  10.519   2.946   7.982
  359   HG12  ILE  51          2HG1      ILE  51  12.544   5.057   8.695
  360   HG13  ILE  51          1HG1      ILE  51  12.970   3.349   8.670
  361   HG21  ILE  51          1HG2      ILE  51   9.497   4.898   7.475
  362   HG22  ILE  51          2HG2      ILE  51  10.516   5.842   8.560
  363   HG23  ILE  51          3HG2      ILE  51   9.169   4.907   9.207
  364   HD11  ILE  51          3HD1      ILE  51  12.319   5.178   6.430
  365   HD12  ILE  51          1HD1      ILE  51  11.899   3.473   6.268
  366   HD13  ILE  51          2HD1      ILE  51  13.572   3.944   6.562
  367    H    ILE  52           H        ILE  52   9.837   0.937   9.545
  368    HA   ILE  52           HA       ILE  52   7.070   1.576   9.928
  369    HB   ILE  52           HB       ILE  52   8.398  -1.112   9.544
  370   HG12  ILE  52          2HG1      ILE  52   8.720   0.496   7.675
  371   HG13  ILE  52          1HG1      ILE  52   7.751  -0.899   7.215
  372   HG21  ILE  52          1HG2      ILE  52   6.330  -1.648  10.434
  373   HG22  ILE  52          2HG2      ILE  52   6.005  -1.648   8.701
  374   HG23  ILE  52          3HG2      ILE  52   5.533  -0.265   9.687
  375   HD11  ILE  52          3HD1      ILE  52   7.082   1.913   7.197
  376   HD12  ILE  52          1HD1      ILE  52   5.883   0.950   8.060
  377   HD13  ILE  52          2HD1      ILE  52   6.295   0.554   6.391
  378    H    ARG  53           H        ARG  53   9.601   0.177  11.876
  379    HA   ARG  53           HA       ARG  53   8.190  -1.229  13.781
  380    HB2  ARG  53           2HB      ARG  53  10.700   0.407  13.918
  381    HB3  ARG  53           1HB      ARG  53  10.049  -0.333  15.374
  382    HG2  ARG  53           2HG      ARG  53  10.017  -2.456  13.732
  383    HG3  ARG  53           1HG      ARG  53  11.378  -1.562  13.050
  384    HD2  ARG  53           2HD      ARG  53  12.574  -2.610  14.635
  385    HD3  ARG  53           1HD      ARG  53  11.906  -1.378  15.706
  386    HE   ARG  53           HE       ARG  53  10.620  -2.989  16.710
  387   HH11  ARG  53          1HH1      ARG  53  11.917  -4.261  13.729
  388   HH12  ARG  53          2HH1      ARG  53  11.393  -5.880  14.047
  389   HH21  ARG  53          1HH2      ARG  53   9.931  -5.119  17.128
  390   HH22  ARG  53          2HH2      ARG  53  10.264  -6.368  15.975
  391    H    ASP  54           H        ASP  54   9.055   2.228  13.935
  392    HA   ASP  54           HA       ASP  54   6.879   2.591  15.886
  393    HB2  ASP  54           2HB      ASP  54   9.467   3.199  16.290
  394    HB3  ASP  54           1HB      ASP  54   8.932   4.708  15.558
  395    H    GLY  55           H        GLY  55   7.040   2.727  12.768
  396    HA2  GLY  55           2HA      GLY  55   6.069   5.477  12.423
  397    HA3  GLY  55           1HA      GLY  55   6.556   4.390  11.130
  398    H    LEU  56           H        LEU  56   5.115   2.736  10.461
  399    HA   LEU  56           HA       LEU  56   2.314   3.363  11.085
  400    HB2  LEU  56           2HB      LEU  56   3.210   1.708   8.750
  401    HB3  LEU  56           1HB      LEU  56   1.721   2.613   8.946
  402    HG   LEU  56           HG       LEU  56   4.342   4.058   8.799
  403   HD11  LEU  56          1HD1      LEU  56   2.823   3.758   6.295
  404   HD12  LEU  56          2HD1      LEU  56   3.708   2.330   6.831
  405   HD13  LEU  56          3HD1      LEU  56   4.562   3.850   6.568
  406   HD21  LEU  56          3HD2      LEU  56   2.894   5.808   7.831
  407   HD22  LEU  56          1HD2      LEU  56   2.409   5.342   9.460
  408   HD23  LEU  56          2HD2      LEU  56   1.501   4.754   8.068
  409    HA   PRO  57           HA       PRO  57   2.000  -0.638  12.981
  410    HB2  PRO  57           2HB      PRO  57  -0.644  -0.721  13.388
  411    HB3  PRO  57           1HB      PRO  57   0.384   0.420  14.263
  412    HG2  PRO  57           2HG      PRO  57  -1.374   0.887  11.890
  413    HG3  PRO  57           1HG      PRO  57  -1.127   1.907  13.320
  414    HD2  PRO  57           2HD      PRO  57   0.107   2.301  10.881
  415    HD3  PRO  57           1HD      PRO  57   0.733   2.891  12.432
  416    H    MET  58           H        MET  58   2.496  -1.032  10.372
  417    HA   MET  58           HA       MET  58   0.296  -2.479   9.147
  418    HB2  MET  58           2HB      MET  58   1.823  -1.028   7.809
  419    HB3  MET  58           1HB      MET  58   3.140  -2.132   8.177
  420    HG2  MET  58           2HG      MET  58   2.433  -3.685   6.708
  421    HG3  MET  58           1HG      MET  58   0.729  -3.344   6.995
  422    HE1  MET  58           3HE      MET  58   4.001  -2.102   5.073
  423    HE2  MET  58           1HE      MET  58   3.205  -2.025   3.501
  424    HE3  MET  58           2HE      MET  58   3.193  -3.529   4.422
  425    H    THR  59           H        THR  59   0.161  -4.675   8.926
  426    HA   THR  59           HA       THR  59   1.576  -6.287  10.793
  427    HB   THR  59           HB       THR  59   0.449  -8.175   9.367
  428    HG1  THR  59           1HG      THR  59  -1.202  -6.025   8.593
  429   HG21  THR  59          3HG2      THR  59  -0.348  -7.542  11.574
  430   HG22  THR  59          1HG2      THR  59  -1.690  -7.838  10.469
  431   HG23  THR  59          2HG2      THR  59  -1.231  -6.185  10.875
  432    H    GLU  60           H        GLU  60   3.189  -7.718  10.540
  433    HA   GLU  60           HA       GLU  60   5.299  -7.323   8.907
  434    HB2  GLU  60           2HB      GLU  60   6.132  -9.102   9.992
  435    HB3  GLU  60           1HB      GLU  60   4.568  -9.211  10.779
  436    HG2  GLU  60           2HG      GLU  60   3.812 -10.829   9.170
  437    HG3  GLU  60           1HG      GLU  60   5.313 -10.668   8.259
  438    H    ALA  61           H        ALA  61   2.676  -9.582   8.236
  439    HA   ALA  61           HA       ALA  61   3.455 -10.696   5.887
  440    HB1  ALA  61           1HB      ALA  61   1.009 -10.809   5.311
  441    HB2  ALA  61           2HB      ALA  61   0.707  -9.839   6.753
  442    HB3  ALA  61           3HB      ALA  61   1.446 -11.433   6.902
  443    H    GLU  62           H        GLU  62   1.624  -7.645   6.174
  444    HA   GLU  62           HA       GLU  62   1.585  -7.069   3.434
  445    HB2  GLU  62           2HB      GLU  62   1.860  -4.716   5.186
  446    HB3  GLU  62           1HB      GLU  62   0.641  -5.081   3.981
  447    HG2  GLU  62           2HG      GLU  62   0.759  -6.040   6.821
  448    HG3  GLU  62           1HG      GLU  62  -0.420  -4.948   6.099
  449    H    ILE  63           H        ILE  63   3.742  -5.668   5.906
  450    HA   ILE  63           HA       ILE  63   5.497  -4.403   4.127
  451    HB   ILE  63           HB       ILE  63   6.460  -5.585   6.718
  452   HG12  ILE  63          2HG1      ILE  63   5.620  -3.048   7.365
  453   HG13  ILE  63          1HG1      ILE  63   4.328  -3.618   6.313
  454   HG21  ILE  63          1HG2      ILE  63   7.874  -4.258   4.967
  455   HG22  ILE  63          2HG2      ILE  63   8.059  -3.932   6.690
  456   HG23  ILE  63          3HG2      ILE  63   7.085  -2.854   5.689
  457   HD11  ILE  63          3HD1      ILE  63   3.494  -4.504   8.171
  458   HD12  ILE  63          1HD1      ILE  63   5.034  -4.417   9.024
  459   HD13  ILE  63          2HD1      ILE  63   4.705  -5.762   7.930
  460    H    THR  64           H        THR  64   6.039  -7.470   5.845
  461    HA   THR  64           HA       THR  64   8.365  -8.249   4.575
  462    HB   THR  64           HB       THR  64   6.082  -9.895   5.644
  463    HG1  THR  64           1HG      THR  64   8.544  -9.009   6.697
  464   HG21  THR  64          3HG2      THR  64   8.818 -10.838   4.839
  465   HG22  THR  64          1HG2      THR  64   7.269 -11.341   4.158
  466   HG23  THR  64          2HG2      THR  64   7.678 -11.761   5.822
  467    H    GLU  65           H        GLU  65   5.007  -9.069   3.674
  468    HA   GLU  65           HA       GLU  65   5.756 -10.448   1.326
  469    HB2  GLU  65           2HB      GLU  65   3.533 -10.663   2.494
  470    HB3  GLU  65           1HB      GLU  65   3.112  -9.101   1.803
  471    HG2  GLU  65           2HG      GLU  65   3.175  -9.963  -0.403
  472    HG3  GLU  65           1HG      GLU  65   3.917 -11.469   0.136
  473    H    PHE  66           H        PHE  66   5.660  -7.256   2.105
  474    HA   PHE  66           HA       PHE  66   5.466  -6.350  -0.646
  475    HB2  PHE  66           2HB      PHE  66   5.257  -4.988   1.999
  476    HB3  PHE  66           1HB      PHE  66   5.843  -4.044   0.637
  477    HD1  PHE  66           2HD      PHE  66   4.228  -5.167  -1.568
  478    HD2  PHE  66           1HD      PHE  66   3.142  -4.123   2.413
  479    HE1  PHE  66           2HE      PHE  66   1.913  -4.782  -2.304
  480    HE2  PHE  66           1HE      PHE  66   0.825  -3.735   1.683
  481    HZ   PHE  66           HZ       PHE  66   0.208  -4.064  -0.678
  482    H    PHE  67           H        PHE  67   7.746  -6.903   1.890
  483    HA   PHE  67           HA       PHE  67   9.864  -5.286   0.876
  484    HB2  PHE  67           2HB      PHE  67   9.588  -7.444   2.917
  485    HB3  PHE  67           1HB      PHE  67  11.204  -7.071   2.330
  486    HD1  PHE  67           2HD      PHE  67  10.655  -4.039   1.955
  487    HD2  PHE  67           1HD      PHE  67   9.944  -6.768   5.148
  488    HE1  PHE  67           2HE      PHE  67  10.788  -2.188   3.568
  489    HE2  PHE  67           1HE      PHE  67  10.079  -4.917   6.763
  490    HZ   PHE  67           HZ       PHE  67  10.503  -2.625   5.974
  491    H    GLU  68           H        GLU  68   8.955  -8.680   0.510
  492    HA   GLU  68           HA       GLU  68  11.228  -9.237  -1.192
  493    HB2  GLU  68           2HB      GLU  68   8.838 -11.013  -0.719
  494    HB3  GLU  68           1HB      GLU  68  10.447 -11.489  -1.246
  495    HG2  GLU  68           2HG      GLU  68   9.725 -10.400   1.465
  496    HG3  GLU  68           1HG      GLU  68  10.060 -12.087   1.075
  497    H    ALA  69           H        ALA  69   7.862  -8.413  -1.533
  498    HA   ALA  69           HA       ALA  69   7.725  -9.122  -4.306
  499    HB1  ALA  69           1HB      ALA  69   5.749  -9.222  -2.841
  500    HB2  ALA  69           2HB      ALA  69   5.492  -8.195  -4.253
  501    HB3  ALA  69           3HB      ALA  69   5.827  -7.467  -2.680
  502    H    ALA  70           H        ALA  70   8.966  -6.612  -2.629
  503    HA   ALA  70           HA       ALA  70   8.541  -4.585  -4.675
  504    HB1  ALA  70           1HB      ALA  70   8.390  -3.558  -2.626
  505    HB2  ALA  70           2HB      ALA  70  10.085  -3.266  -3.018
  506    HB3  ALA  70           3HB      ALA  70   9.650  -4.564  -1.907
  507    H    ASP  71           H        ASP  71  11.044  -6.698  -3.461
  508    HA   ASP  71           HA       ASP  71  12.885  -5.634  -5.500
  509    HB2  ASP  71           2HB      ASP  71  13.536  -5.477  -3.016
  510    HB3  ASP  71           1HB      ASP  71  13.745  -7.224  -3.089
  511    HA   PRO  72           HA       PRO  72  12.171  -9.610  -7.448
  512    HB2  PRO  72           2HB      PRO  72  14.114  -9.342  -9.363
  513    HB3  PRO  72           1HB      PRO  72  12.504  -8.625  -9.487
  514    HG2  PRO  72           2HG      PRO  72  15.077  -7.364  -8.629
  515    HG3  PRO  72           1HG      PRO  72  13.802  -6.710  -9.674
  516    HD2  PRO  72           2HD      PRO  72  14.031  -5.984  -7.096
  517    HD3  PRO  72           1HD      PRO  72  12.448  -6.147  -7.884
  518    H    ASN  73           H        ASN  73  15.377  -8.420  -6.554
  519    HA   ASN  73           HA       ASN  73  16.509 -11.084  -6.543
  520    HB2  ASN  73           2HB      ASN  73  17.763  -8.544  -5.496
  521    HB3  ASN  73           1HB      ASN  73  18.584 -10.027  -5.973
  522   HD21  ASN  73          1HD2      ASN  73  17.090  -7.107  -7.046
  523   HD22  ASN  73          2HD2      ASN  73  17.559  -7.227  -8.704
  524    H    ASN  74           H        ASN  74  15.228  -8.776  -4.264
  525    HA   ASN  74           HA       ASN  74  14.571  -9.001  -2.097
  526    HB2  ASN  74           2HB      ASN  74  15.523 -11.863  -2.152
  527    HB3  ASN  74           1HB      ASN  74  14.314 -11.139  -1.094
  528   HD21  ASN  74          1HD2      ASN  74  12.529  -9.984  -2.505
  529   HD22  ASN  74          2HD2      ASN  74  11.837 -10.998  -3.721
  530    H    THR  75           H        THR  75  17.117  -8.072  -2.844
  531    HA   THR  75           HA       THR  75  18.988  -9.163  -0.914
  532    HB   THR  75           HB       THR  75  19.978  -8.613  -2.993
  533    HG1  THR  75           1HG      THR  75  20.554  -6.426  -1.290
  534   HG21  THR  75          3HG2      THR  75  18.492  -6.031  -2.788
  535   HG22  THR  75          1HG2      THR  75  18.543  -7.191  -4.117
  536   HG23  THR  75          2HG2      THR  75  19.946  -6.174  -3.777
  537    H    GLY  76           H        GLY  76  16.720  -8.105   0.283
  538    HA2  GLY  76           2HA      GLY  76  16.008  -6.625   1.874
  539    HA3  GLY  76           1HA      GLY  76  17.709  -6.532   2.310
  540    H    PHE  77           H        PHE  77  16.646  -5.534  -0.844
  541    HA   PHE  77           HA       PHE  77  16.846  -2.721  -0.014
  542    HB2  PHE  77           2HB      PHE  77  18.049  -3.959  -2.498
  543    HB3  PHE  77           1HB      PHE  77  18.005  -2.234  -2.156
  544    HD1  PHE  77           2HD      PHE  77  18.642  -2.335   0.775
  545    HD2  PHE  77           1HD      PHE  77  20.351  -4.359  -2.554
  546    HE1  PHE  77           2HE      PHE  77  20.773  -2.522   1.990
  547    HE2  PHE  77           1HE      PHE  77  22.486  -4.552  -1.346
  548    HZ   PHE  77           HZ       PHE  77  22.699  -3.632   0.928
  549    H    ILE  78           H        ILE  78  15.215  -1.469  -0.670
  550    HA   ILE  78           HA       ILE  78  13.256  -2.630  -2.523
  551    HB   ILE  78           HB       ILE  78  12.991  -0.322  -0.590
  552   HG12  ILE  78          2HG1      ILE  78  11.764  -3.081  -0.588
  553   HG13  ILE  78          1HG1      ILE  78  13.013  -2.503   0.515
  554   HG21  ILE  78          1HG2      ILE  78  10.921  -1.529  -2.422
  555   HG22  ILE  78          2HG2      ILE  78  11.627   0.083  -2.564
  556   HG23  ILE  78          3HG2      ILE  78  10.610  -0.316  -1.182
  557   HD11  ILE  78          3HD1      ILE  78  11.498  -1.597   1.856
  558   HD12  ILE  78          1HD1      ILE  78  10.269  -2.419   0.895
  559   HD13  ILE  78          2HD1      ILE  78  10.719  -0.753   0.513
  560    H    ASP  79           H        ASP  79  12.332  -1.400  -4.170
  561    HA   ASP  79           HA       ASP  79  14.059   0.741  -5.200
  562    HB2  ASP  79           2HB      ASP  79  13.694  -1.150  -6.741
  563    HB3  ASP  79           1HB      ASP  79  11.952  -0.928  -6.609
  564    H    TYR  80           H        TYR  80  13.310   2.491  -4.096
  565    HA   TYR  80           HA       TYR  80  11.050   3.239  -3.021
  566    HB2  TYR  80           2HB      TYR  80  12.975   4.750  -3.310
  567    HB3  TYR  80           1HB      TYR  80  12.495   5.035  -4.980
  568    HD1  TYR  80           1HD      TYR  80  10.778   5.067  -1.651
  569    HD2  TYR  80           2HD      TYR  80  11.525   7.090  -5.317
  570    HE1  TYR  80           1HE      TYR  80   9.342   6.921  -0.914
  571    HE2  TYR  80           2HE      TYR  80  10.091   8.951  -4.591
  572    HH   TYR  80           HH       TYR  80   9.362   9.866  -2.142
  573    H    LYS  81           H        LYS  81  11.442   3.210  -6.548
  574    HA   LYS  81           HA       LYS  81   8.911   4.316  -7.135
  575    HB2  LYS  81           2HB      LYS  81  10.842   2.636  -8.716
  576    HB3  LYS  81           1HB      LYS  81   9.288   3.110  -9.385
  577    HG2  LYS  81           2HG      LYS  81  10.925   5.274  -8.228
  578    HG3  LYS  81           1HG      LYS  81  11.532   4.529  -9.708
  579    HD2  LYS  81           2HD      LYS  81  10.203   6.221 -10.546
  580    HD3  LYS  81           1HD      LYS  81   9.083   4.857 -10.544
  581    HE2  LYS  81           2HE      LYS  81   7.793   5.749  -8.921
  582    HE3  LYS  81           1HE      LYS  81   9.171   6.428  -8.056
  583    HZ1  LYS  81           3HZ      LYS  81   9.139   8.331  -9.319
  584    HZ2  LYS  81           1HZ      LYS  81   7.487   7.987  -9.219
  585    HZ3  LYS  81           2HZ      LYS  81   8.345   7.604 -10.624
  586    H    ALA  82           H        ALA  82  10.020   0.925  -7.207
  587    HA   ALA  82           HA       ALA  82   7.581  -0.282  -7.762
  588    HB1  ALA  82           1HB      ALA  82   9.239  -1.732  -5.817
  589    HB2  ALA  82           2HB      ALA  82  10.094  -1.192  -7.265
  590    HB3  ALA  82           3HB      ALA  82   8.670  -2.220  -7.414
  591    H    PHE  83           H        PHE  83   8.765   1.140  -4.833
  592    HA   PHE  83           HA       PHE  83   6.641   0.010  -3.208
  593    HB2  PHE  83           2HB      PHE  83   9.233   1.026  -2.708
  594    HB3  PHE  83           1HB      PHE  83   8.103   2.089  -1.871
  595    HD1  PHE  83           2HD      PHE  83   8.548  -1.567  -2.457
  596    HD2  PHE  83           1HD      PHE  83   7.650   1.539   0.309
  597    HE1  PHE  83           2HE      PHE  83   8.343  -3.231  -0.663
  598    HE2  PHE  83           1HE      PHE  83   7.443  -0.122   2.113
  599    HZ   PHE  83           HZ       PHE  83   7.788  -2.512   1.629
  600    H    ALA  84           H        ALA  84   7.492   3.000  -4.802
  601    HA   ALA  84           HA       ALA  84   5.453   4.563  -3.513
  602    HB1  ALA  84           1HB      ALA  84   7.227   5.879  -4.182
  603    HB2  ALA  84           2HB      ALA  84   6.062   6.162  -5.475
  604    HB3  ALA  84           3HB      ALA  84   7.403   5.044  -5.724
  605    H    ALA  85           H        ALA  85   5.737   2.676  -6.439
  606    HA   ALA  85           HA       ALA  85   3.383   3.698  -7.666
  607    HB1  ALA  85           1HB      ALA  85   3.670   1.942  -9.302
  608    HB2  ALA  85           2HB      ALA  85   4.835   1.138  -8.248
  609    HB3  ALA  85           3HB      ALA  85   5.225   2.705  -8.961
  610    H    MET  86           H        MET  86   3.894   1.667  -5.157
  611    HA   MET  86           HA       MET  86   1.697  -0.132  -5.492
  612    HB2  MET  86           2HB      MET  86   3.408   0.571  -3.107
  613    HB3  MET  86           1HB      MET  86   2.112  -0.616  -3.040
  614    HG2  MET  86           2HG      MET  86   4.108  -0.962  -5.186
  615    HG3  MET  86           1HG      MET  86   4.659  -1.242  -3.535
  616    HE1  MET  86           3HE      MET  86   3.299  -4.488  -5.926
  617    HE2  MET  86           1HE      MET  86   4.777  -3.555  -5.690
  618    HE3  MET  86           2HE      MET  86   3.417  -2.849  -6.563
  619    H    LEU  87           H        LEU  87   2.175   2.991  -4.002
  620    HA   LEU  87           HA       LEU  87  -0.518   2.957  -2.916
  621    HB2  LEU  87           2HB      LEU  87   1.689   4.957  -2.636
  622    HB3  LEU  87           1HB      LEU  87   0.129   5.098  -1.849
  623    HG   LEU  87           HG       LEU  87   1.559   2.584  -1.295
  624   HD11  LEU  87          1HD1      LEU  87   3.315   4.485  -1.404
  625   HD12  LEU  87          2HD1      LEU  87   3.287   3.414  -0.005
  626   HD13  LEU  87          3HD1      LEU  87   2.574   5.023   0.103
  627   HD21  LEU  87          3HD2      LEU  87  -0.572   3.335  -0.232
  628   HD22  LEU  87          1HD2      LEU  87   0.337   4.631   0.547
  629   HD23  LEU  87          2HD2      LEU  87   0.714   2.946   0.911
  630    H    TYR  88           H        TYR  88   0.981   3.764  -5.606
  631    HA   TYR  88           HA       TYR  88  -1.090   5.690  -6.403
  632    HB2  TYR  88           2HB      TYR  88   1.813   5.692  -7.250
  633    HB3  TYR  88           1HB      TYR  88   0.572   6.748  -7.915
  634    HD1  TYR  88           2HD      TYR  88  -0.907   7.553  -5.510
  635    HD2  TYR  88           1HD      TYR  88   3.279   7.098  -6.117
  636    HE1  TYR  88           2HE      TYR  88  -0.476   9.189  -3.725
  637    HE2  TYR  88           1HE      TYR  88   3.722   8.732  -4.334
  638    HH   TYR  88           HH       TYR  88   1.377  10.768  -3.083
  639    H    SER  89           H        SER  89  -0.759   2.706  -6.680
  640    HA   SER  89           HA       SER  89  -0.263   2.122  -9.409
  641    HB2  SER  89           2HB      SER  89  -1.075  -0.078  -8.926
  642    HB3  SER  89           1HB      SER  89  -0.199   0.470  -7.496
  643    HG   SER  89           HG       SER  89  -2.294  -0.517  -7.091
  644    H    VAL  90           H        VAL  90  -1.449   3.410 -10.771
  645    HA   VAL  90           HA       VAL  90  -4.350   2.912 -10.779
  646    HB   VAL  90           HB       VAL  90  -4.642   5.242 -11.679
  647   HG11  VAL  90          1HG1      VAL  90  -5.343   4.905  -9.469
  648   HG12  VAL  90          2HG1      VAL  90  -4.297   6.324  -9.391
  649   HG13  VAL  90          3HG1      VAL  90  -3.688   4.750  -8.876
  650   HG21  VAL  90          3HG2      VAL  90  -2.095   6.067 -10.423
  651   HG22  VAL  90          1HG2      VAL  90  -2.955   6.749 -11.804
  652   HG23  VAL  90          2HG2      VAL  90  -1.986   5.290 -12.001
  653    H    ASP  91           H        ASP  91  -2.191   1.627 -12.259
  654    HA   ASP  91           HA       ASP  91  -3.261   2.049 -14.934
  655    HB2  ASP  91           2HB      ASP  91  -0.901   2.007 -15.874
  656    HB3  ASP  91           1HB      ASP  91  -1.382   3.497 -15.071
  657    H    GLU  92           H        GLU  92  -3.877   0.112 -15.607
  658    HA   GLU  92           HA       GLU  92  -2.103  -2.178 -15.178
  659    HB2  GLU  92           2HB      GLU  92  -5.081  -2.354 -14.728
  660    HB3  GLU  92           1HB      GLU  92  -3.879  -3.602 -14.430
  661    HG2  GLU  92           2HG      GLU  92  -3.963  -2.914 -12.316
  662    HG3  GLU  92           1HG      GLU  92  -2.970  -1.564 -12.865
  663    H    SER  93           H        SER  93  -2.882  -4.106 -16.505
  664    HA   SER  93           HA       SER  93  -3.256  -5.008 -18.558
  665    HB2  SER  93           2HB      SER  93  -5.321  -4.565 -19.568
  666    HB3  SER  93           1HB      SER  93  -5.601  -4.117 -17.886
  667    HG   SER  93           HG       SER  93  -6.370  -2.495 -19.246
  Start of MODEL   10
    1    H1   MET   1           1HT      MET   1 -21.285  21.513 -15.365
    2    H2   MET   1           2HT      MET   1 -19.963  20.738 -14.593
    3    H3   MET   1           3HT      MET   1 -20.566  22.225 -13.983
    4    HA   MET   1           HA       MET   1 -21.330  20.533 -12.596
    5    HB2  MET   1           2HB      MET   1 -22.859  22.420 -13.592
    6    HB3  MET   1           1HB      MET   1 -23.678  21.077 -14.375
    7    HG2  MET   1           2HG      MET   1 -24.144  20.066 -12.227
    8    HG3  MET   1           1HG      MET   1 -23.250  21.345 -11.410
    9    HE1  MET   1           2HE      MET   1 -25.476  24.381 -11.491
   10    HE2  MET   1           3HE      MET   1 -23.823  23.881 -11.850
   11    HE3  MET   1           1HE      MET   1 -24.583  23.389 -10.336
   12    H    GLY   2           H        GLY   2 -21.630  18.411 -12.296
   13    HA2  GLY   2           2HA      GLY   2 -22.584  16.792 -14.563
   14    HA3  GLY   2           1HA      GLY   2 -21.108  16.335 -13.726
   15    H    SER   3           H        SER   3 -24.313  17.440 -12.624
   16    HA   SER   3           HA       SER   3 -24.332  15.214 -10.716
   17    HB2  SER   3           2HB      SER   3 -26.404  16.602  -9.865
   18    HB3  SER   3           1HB      SER   3 -24.764  17.127  -9.486
   19    HG   SER   3           HG       SER   3 -26.673  18.336 -11.015
   20    H    SER   4           H        SER   4 -26.154  16.639 -13.359
   21    HA   SER   4           HA       SER   4 -28.485  15.095 -13.155
   22    HB2  SER   4           2HB      SER   4 -27.227  16.140 -15.702
   23    HB3  SER   4           1HB      SER   4 -28.925  15.733 -15.451
   24    HG   SER   4           HG       SER   4 -27.448  17.861 -14.308
   25    H    HIS   5           H        HIS   5 -28.944  13.039 -13.623
   26    HA   HIS   5           HA       HIS   5 -26.799  11.360 -14.680
   27    HB2  HIS   5           2HB      HIS   5 -28.396  10.949 -12.559
   28    HB3  HIS   5           1HB      HIS   5 -29.369  10.161 -13.795
   29    HD1  HIS   5           1HD      HIS   5 -26.943   9.344 -11.390
   30    HD2  HIS   5           2HD      HIS   5 -27.494   8.295 -15.373
   31    HE1  HIS   5           1HE      HIS   5 -25.628   7.226 -11.715
   32    HE2  HIS   5           2HE      HIS   5 -26.048   6.563 -14.109
   33    H    HIS   6           H        HIS   6 -26.938  11.927 -16.879
   34    HA   HIS   6           HA       HIS   6 -29.328  11.826 -18.385
   35    HB2  HIS   6           2HB      HIS   6 -27.765  11.711 -20.358
   36    HB3  HIS   6           1HB      HIS   6 -27.476  13.060 -19.264
   37    HD1  HIS   6           1HD      HIS   6 -26.172   9.482 -19.497
   38    HD2  HIS   6           2HD      HIS   6 -24.831  13.363 -18.863
   39    HE1  HIS   6           1HE      HIS   6 -23.683   9.292 -19.192
   40    HE2  HIS   6           2HE      HIS   6 -22.884  11.662 -18.896
   41    H    HIS   7           H        HIS   7 -29.959  10.271 -19.979
   42    HA   HIS   7           HA       HIS   7 -28.916   7.559 -19.532
   43    HB2  HIS   7           2HB      HIS   7 -31.328   6.769 -19.810
   44    HB3  HIS   7           1HB      HIS   7 -30.923   7.541 -18.280
   45    HD1  HIS   7           1HD      HIS   7 -32.159   9.667 -17.680
   46    HD2  HIS   7           2HD      HIS   7 -32.948   8.363 -21.546
   47    HE1  HIS   7           1HE      HIS   7 -34.072  11.083 -18.489
   48    HE2  HIS   7           2HE      HIS   7 -34.477  10.335 -20.860
   49    H    HIS   8           H        HIS   8 -27.735   7.978 -21.502
   50    HA   HIS   8           HA       HIS   8 -29.396   7.493 -23.875
   51    HB2  HIS   8           2HB      HIS   8 -27.430   9.682 -23.431
   52    HB3  HIS   8           1HB      HIS   8 -27.449   8.925 -25.020
   53    HD1  HIS   8           1HD      HIS   8 -29.908   8.929 -26.208
   54    HD2  HIS   8           2HD      HIS   8 -29.304  11.617 -23.098
   55    HE1  HIS   8           1HE      HIS   8 -31.725  10.651 -26.446
   56    HE2  HIS   8           2HE      HIS   8 -31.288  12.314 -24.603
   57    H    HIS   9           H        HIS   9 -27.860   5.694 -22.189
   58    HA   HIS   9           HA       HIS   9 -26.312   4.428 -24.278
   59    HB2  HIS   9           2HB      HIS   9 -24.894   6.077 -22.668
   60    HB3  HIS   9           1HB      HIS   9 -24.813   4.588 -21.732
   61    HD1  HIS   9           1HD      HIS   9 -22.169   5.131 -22.501
   62    HD2  HIS   9           2HD      HIS   9 -24.777   3.542 -25.319
   63    HE1  HIS   9           1HE      HIS   9 -20.704   4.133 -24.285
   64    HE2  HIS   9           2HE      HIS   9 -22.305   3.254 -26.020
   65    H    HIS  10           H        HIS  10 -25.082   2.445 -22.914
   66    HA   HIS  10           HA       HIS  10 -27.165   0.664 -22.334
   67    HB2  HIS  10           2HB      HIS  10 -24.545   0.358 -22.887
   68    HB3  HIS  10           1HB      HIS  10 -24.507   0.097 -21.145
   69    HD1  HIS  10           1HD      HIS  10 -27.087  -1.076 -23.683
   70    HD2  HIS  10           2HD      HIS  10 -24.388  -2.599 -20.915
   71    HE1  HIS  10           1HE      HIS  10 -27.476  -3.560 -23.661
   72    HE2  HIS  10           2HE      HIS  10 -25.892  -4.450 -21.917
   73    H    SER  11           H        SER  11 -24.820   2.170 -20.108
   74    HA   SER  11           HA       SER  11 -26.707   2.700 -18.097
   75    HB2  SER  11           2HB      SER  11 -25.985   1.003 -16.413
   76    HB3  SER  11           1HB      SER  11 -26.837   0.299 -17.789
   77    HG   SER  11           HG       SER  11 -24.374  -0.233 -16.901
   78    H    SER  12           H        SER  12 -23.449   1.312 -17.776
   79    HA   SER  12           HA       SER  12 -22.071   3.760 -17.649
   80    HB2  SER  12           2HB      SER  12 -23.231   2.751 -15.102
   81    HB3  SER  12           1HB      SER  12 -21.582   3.375 -15.046
   82    HG   SER  12           HG       SER  12 -23.729   4.801 -16.219
   83    H    GLY  13           H        GLY  13 -22.065   0.642 -15.906
   84    HA2  GLY  13           2HA      GLY  13 -20.575  -1.140 -16.515
   85    HA3  GLY  13           1HA      GLY  13 -19.464   0.062 -17.157
   86    H    LEU  14           H        LEU  14 -20.415  -1.755 -14.412
   87    HA   LEU  14           HA       LEU  14 -19.050  -0.220 -12.434
   88    HB2  LEU  14           2HB      LEU  14 -20.881  -2.166 -12.293
   89    HB3  LEU  14           1HB      LEU  14 -19.440  -3.137 -12.055
   90    HG   LEU  14           HG       LEU  14 -20.399  -2.502  -9.917
   91   HD11  LEU  14          1HD1      LEU  14 -17.971  -2.728 -10.079
   92   HD12  LEU  14          2HD1      LEU  14 -18.427  -1.509  -8.890
   93   HD13  LEU  14          3HD1      LEU  14 -17.836  -1.016 -10.477
   94   HD21  LEU  14          3HD2      LEU  14 -21.181  -0.214 -11.083
   95   HD22  LEU  14          1HD2      LEU  14 -19.742   0.357 -10.235
   96   HD23  LEU  14          2HD2      LEU  14 -21.046  -0.417  -9.336
   97    H    VAL  15           H        VAL  15 -18.231  -3.126 -14.298
   98    HA   VAL  15           HA       VAL  15 -16.237  -4.105 -14.795
   99    HB   VAL  15           HB       VAL  15 -14.944  -1.540 -13.866
  100   HG11  VAL  15          1HG1      VAL  15 -13.239  -3.082 -14.185
  101   HG12  VAL  15          2HG1      VAL  15 -13.330  -2.270 -15.748
  102   HG13  VAL  15          3HG1      VAL  15 -14.060  -3.861 -15.538
  103   HG21  VAL  15          3HG2      VAL  15 -16.679  -1.006 -15.475
  104   HG22  VAL  15          1HG2      VAL  15 -16.062  -2.234 -16.581
  105   HG23  VAL  15          2HG2      VAL  15 -15.089  -0.810 -16.213
  106    HA   PRO  16           HA       PRO  16 -15.771  -5.392 -10.384
  107    HB2  PRO  16           2HB      PRO  16 -15.037  -7.876 -11.843
  108    HB3  PRO  16           1HB      PRO  16 -16.125  -7.658 -10.468
  109    HG2  PRO  16           2HG      PRO  16 -17.090  -8.112 -12.910
  110    HG3  PRO  16           1HG      PRO  16 -17.893  -6.980 -11.807
  111    HD2  PRO  16           2HD      PRO  16 -16.144  -6.413 -14.163
  112    HD3  PRO  16           1HD      PRO  16 -17.597  -5.556 -13.601
  113    H    ARG  17           H        ARG  17 -13.846  -7.199  -9.769
  114    HA   ARG  17           HA       ARG  17 -11.613  -7.512  -9.460
  115    HB2  ARG  17           2HB      ARG  17 -11.125  -5.981 -12.009
  116    HB3  ARG  17           1HB      ARG  17 -10.089  -7.187 -11.256
  117    HG2  ARG  17           2HG      ARG  17 -11.799  -8.902 -11.730
  118    HG3  ARG  17           1HG      ARG  17 -12.757  -7.677 -12.565
  119    HD2  ARG  17           2HD      ARG  17 -11.294  -9.175 -14.006
  120    HD3  ARG  17           1HD      ARG  17 -11.161  -7.437 -14.272
  121    HE   ARG  17           HE       ARG  17  -9.144  -9.200 -13.149
  122   HH11  ARG  17          1HH1      ARG  17 -10.163  -5.911 -13.740
  123   HH12  ARG  17          2HH1      ARG  17  -8.571  -5.257 -13.564
  124   HH21  ARG  17          1HH2      ARG  17  -7.053  -8.337 -12.916
  125   HH22  ARG  17          2HH2      ARG  17  -6.806  -6.632 -13.098
  126    H    GLY  18           H        GLY  18 -11.764  -4.334 -11.082
  127    HA2  GLY  18           2HA      GLY  18  -9.860  -3.099  -9.445
  128    HA3  GLY  18           1HA      GLY  18 -11.075  -2.256 -10.393
  129    H    SER  19           H        SER  19  -9.895  -2.265  -7.464
  130    HA   SER  19           HA       SER  19 -12.335  -2.440  -5.914
  131    HB2  SER  19           2HB      SER  19 -10.228  -3.201  -4.917
  132    HB3  SER  19           1HB      SER  19  -9.542  -1.587  -5.107
  133    HG   SER  19           HG       SER  19 -10.302  -1.389  -3.138
  134    H    HIS  20           H        HIS  20 -13.087  -0.656  -4.574
  135    HA   HIS  20           HA       HIS  20 -12.761   1.923  -5.950
  136    HB2  HIS  20           2HB      HIS  20 -15.072   0.661  -4.513
  137    HB3  HIS  20           1HB      HIS  20 -14.982   2.412  -4.672
  138    HD1  HIS  20           1HD      HIS  20 -15.219   3.396  -7.072
  139    HD2  HIS  20           2HD      HIS  20 -15.726  -0.721  -6.836
  140    HE1  HIS  20           1HE      HIS  20 -16.245   2.718  -9.266
  141    HE2  HIS  20           2HE      HIS  20 -16.462   0.212  -9.134
  142    H    MET  21           H        MET  21 -12.999   0.403  -2.765
  143    HA   MET  21           HA       MET  21 -12.712   2.711  -1.206
  144    HB2  MET  21           2HB      MET  21 -11.798   1.080   0.529
  145    HB3  MET  21           1HB      MET  21 -13.412   0.759  -0.087
  146    HG2  MET  21           2HG      MET  21 -12.779  -1.130  -1.172
  147    HG3  MET  21           1HG      MET  21 -11.141  -0.547  -1.466
  148    HE1  MET  21           3HE      MET  21 -12.721  -0.132   1.955
  149    HE2  MET  21           1HE      MET  21 -12.281  -1.584   2.855
  150    HE3  MET  21           2HE      MET  21 -13.526  -1.663   1.608
  151    H    SER  22           H        SER  22 -11.125   4.130  -1.660
  152    HA   SER  22           HA       SER  22  -8.404   3.122  -1.990
  153    HB2  SER  22           2HB      SER  22  -8.939   4.547  -3.800
  154    HB3  SER  22           1HB      SER  22  -9.701   5.732  -2.737
  155    HG   SER  22           HG       SER  22  -7.791   6.639  -2.980
  156    H    ASP  23           H        ASP  23 -10.206   3.937   0.469
  157    HA   ASP  23           HA       ASP  23  -8.638   5.854   1.846
  158    HB2  ASP  23           2HB      ASP  23 -10.611   3.864   2.933
  159    HB3  ASP  23           1HB      ASP  23  -9.982   5.255   3.813
  160    H    GLU  24           H        GLU  24  -8.249   2.648   1.229
  161    HA   GLU  24           HA       GLU  24  -6.889   1.780   3.529
  162    HB2  GLU  24           2HB      GLU  24  -6.698   0.781   0.699
  163    HB3  GLU  24           1HB      GLU  24  -6.023  -0.053   2.092
  164    HG2  GLU  24           2HG      GLU  24  -8.279  -0.277   3.032
  165    HG3  GLU  24           1HG      GLU  24  -8.938   0.515   1.601
  166    H    LYS  25           H        LYS  25  -6.037   3.839   1.106
  167    HA   LYS  25           HA       LYS  25  -3.162   3.503   1.413
  168    HB2  LYS  25           2HB      LYS  25  -4.045   3.883  -0.841
  169    HB3  LYS  25           1HB      LYS  25  -4.750   5.407  -0.320
  170    HG2  LYS  25           2HG      LYS  25  -2.064   5.607   0.368
  171    HG3  LYS  25           1HG      LYS  25  -2.070   4.824  -1.213
  172    HD2  LYS  25           2HD      LYS  25  -2.840   6.668  -2.265
  173    HD3  LYS  25           1HD      LYS  25  -3.904   7.109  -0.929
  174    HE2  LYS  25           2HE      LYS  25  -2.426   8.779  -0.634
  175    HE3  LYS  25           1HE      LYS  25  -1.491   7.541   0.202
  176    HZ1  LYS  25           3HZ      LYS  25  -0.454   8.988  -1.710
  177    HZ2  LYS  25           1HZ      LYS  25  -1.146   7.797  -2.692
  178    HZ3  LYS  25           2HZ      LYS  25  -0.021   7.365  -1.505
  179    H    THR  26           H        THR  26  -5.746   5.543   2.484
  180    HA   THR  26           HA       THR  26  -4.213   7.787   3.244
  181    HB   THR  26           HB       THR  26  -6.452   7.563   4.974
  182    HG1  THR  26           1HG      THR  26  -7.101   6.994   2.277
  183   HG21  THR  26          3HG2      THR  26  -7.238   9.168   2.878
  184   HG22  THR  26          1HG2      THR  26  -5.478   9.319   2.883
  185   HG23  THR  26          2HG2      THR  26  -6.404   9.688   4.342
  186    H    GLN  27           H        GLN  27  -4.838   4.717   4.755
  187    HA   GLN  27           HA       GLN  27  -4.141   5.373   7.398
  188    HB2  GLN  27           2HB      GLN  27  -5.091   3.156   6.363
  189    HB3  GLN  27           1HB      GLN  27  -3.392   2.730   6.196
  190    HG2  GLN  27           2HG      GLN  27  -3.167   3.241   8.665
  191    HG3  GLN  27           1HG      GLN  27  -4.929   3.283   8.714
  192   HE21  GLN  27          1HE2      GLN  27  -2.201   1.247   7.771
  193   HE22  GLN  27          2HE2      GLN  27  -2.968  -0.258   8.130
  194    H    LEU  28           H        LEU  28  -2.291   5.008   4.523
  195    HA   LEU  28           HA       LEU  28   0.241   4.773   5.889
  196    HB2  LEU  28           2HB      LEU  28  -0.262   3.589   3.753
  197    HB3  LEU  28           1HB      LEU  28  -0.329   5.156   2.969
  198    HG   LEU  28           HG       LEU  28   2.167   4.827   4.402
  199   HD11  LEU  28          1HD1      LEU  28   2.207   2.546   4.071
  200   HD12  LEU  28          2HD1      LEU  28   2.995   3.137   2.609
  201   HD13  LEU  28          3HD1      LEU  28   1.304   2.641   2.560
  202   HD21  LEU  28          3HD2      LEU  28   2.932   5.137   1.911
  203   HD22  LEU  28          1HD2      LEU  28   2.207   6.471   2.807
  204   HD23  LEU  28          2HD2      LEU  28   1.233   5.543   1.666
  205    H    ILE  29           H        ILE  29  -1.796   7.164   4.990
  206    HA   ILE  29           HA       ILE  29  -0.074   9.220   4.197
  207    HB   ILE  29           HB       ILE  29  -2.760   9.357   5.494
  208   HG12  ILE  29          2HG1      ILE  29  -2.471   8.254   3.216
  209   HG13  ILE  29          1HG1      ILE  29  -3.686   9.522   3.348
  210   HG21  ILE  29          1HG2      ILE  29  -1.005  11.530   4.426
  211   HG22  ILE  29          2HG2      ILE  29  -1.966  11.491   5.906
  212   HG23  ILE  29          3HG2      ILE  29  -2.759  11.692   4.344
  213   HD11  ILE  29          3HD1      ILE  29  -1.175  10.644   2.574
  214   HD12  ILE  29          1HD1      ILE  29  -2.731  10.662   1.739
  215   HD13  ILE  29          2HD1      ILE  29  -1.619   9.314   1.501
  216    H    GLU  30           H        GLU  30  -0.532   7.804   7.062
  217    HA   GLU  30           HA       GLU  30   0.126   9.982   8.777
  218    HB2  GLU  30           2HB      GLU  30  -1.245   7.939   9.443
  219    HB3  GLU  30           1HB      GLU  30   0.286   7.079   9.534
  220    HG2  GLU  30           2HG      GLU  30   0.858   9.216  11.061
  221    HG3  GLU  30           1HG      GLU  30  -0.876   9.080  11.349
  222    H    ALA  31           H        ALA  31   1.897   8.507   6.635
  223    HA   ALA  31           HA       ALA  31   4.346   8.261   8.202
  224    HB1  ALA  31           1HB      ALA  31   3.470   7.353   5.521
  225    HB2  ALA  31           2HB      ALA  31   4.393   6.505   6.763
  226    HB3  ALA  31           3HB      ALA  31   5.187   7.698   5.736
  227    H    PHE  32           H        PHE  32   2.837  10.330   5.829
  228    HA   PHE  32           HA       PHE  32   5.045  11.776   4.935
  229    HB2  PHE  32           2HB      PHE  32   2.135  12.458   5.246
  230    HB3  PHE  32           1HB      PHE  32   3.283  13.669   4.686
  231    HD1  PHE  32           2HD      PHE  32   4.889  12.765   2.747
  232    HD2  PHE  32           1HD      PHE  32   1.013  11.261   3.652
  233    HE1  PHE  32           2HE      PHE  32   4.700  11.886   0.456
  234    HE2  PHE  32           1HE      PHE  32   0.815  10.380   1.363
  235    HZ   PHE  32           HZ       PHE  32   2.661  10.692  -0.238
  236    H    TYR  33           H        TYR  33   3.426  11.836   7.991
  237    HA   TYR  33           HA       TYR  33   4.730  14.340   8.756
  238    HB2  TYR  33           2HB      TYR  33   2.881  12.677  10.461
  239    HB3  TYR  33           1HB      TYR  33   3.298  14.375  10.657
  240    HD1  TYR  33           1HD      TYR  33   1.435  11.985   8.531
  241    HD2  TYR  33           2HD      TYR  33   2.074  16.068   9.540
  242    HE1  TYR  33           1HE      TYR  33  -0.544  12.614   7.215
  243    HE2  TYR  33           2HE      TYR  33   0.096  16.708   8.227
  244    HH   TYR  33           HH       TYR  33  -2.095  15.477   7.478
  245    H    ASN  34           H        ASN  34   6.259  11.892   8.293
  246    HA   ASN  34           HA       ASN  34   7.963  12.011  10.537
  247    HB2  ASN  34           2HB      ASN  34   5.975  10.585  11.367
  248    HB3  ASN  34           1HB      ASN  34   6.609   9.332  10.305
  249   HD21  ASN  34          1HD2      ASN  34   8.072  11.698  12.509
  250   HD22  ASN  34          2HD2      ASN  34   9.006  10.547  13.396
  251    H    PHE  35           H        PHE  35   8.127  12.183   7.690
  252    HA   PHE  35           HA       PHE  35  10.462  10.701   7.221
  253    HB2  PHE  35           2HB      PHE  35   8.773   8.837   7.083
  254    HB3  PHE  35           1HB      PHE  35   8.085   9.646   5.680
  255    HD1  PHE  35           1HD      PHE  35  11.386   8.442   6.930
  256    HD2  PHE  35           2HD      PHE  35   8.794   8.990   3.599
  257    HE1  PHE  35           1HE      PHE  35  13.014   7.301   5.481
  258    HE2  PHE  35           2HE      PHE  35  10.418   7.850   2.143
  259    HZ   PHE  35           HZ       PHE  35  12.530   7.002   3.084
  260    H    ASP  36           H        ASP  36  10.852  12.965   6.706
  261    HA   ASP  36           HA       ASP  36   9.796  13.801   4.096
  262    HB2  ASP  36           2HB      ASP  36   9.879  15.235   6.376
  263    HB3  ASP  36           1HB      ASP  36  11.446  15.672   5.700
  264    H    GLY  37           H        GLY  37  11.711  11.778   4.088
  265    HA2  GLY  37           2HA      GLY  37  14.285  13.018   3.525
  266    HA3  GLY  37           1HA      GLY  37  13.933  11.297   3.514
  267    H    ASP  38           H        ASP  38  12.843  10.400   1.674
  268    HA   ASP  38           HA       ASP  38  12.865  10.010  -0.580
  269    HB2  ASP  38           2HB      ASP  38  11.474  11.552  -1.853
  270    HB3  ASP  38           1HB      ASP  38  10.778  11.289  -0.257
  271    H    TYR  39           H        TYR  39  15.312  11.191   0.438
  272    HA   TYR  39           HA       TYR  39  16.362  13.248  -1.064
  273    HB2  TYR  39           2HB      TYR  39  18.590  11.816  -0.774
  274    HB3  TYR  39           1HB      TYR  39  17.835  12.652   0.574
  275    HD1  TYR  39           2HD      TYR  39  16.518   9.524  -0.903
  276    HD2  TYR  39           1HD      TYR  39  18.709  11.266   2.302
  277    HE1  TYR  39           2HE      TYR  39  16.383   7.405   0.335
  278    HE2  TYR  39           1HE      TYR  39  18.579   9.151   3.547
  279    HH   TYR  39           HH       TYR  39  16.479   6.736   2.859
  280    H    ASP  40           H        ASP  40  18.051  10.313  -1.869
  281    HA   ASP  40           HA       ASP  40  18.173  10.952  -4.597
  282    HB2  ASP  40           2HB      ASP  40  19.721   9.435  -3.191
  283    HB3  ASP  40           1HB      ASP  40  18.558   8.161  -3.545
  284    H    GLY  41           H        GLY  41  15.884   9.092  -2.749
  285    HA2  GLY  41           2HA      GLY  41  13.654   8.800  -3.610
  286    HA3  GLY  41           1HA      GLY  41  14.341   8.664  -5.221
  287    H    PHE  42           H        PHE  42  15.832   7.024  -2.550
  288    HA   PHE  42           HA       PHE  42  14.508   4.509  -3.222
  289    HB2  PHE  42           2HB      PHE  42  17.461   5.035  -3.515
  290    HB3  PHE  42           1HB      PHE  42  16.823   3.409  -3.290
  291    HD1  PHE  42           2HD      PHE  42  16.797   6.348  -5.524
  292    HD2  PHE  42           1HD      PHE  42  15.837   2.227  -5.074
  293    HE1  PHE  42           2HE      PHE  42  16.380   6.185  -7.943
  294    HE2  PHE  42           1HE      PHE  42  15.418   2.055  -7.493
  295    HZ   PHE  42           HZ       PHE  42  15.690   4.036  -8.930
  296    H    VAL  43           H        VAL  43  13.985   3.474  -1.420
  297    HA   VAL  43           HA       VAL  43  15.559   4.013   1.015
  298    HB   VAL  43           HB       VAL  43  13.285   4.916   1.173
  299   HG11  VAL  43          1HG1      VAL  43  12.265   3.274  -0.407
  300   HG12  VAL  43          2HG1      VAL  43  11.334   3.541   1.066
  301   HG13  VAL  43          3HG1      VAL  43  12.306   2.080   0.893
  302   HG21  VAL  43          3HG2      VAL  43  14.427   4.013   3.177
  303   HG22  VAL  43          1HG2      VAL  43  13.610   2.471   2.912
  304   HG23  VAL  43          2HG2      VAL  43  12.668   3.917   3.280
  305    H    SER  44           H        SER  44  16.628   2.336   1.809
  306    HA   SER  44           HA       SER  44  16.296  -0.290   0.723
  307    HB2  SER  44           2HB      SER  44  17.932  -0.650   2.881
  308    HB3  SER  44           1HB      SER  44  18.485  -0.138   1.287
  309    HG   SER  44           HG       SER  44  18.703   1.882   1.986
  310    H    VAL  45           H        VAL  45  15.796  -2.207   1.915
  311    HA   VAL  45           HA       VAL  45  13.454  -2.053   3.433
  312    HB   VAL  45           HB       VAL  45  15.439  -4.332   3.375
  313   HG11  VAL  45          1HG1      VAL  45  13.714  -5.738   4.131
  314   HG12  VAL  45          2HG1      VAL  45  12.483  -4.500   3.881
  315   HG13  VAL  45          3HG1      VAL  45  13.660  -4.326   5.183
  316   HG21  VAL  45          3HG2      VAL  45  14.288  -5.208   1.511
  317   HG22  VAL  45          1HG2      VAL  45  14.573  -3.510   1.139
  318   HG23  VAL  45          2HG2      VAL  45  12.978  -4.039   1.671
  319    H    GLU  46           H        GLU  46  16.769  -2.809   4.492
  320    HA   GLU  46           HA       GLU  46  16.356  -3.125   7.188
  321    HB2  GLU  46           2HB      GLU  46  18.722  -1.624   6.077
  322    HB3  GLU  46           1HB      GLU  46  18.663  -2.642   7.509
  323    HG2  GLU  46           2HG      GLU  46  18.107  -4.551   5.905
  324    HG3  GLU  46           1HG      GLU  46  18.642  -3.460   4.628
  325    H    GLU  47           H        GLU  47  16.454  -0.155   5.341
  326    HA   GLU  47           HA       GLU  47  16.375   1.510   7.716
  327    HB2  GLU  47           2HB      GLU  47  17.480   2.016   5.378
  328    HB3  GLU  47           1HB      GLU  47  15.859   2.555   4.959
  329    HG2  GLU  47           2HG      GLU  47  15.993   3.995   7.066
  330    HG3  GLU  47           1HG      GLU  47  17.723   3.658   7.027
  331    H    PHE  48           H        PHE  48  14.205   0.171   5.353
  332    HA   PHE  48           HA       PHE  48  11.986   1.867   5.861
  333    HB2  PHE  48           2HB      PHE  48  12.594  -0.164   4.056
  334    HB3  PHE  48           1HB      PHE  48  11.274  -0.828   5.011
  335    HD1  PHE  48           1HD      PHE  48   9.748   1.666   5.574
  336    HD2  PHE  48           2HD      PHE  48  11.589   0.256   2.005
  337    HE1  PHE  48           1HE      PHE  48   8.135   2.958   4.237
  338    HE2  PHE  48           2HE      PHE  48   9.982   1.547   0.662
  339    HZ   PHE  48           HZ       PHE  48   8.252   2.899   1.777
  340    H    ARG  49           H        ARG  49  13.010  -1.269   7.145
  341    HA   ARG  49           HA       ARG  49  10.758  -1.886   8.656
  342    HB2  ARG  49           2HB      ARG  49  13.638  -2.470   9.374
  343    HB3  ARG  49           1HB      ARG  49  12.223  -3.313   9.988
  344    HG2  ARG  49           2HG      ARG  49  11.885  -4.464   8.039
  345    HG3  ARG  49           1HG      ARG  49  12.667  -3.229   7.048
  346    HD2  ARG  49           2HD      ARG  49  14.372  -4.698   7.001
  347    HD3  ARG  49           1HD      ARG  49  14.744  -4.021   8.585
  348    HE   ARG  49           HE       ARG  49  12.926  -6.140   8.893
  349   HH11  ARG  49          1HH1      ARG  49  16.259  -5.569   8.030
  350   HH12  ARG  49          2HH1      ARG  49  16.800  -7.111   8.600
  351   HH21  ARG  49          1HH2      ARG  49  13.637  -8.169   9.643
  352   HH22  ARG  49          2HH2      ARG  49  15.313  -8.588   9.515
  353    H    GLY  50           H        GLY  50  13.702  -0.155   9.691
  354    HA2  GLY  50           2HA      GLY  50  12.971   0.377  12.313
  355    HA3  GLY  50           1HA      GLY  50  14.023   1.403  11.349
  356    H    ILE  51           H        ILE  51  11.781   1.806   9.387
  357    HA   ILE  51           HA       ILE  51  10.560   4.044  10.791
  358    HB   ILE  51           HB       ILE  51  10.272   3.279   7.884
  359   HG12  ILE  51          2HG1      ILE  51  12.056   5.480   8.853
  360   HG13  ILE  51          1HG1      ILE  51  12.647   3.822   8.875
  361   HG21  ILE  51          1HG2      ILE  51   9.095   5.173   7.574
  362   HG22  ILE  51          2HG2      ILE  51  10.039   6.080   8.754
  363   HG23  ILE  51          3HG2      ILE  51   8.749   5.004   9.295
  364   HD11  ILE  51          3HD1      ILE  51  13.366   4.413   6.821
  365   HD12  ILE  51          1HD1      ILE  51  12.091   5.612   6.595
  366   HD13  ILE  51          2HD1      ILE  51  11.739   3.897   6.376
  367    H    ILE  52           H        ILE  52   9.544   1.188   8.937
  368    HA   ILE  52           HA       ILE  52   6.766   1.579   9.288
  369    HB   ILE  52           HB       ILE  52   8.281  -0.978   8.740
  370   HG12  ILE  52          2HG1      ILE  52   8.600   0.831   7.063
  371   HG13  ILE  52          1HG1      ILE  52   7.763  -0.574   6.408
  372   HG21  ILE  52          1HG2      ILE  52   6.132  -1.582   9.544
  373   HG22  ILE  52          2HG2      ILE  52   6.072  -1.720   7.787
  374   HG23  ILE  52          3HG2      ILE  52   5.346  -0.327   8.587
  375   HD11  ILE  52          3HD1      ILE  52   5.708   1.028   7.280
  376   HD12  ILE  52          1HD1      ILE  52   6.280   0.875   5.619
  377   HD13  ILE  52          2HD1      ILE  52   6.883   2.178   6.642
  378    H    ARG  53           H        ARG  53   9.230   0.146  11.289
  379    HA   ARG  53           HA       ARG  53   7.793  -1.528  12.937
  380    HB2  ARG  53           2HB      ARG  53  10.342  -0.655  12.914
  381    HB3  ARG  53           1HB      ARG  53   9.734   0.256  14.290
  382    HG2  ARG  53           2HG      ARG  53   9.514  -1.579  15.586
  383    HG3  ARG  53           1HG      ARG  53   9.075  -2.620  14.230
  384    HD2  ARG  53           2HD      ARG  53  11.648  -2.022  13.616
  385    HD3  ARG  53           1HD      ARG  53  11.714  -2.014  15.378
  386    HE   ARG  53           HE       ARG  53  11.451  -4.286  15.363
  387   HH11  ARG  53          1HH1      ARG  53  10.570  -3.033  12.227
  388   HH12  ARG  53          2HH1      ARG  53  10.414  -4.600  11.506
  389   HH21  ARG  53          1HH2      ARG  53  11.247  -6.347  14.416
  390   HH22  ARG  53          2HH2      ARG  53  10.799  -6.482  12.749
  391    H    ASP  54           H        ASP  54   8.487   1.898  13.660
  392    HA   ASP  54           HA       ASP  54   6.045   1.943  15.304
  393    HB2  ASP  54           2HB      ASP  54   8.371   2.389  16.350
  394    HB3  ASP  54           1HB      ASP  54   8.272   3.950  15.539
  395    H    GLY  55           H        GLY  55   6.646   2.572  12.304
  396    HA2  GLY  55           2HA      GLY  55   5.714   5.350  12.240
  397    HA3  GLY  55           1HA      GLY  55   6.331   4.438  10.872
  398    H    LEU  56           H        LEU  56   4.959   2.904   9.844
  399    HA   LEU  56           HA       LEU  56   2.123   3.578  10.157
  400    HB2  LEU  56           2HB      LEU  56   3.422   2.104   7.871
  401    HB3  LEU  56           1HB      LEU  56   1.814   2.800   7.909
  402    HG   LEU  56           HG       LEU  56   4.279   4.504   8.164
  403   HD11  LEU  56          1HD1      LEU  56   3.002   3.361   5.721
  404   HD12  LEU  56          2HD1      LEU  56   4.710   3.590   6.096
  405   HD13  LEU  56          3HD1      LEU  56   3.708   4.977   5.669
  406   HD21  LEU  56          3HD2      LEU  56   1.675   5.105   8.595
  407   HD22  LEU  56          1HD2      LEU  56   1.824   5.484   6.879
  408   HD23  LEU  56          2HD2      LEU  56   2.885   6.265   8.050
  409    HA   PRO  57           HA       PRO  57   1.319  -0.466  11.788
  410    HB2  PRO  57           2HB      PRO  57  -1.353  -0.552  11.496
  411    HB3  PRO  57           1HB      PRO  57  -0.578   0.519  12.669
  412    HG2  PRO  57           2HG      PRO  57  -1.653   1.153   9.948
  413    HG3  PRO  57           1HG      PRO  57  -1.810   2.074  11.454
  414    HD2  PRO  57           2HD      PRO  57   0.007   2.668   9.501
  415    HD3  PRO  57           1HD      PRO  57   0.253   3.046  11.217
  416    H    MET  58           H        MET  58   2.003  -2.166  10.653
  417    HA   MET  58           HA       MET  58   0.305  -3.225   8.559
  418    HB2  MET  58           2HB      MET  58   2.637  -1.742   7.911
  419    HB3  MET  58           1HB      MET  58   2.985  -3.432   7.572
  420    HG2  MET  58           2HG      MET  58   1.180  -3.595   6.057
  421    HG3  MET  58           1HG      MET  58   0.521  -2.043   6.567
  422    HE1  MET  58           3HE      MET  58   2.082  -3.698   3.725
  423    HE2  MET  58           1HE      MET  58   3.500  -3.845   4.764
  424    HE3  MET  58           2HE      MET  58   3.564  -2.830   3.324
  425    H    THR  59           H        THR  59   0.347  -5.410   8.473
  426    HA   THR  59           HA       THR  59   1.727  -6.800  10.577
  427    HB   THR  59           HB       THR  59   0.634  -8.764   8.996
  428    HG1  THR  59           1HG      THR  59  -1.391  -7.908   8.345
  429   HG21  THR  59          3HG2      THR  59  -1.369  -8.621  10.457
  430   HG22  THR  59          1HG2      THR  59  -0.707  -7.133  11.133
  431   HG23  THR  59          2HG2      THR  59   0.167  -8.654  11.325
  432    H    GLU  60           H        GLU  60   3.288  -8.423  10.354
  433    HA   GLU  60           HA       GLU  60   5.467  -8.056   8.811
  434    HB2  GLU  60           2HB      GLU  60   5.794 -10.607   8.961
  435    HB3  GLU  60           1HB      GLU  60   5.676  -9.702  10.462
  436    HG2  GLU  60           2HG      GLU  60   3.190 -10.316  10.409
  437    HG3  GLU  60           1HG      GLU  60   3.646 -11.495   9.182
  438    H    ALA  61           H        ALA  61   2.803 -10.207   7.958
  439    HA   ALA  61           HA       ALA  61   3.620 -11.174   5.544
  440    HB1  ALA  61           1HB      ALA  61   1.566 -12.024   5.499
  441    HB2  ALA  61           2HB      ALA  61   0.836 -10.422   5.398
  442    HB3  ALA  61           3HB      ALA  61   1.234 -11.112   6.971
  443    H    GLU  62           H        GLU  62   1.774  -8.153   6.029
  444    HA   GLU  62           HA       GLU  62   1.730  -7.328   3.368
  445    HB2  GLU  62           2HB      GLU  62   2.135  -5.174   5.359
  446    HB3  GLU  62           1HB      GLU  62   0.910  -5.335   4.112
  447    HG2  GLU  62           2HG      GLU  62   0.951  -6.601   6.828
  448    HG3  GLU  62           1HG      GLU  62  -0.176  -5.395   6.213
  449    H    ILE  63           H        ILE  63   3.954  -6.183   5.895
  450    HA   ILE  63           HA       ILE  63   5.732  -4.843   4.189
  451    HB   ILE  63           HB       ILE  63   6.656  -6.197   6.708
  452   HG12  ILE  63          2HG1      ILE  63   5.855  -3.675   7.487
  453   HG13  ILE  63          1HG1      ILE  63   4.552  -4.184   6.416
  454   HG21  ILE  63          1HG2      ILE  63   8.049  -4.722   4.995
  455   HG22  ILE  63          2HG2      ILE  63   8.334  -4.661   6.735
  456   HG23  ILE  63          3HG2      ILE  63   7.358  -3.415   5.957
  457   HD11  ILE  63          3HD1      ILE  63   5.267  -5.121   9.082
  458   HD12  ILE  63          1HD1      ILE  63   4.931  -6.410   7.925
  459   HD13  ILE  63          2HD1      ILE  63   3.724  -5.163   8.230
  460    H    THR  64           H        THR  64   6.256  -7.988   5.762
  461    HA   THR  64           HA       THR  64   8.567  -8.736   4.462
  462    HB   THR  64           HB       THR  64   6.277 -10.439   5.422
  463    HG1  THR  64           1HG      THR  64   7.233  -9.287   7.078
  464   HG21  THR  64          3HG2      THR  64   9.072 -11.273   4.708
  465   HG22  THR  64          1HG2      THR  64   7.568 -11.819   3.968
  466   HG23  THR  64          2HG2      THR  64   7.938 -12.253   5.637
  467    H    GLU  65           H        GLU  65   5.219  -9.527   3.512
  468    HA   GLU  65           HA       GLU  65   5.978 -10.851   1.141
  469    HB2  GLU  65           2HB      GLU  65   3.739 -11.039   2.324
  470    HB3  GLU  65           1HB      GLU  65   3.337  -9.496   1.581
  471    HG2  GLU  65           2HG      GLU  65   4.047 -10.778  -0.618
  472    HG3  GLU  65           1HG      GLU  65   3.611 -12.182   0.356
  473    H    PHE  66           H        PHE  66   5.906  -7.680   1.989
  474    HA   PHE  66           HA       PHE  66   5.714  -6.707  -0.738
  475    HB2  PHE  66           2HB      PHE  66   5.583  -5.392   1.945
  476    HB3  PHE  66           1HB      PHE  66   6.066  -4.433   0.553
  477    HD1  PHE  66           2HD      PHE  66   3.651  -7.188   0.296
  478    HD2  PHE  66           1HD      PHE  66   4.173  -2.977   0.631
  479    HE1  PHE  66           2HE      PHE  66   1.289  -6.851  -0.301
  480    HE2  PHE  66           1HE      PHE  66   1.810  -2.634   0.038
  481    HZ   PHE  66           HZ       PHE  66   0.366  -4.573  -0.431
  482    H    PHE  67           H        PHE  67   7.999  -7.350   1.772
  483    HA   PHE  67           HA       PHE  67  10.118  -5.752   0.649
  484    HB2  PHE  67           2HB      PHE  67   9.898  -7.726   2.893
  485    HB3  PHE  67           1HB      PHE  67  11.487  -7.254   2.306
  486    HD1  PHE  67           2HD      PHE  67  10.120  -4.332   1.681
  487    HD2  PHE  67           1HD      PHE  67  10.691  -6.836   5.079
  488    HE1  PHE  67           2HE      PHE  67  10.052  -2.360   3.143
  489    HE2  PHE  67           1HE      PHE  67  10.625  -4.862   6.545
  490    HZ   PHE  67           HZ       PHE  67  10.307  -2.621   5.578
  491    H    GLU  68           H        GLU  68   8.926  -8.985   0.280
  492    HA   GLU  68           HA       GLU  68  11.328  -9.865  -1.112
  493    HB2  GLU  68           2HB      GLU  68   8.751 -11.390  -0.726
  494    HB3  GLU  68           1HB      GLU  68  10.324 -12.044  -1.158
  495    HG2  GLU  68           2HG      GLU  68  10.895 -10.826   1.196
  496    HG3  GLU  68           1HG      GLU  68   9.227 -11.332   1.463
  497    H    ALA  69           H        ALA  69   8.114  -8.728  -1.781
  498    HA   ALA  69           HA       ALA  69   8.241  -9.524  -4.560
  499    HB1  ALA  69           1HB      ALA  69   6.136  -7.937  -3.136
  500    HB2  ALA  69           2HB      ALA  69   6.121  -9.692  -3.324
  501    HB3  ALA  69           3HB      ALA  69   5.993  -8.649  -4.743
  502    H    ALA  70           H        ALA  70   9.226  -7.004  -2.729
  503    HA   ALA  70           HA       ALA  70   8.970  -4.961  -4.785
  504    HB1  ALA  70           1HB      ALA  70  10.136  -4.837  -2.006
  505    HB2  ALA  70           2HB      ALA  70   8.552  -4.252  -2.521
  506    HB3  ALA  70           3HB      ALA  70  10.016  -3.466  -3.112
  507    H    ASP  71           H        ASP  71  11.357  -7.108  -3.444
  508    HA   ASP  71           HA       ASP  71  13.327  -6.031  -5.348
  509    HB2  ASP  71           2HB      ASP  71  13.648  -5.767  -2.699
  510    HB3  ASP  71           1HB      ASP  71  14.316  -7.385  -2.893
  511    HA   PRO  72           HA       PRO  72  12.981 -10.247  -6.860
  512    HB2  PRO  72           2HB      PRO  72  14.922 -10.024  -8.772
  513    HB3  PRO  72           1HB      PRO  72  13.267  -9.445  -8.986
  514    HG2  PRO  72           2HG      PRO  72  15.727  -7.915  -8.233
  515    HG3  PRO  72           1HG      PRO  72  14.434  -7.471  -9.363
  516    HD2  PRO  72           2HD      PRO  72  14.553  -6.467  -6.867
  517    HD3  PRO  72           1HD      PRO  72  13.006  -6.813  -7.667
  518    H    ASN  73           H        ASN  73  16.046  -8.677  -6.064
  519    HA   ASN  73           HA       ASN  73  17.437 -11.191  -5.768
  520    HB2  ASN  73           2HB      ASN  73  18.267  -8.357  -5.109
  521    HB3  ASN  73           1HB      ASN  73  19.323  -9.762  -4.996
  522   HD21  ASN  73          1HD2      ASN  73  20.451  -8.135  -6.502
  523   HD22  ASN  73          2HD2      ASN  73  20.190  -8.387  -8.191
  524    H    ASN  74           H        ASN  74  15.828  -8.863  -3.728
  525    HA   ASN  74           HA       ASN  74  15.116  -8.988  -1.570
  526    HB2  ASN  74           2HB      ASN  74  16.365 -11.727  -1.365
  527    HB3  ASN  74           1HB      ASN  74  15.049 -11.058  -0.405
  528   HD21  ASN  74          1HD2      ASN  74  13.142 -10.317  -1.825
  529   HD22  ASN  74          2HD2      ASN  74  12.633 -11.450  -3.027
  530    H    THR  75           H        THR  75  17.550  -7.821  -2.292
  531    HA   THR  75           HA       THR  75  19.469  -8.558  -0.244
  532    HB   THR  75           HB       THR  75  20.483  -8.034  -2.308
  533    HG1  THR  75           1HG      THR  75  21.872  -6.954  -1.186
  534   HG21  THR  75          3HG2      THR  75  18.610  -5.722  -2.400
  535   HG22  THR  75          1HG2      THR  75  18.987  -6.919  -3.640
  536   HG23  THR  75          2HG2      THR  75  20.149  -5.647  -3.258
  537    H    GLY  76           H        GLY  76  17.059  -7.703   0.825
  538    HA2  GLY  76           2HA      GLY  76  16.131  -6.213   2.293
  539    HA3  GLY  76           1HA      GLY  76  17.795  -5.887   2.756
  540    H    PHE  77           H        PHE  77  16.728  -5.241  -0.486
  541    HA   PHE  77           HA       PHE  77  16.672  -2.361   0.134
  542    HB2  PHE  77           2HB      PHE  77  18.296  -3.858  -1.793
  543    HB3  PHE  77           1HB      PHE  77  17.449  -2.492  -2.509
  544    HD1  PHE  77           1HD      PHE  77  19.997  -3.524  -0.101
  545    HD2  PHE  77           2HD      PHE  77  17.985  -0.227  -1.888
  546    HE1  PHE  77           1HE      PHE  77  21.721  -2.002   0.776
  547    HE2  PHE  77           2HE      PHE  77  19.706   1.302  -1.015
  548    HZ   PHE  77           HZ       PHE  77  21.577   0.415   0.318
  549    H    ILE  78           H        ILE  78  15.209  -1.084  -1.009
  550    HA   ILE  78           HA       ILE  78  13.196  -2.567  -2.579
  551    HB   ILE  78           HB       ILE  78  12.740  -0.292  -0.642
  552   HG12  ILE  78          2HG1      ILE  78  11.728  -3.138  -0.664
  553   HG13  ILE  78          1HG1      ILE  78  12.937  -2.475   0.439
  554   HG21  ILE  78          1HG2      ILE  78  10.792  -1.622  -2.519
  555   HG22  ILE  78          2HG2      ILE  78  11.338   0.054  -2.578
  556   HG23  ILE  78          3HG2      ILE  78  10.351  -0.504  -1.229
  557   HD11  ILE  78          3HD1      ILE  78  10.543  -0.886   0.485
  558   HD12  ILE  78          1HD1      ILE  78  11.354  -1.736   1.802
  559   HD13  ILE  78          2HD1      ILE  78  10.176  -2.584   0.800
  560    H    ASP  79           H        ASP  79  12.131  -1.424  -4.221
  561    HA   ASP  79           HA       ASP  79  13.677   0.818  -5.309
  562    HB2  ASP  79           2HB      ASP  79  12.718  -1.464  -6.543
  563    HB3  ASP  79           1HB      ASP  79  11.496  -0.265  -6.957
  564    H    TYR  80           H        TYR  80  12.892   2.530  -4.164
  565    HA   TYR  80           HA       TYR  80  10.632   3.159  -3.000
  566    HB2  TYR  80           2HB      TYR  80  12.540   4.733  -3.423
  567    HB3  TYR  80           1HB      TYR  80  11.832   5.087  -4.996
  568    HD1  TYR  80           2HD      TYR  80   9.739   6.348  -5.161
  569    HD2  TYR  80           1HD      TYR  80  11.567   5.601  -1.393
  570    HE1  TYR  80           2HE      TYR  80   8.329   8.085  -4.141
  571    HE2  TYR  80           1HE      TYR  80  10.162   7.336  -0.361
  572    HH   TYR  80           HH       TYR  80   7.519   8.413  -1.384
  573    H    LYS  81           H        LYS  81  10.924   3.175  -6.535
  574    HA   LYS  81           HA       LYS  81   8.321   4.156  -7.038
  575    HB2  LYS  81           2HB      LYS  81  10.258   2.559  -8.710
  576    HB3  LYS  81           1HB      LYS  81   8.684   3.056  -9.319
  577    HG2  LYS  81           2HG      LYS  81   9.828   4.836 -10.063
  578    HG3  LYS  81           1HG      LYS  81   9.609   5.417  -8.410
  579    HD2  LYS  81           2HD      LYS  81  11.787   4.708  -7.782
  580    HD3  LYS  81           1HD      LYS  81  11.992   3.792  -9.278
  581    HE2  LYS  81           2HE      LYS  81  11.745   6.792  -9.066
  582    HE3  LYS  81           1HE      LYS  81  13.245   5.900  -9.317
  583    HZ1  LYS  81           3HZ      LYS  81  10.938   6.107 -11.167
  584    HZ2  LYS  81           1HZ      LYS  81  12.200   5.001 -11.384
  585    HZ3  LYS  81           2HZ      LYS  81  12.516   6.663 -11.418
  586    H    ALA  82           H        ALA  82   9.607   0.828  -7.210
  587    HA   ALA  82           HA       ALA  82   7.230  -0.502  -7.715
  588    HB1  ALA  82           1HB      ALA  82   9.804  -1.273  -7.263
  589    HB2  ALA  82           2HB      ALA  82   8.439  -2.377  -7.428
  590    HB3  ALA  82           3HB      ALA  82   8.992  -1.892  -5.824
  591    H    PHE  83           H        PHE  83   8.381   0.959  -4.795
  592    HA   PHE  83           HA       PHE  83   6.344  -0.307  -3.150
  593    HB2  PHE  83           2HB      PHE  83   8.899   0.815  -2.675
  594    HB3  PHE  83           1HB      PHE  83   7.736   1.807  -1.797
  595    HD1  PHE  83           1HD      PHE  83   8.306  -1.819  -2.470
  596    HD2  PHE  83           2HD      PHE  83   7.383   1.198   0.385
  597    HE1  PHE  83           1HE      PHE  83   8.211  -3.525  -0.706
  598    HE2  PHE  83           2HE      PHE  83   7.289  -0.504   2.159
  599    HZ   PHE  83           HZ       PHE  83   7.703  -2.872   1.616
  600    H    ALA  84           H        ALA  84   7.021   2.734  -4.723
  601    HA   ALA  84           HA       ALA  84   4.919   4.166  -3.363
  602    HB1  ALA  84           1HB      ALA  84   5.528   6.033  -4.724
  603    HB2  ALA  84           2HB      ALA  84   6.426   4.999  -5.834
  604    HB3  ALA  84           3HB      ALA  84   7.012   5.245  -4.190
  605    H    ALA  85           H        ALA  85   5.231   2.247  -6.228
  606    HA   ALA  85           HA       ALA  85   2.965   3.277  -7.585
  607    HB1  ALA  85           1HB      ALA  85   3.215   1.406  -9.091
  608    HB2  ALA  85           2HB      ALA  85   4.293   0.612  -7.942
  609    HB3  ALA  85           3HB      ALA  85   4.797   2.103  -8.739
  610    H    MET  86           H        MET  86   3.281   1.394  -4.930
  611    HA   MET  86           HA       MET  86   0.947  -0.253  -5.251
  612    HB2  MET  86           2HB      MET  86   2.549   0.349  -2.758
  613    HB3  MET  86           1HB      MET  86   1.344  -0.920  -2.925
  614    HG2  MET  86           2HG      MET  86   2.732  -1.993  -4.637
  615    HG3  MET  86           1HG      MET  86   3.948  -0.736  -4.423
  616    HE1  MET  86           3HE      MET  86   3.395  -4.512  -2.045
  617    HE2  MET  86           1HE      MET  86   3.700  -4.309  -3.770
  618    HE3  MET  86           2HE      MET  86   2.163  -3.790  -3.079
  619    H    LEU  87           H        LEU  87   1.712   2.848  -3.846
  620    HA   LEU  87           HA       LEU  87  -0.980   3.077  -2.762
  621    HB2  LEU  87           2HB      LEU  87   1.433   4.812  -2.423
  622    HB3  LEU  87           1HB      LEU  87  -0.119   5.136  -1.674
  623    HG   LEU  87           HG       LEU  87   1.090   2.486  -1.117
  624   HD11  LEU  87          1HD1      LEU  87   3.068   3.781  -0.900
  625   HD12  LEU  87          2HD1      LEU  87   2.444   3.515   0.727
  626   HD13  LEU  87          3HD1      LEU  87   2.208   5.074  -0.063
  627   HD21  LEU  87          3HD2      LEU  87  -0.186   4.509   0.714
  628   HD22  LEU  87          1HD2      LEU  87   0.061   2.787   1.007
  629   HD23  LEU  87          2HD2      LEU  87  -1.099   3.316  -0.211
  630    H    TYR  88           H        TYR  88   0.632   3.730  -5.425
  631    HA   TYR  88           HA       TYR  88  -1.193   5.892  -6.223
  632    HB2  TYR  88           2HB      TYR  88   1.689   5.557  -7.083
  633    HB3  TYR  88           1HB      TYR  88   0.582   6.782  -7.692
  634    HD1  TYR  88           2HD      TYR  88  -0.708   7.919  -5.447
  635    HD2  TYR  88           1HD      TYR  88   3.289   6.490  -5.719
  636    HE1  TYR  88           2HE      TYR  88  -0.051   9.425  -3.618
  637    HE2  TYR  88           1HE      TYR  88   3.957   7.991  -3.890
  638    HH   TYR  88           HH       TYR  88   3.218  10.031  -2.818
  639    H    SER  89           H        SER  89  -1.219   2.894  -6.524
  640    HA   SER  89           HA       SER  89  -0.735   2.214  -9.213
  641    HB2  SER  89           2HB      SER  89  -1.126   0.643  -7.225
  642    HB3  SER  89           1HB      SER  89  -2.846   0.922  -7.490
  643    HG   SER  89           HG       SER  89  -2.478  -0.781  -8.746
  644    H    VAL  90           H        VAL  90  -1.601   4.019 -10.373
  645    HA   VAL  90           HA       VAL  90  -3.198   5.255 -11.452
  646    HB   VAL  90           HB       VAL  90  -4.835   3.914 -12.698
  647   HG11  VAL  90          1HG1      VAL  90  -2.003   2.934 -12.547
  648   HG12  VAL  90          2HG1      VAL  90  -2.732   4.025 -13.724
  649   HG13  VAL  90          3HG1      VAL  90  -3.144   2.311 -13.738
  650   HG21  VAL  90          3HG2      VAL  90  -5.285   2.329 -10.787
  651   HG22  VAL  90          1HG2      VAL  90  -3.786   1.510 -11.221
  652   HG23  VAL  90          2HG2      VAL  90  -5.118   1.582 -12.375
  653    H    ASP  91           H        ASP  91  -3.615   5.114  -8.592
  654    HA   ASP  91           HA       ASP  91  -6.394   4.730  -8.062
  655    HB2  ASP  91           2HB      ASP  91  -4.403   6.307  -6.421
  656    HB3  ASP  91           1HB      ASP  91  -5.920   5.607  -5.864
  657    H    GLU  92           H        GLU  92  -7.604   6.639  -6.946
  658    HA   GLU  92           HA       GLU  92  -7.504   8.902  -8.820
  659    HB2  GLU  92           2HB      GLU  92  -9.606   7.421  -8.527
  660    HB3  GLU  92           1HB      GLU  92  -9.817   8.277  -7.006
  661    HG2  GLU  92           2HG      GLU  92 -10.383  10.229  -8.015
  662    HG3  GLU  92           1HG      GLU  92  -9.394   9.908  -9.441
  663    H    SER  93           H        SER  93  -7.506   8.028  -5.430
  664    HA   SER  93           HA       SER  93  -7.028   9.198  -3.539
  665    HB2  SER  93           2HB      SER  93  -5.100   9.899  -5.210
  666    HB3  SER  93           1HB      SER  93  -5.897  11.469  -5.119
  667    HG   SER  93           HG       SER  93  -5.518  11.533  -2.944
  Start of MODEL   11
    1    H1   MET   1           1HT      MET   1 -38.563 -30.066 -19.098
    2    H2   MET   1           2HT      MET   1 -40.243 -29.984 -19.439
    3    H3   MET   1           3HT      MET   1 -39.667 -31.012 -18.192
    4    HA   MET   1           HA       MET   1 -39.274 -28.107 -18.160
    5    HB2  MET   1           2HB      MET   1 -41.263 -28.079 -16.639
    6    HB3  MET   1           1HB      MET   1 -41.646 -28.456 -18.314
    7    HG2  MET   1           2HG      MET   1 -42.304 -30.560 -17.837
    8    HG3  MET   1           1HG      MET   1 -41.125 -30.755 -16.540
    9    HE1  MET   1           2HE      MET   1 -45.070 -28.875 -16.831
   10    HE2  MET   1           3HE      MET   1 -43.576 -28.194 -17.479
   11    HE3  MET   1           1HE      MET   1 -44.194 -27.646 -15.920
   12    H    GLY   2           H        GLY   2 -37.399 -30.115 -17.473
   13    HA2  GLY   2           2HA      GLY   2 -37.417 -29.873 -14.526
   14    HA3  GLY   2           1HA      GLY   2 -36.821 -31.305 -15.351
   15    H    SER   3           H        SER   3 -36.309 -27.817 -15.865
   16    HA   SER   3           HA       SER   3 -33.575 -27.956 -15.013
   17    HB2  SER   3           2HB      SER   3 -33.724 -27.123 -17.855
   18    HB3  SER   3           1HB      SER   3 -32.449 -27.988 -16.996
   19    HG   SER   3           HG       SER   3 -34.748 -28.976 -18.248
   20    H    SER   4           H        SER   4 -33.028 -26.030 -14.227
   21    HA   SER   4           HA       SER   4 -34.647 -23.706 -15.012
   22    HB2  SER   4           2HB      SER   4 -32.880 -23.621 -12.611
   23    HB3  SER   4           1HB      SER   4 -34.465 -22.895 -12.868
   24    HG   SER   4           HG       SER   4 -33.849 -25.240 -11.714
   25    H    HIS   5           H        HIS   5 -32.397 -24.684 -16.563
   26    HA   HIS   5           HA       HIS   5 -30.681 -23.803 -17.771
   27    HB2  HIS   5           2HB      HIS   5 -31.098 -21.227 -16.245
   28    HB3  HIS   5           1HB      HIS   5 -30.333 -21.431 -17.817
   29    HD1  HIS   5           1HD      HIS   5 -33.641 -21.090 -16.174
   30    HD2  HIS   5           2HD      HIS   5 -32.132 -21.850 -19.970
   31    HE1  HIS   5           1HE      HIS   5 -35.584 -20.794 -17.742
   32    HE2  HIS   5           2HE      HIS   5 -34.667 -21.344 -20.024
   33    H    HIS   6           H        HIS   6 -30.360 -22.126 -14.636
   34    HA   HIS   6           HA       HIS   6 -28.114 -23.750 -13.873
   35    HB2  HIS   6           2HB      HIS   6 -27.423 -21.742 -15.534
   36    HB3  HIS   6           1HB      HIS   6 -27.369 -20.882 -13.998
   37    HD1  HIS   6           1HD      HIS   6 -25.110 -22.357 -16.128
   38    HD2  HIS   6           2HD      HIS   6 -25.851 -22.881 -12.073
   39    HE1  HIS   6           1HE      HIS   6 -22.998 -23.342 -15.181
   40    HE2  HIS   6           2HE      HIS   6 -23.441 -23.570 -12.711
   41    H    HIS   7           H        HIS   7 -29.687 -20.605 -13.310
   42    HA   HIS   7           HA       HIS   7 -30.440 -19.597 -11.416
   43    HB2  HIS   7           2HB      HIS   7 -31.462 -22.058 -11.300
   44    HB3  HIS   7           1HB      HIS   7 -30.425 -22.150  -9.880
   45    HD1  HIS   7           1HD      HIS   7 -32.678 -19.344 -11.133
   46    HD2  HIS   7           2HD      HIS   7 -32.050 -21.702  -7.770
   47    HE1  HIS   7           1HE      HIS   7 -34.289 -18.488  -9.401
   48    HE2  HIS   7           2HE      HIS   7 -33.952 -19.988  -7.405
   49    H    HIS   8           H        HIS   8 -27.619 -19.779 -11.832
   50    HA   HIS   8           HA       HIS   8 -26.409 -20.323  -9.262
   51    HB2  HIS   8           2HB      HIS   8 -25.432 -20.469 -11.770
   52    HB3  HIS   8           1HB      HIS   8 -24.886 -18.852 -11.338
   53    HD1  HIS   8           1HD      HIS   8 -23.873 -22.278 -11.150
   54    HD2  HIS   8           2HD      HIS   8 -23.386 -18.928  -8.741
   55    HE1  HIS   8           1HE      HIS   8 -21.930 -22.811  -9.643
   56    HE2  HIS   8           2HE      HIS   8 -21.710 -20.804  -8.137
   57    H    HIS   9           H        HIS   9 -25.253 -18.748  -8.021
   58    HA   HIS   9           HA       HIS   9 -25.063 -16.780  -6.899
   59    HB2  HIS   9           2HB      HIS   9 -24.477 -16.167  -9.450
   60    HB3  HIS   9           1HB      HIS   9 -25.890 -15.142  -9.233
   61    HD1  HIS   9           1HD      HIS   9 -22.566 -15.803  -7.506
   62    HD2  HIS   9           2HD      HIS   9 -25.327 -12.751  -8.087
   63    HE1  HIS   9           1HE      HIS   9 -21.537 -13.757  -6.466
   64    HE2  HIS   9           2HE      HIS   9 -23.262 -11.945  -6.753
   65    H    HIS  10           H        HIS  10 -26.571 -16.453  -5.405
   66    HA   HIS  10           HA       HIS  10 -29.357 -16.309  -5.999
   67    HB2  HIS  10           2HB      HIS  10 -27.999 -16.989  -3.786
   68    HB3  HIS  10           1HB      HIS  10 -28.358 -15.313  -3.384
   69    HD1  HIS  10           1HD      HIS  10 -31.197 -15.838  -5.145
   70    HD2  HIS  10           2HD      HIS  10 -29.836 -17.573  -1.624
   71    HE1  HIS  10           1HE      HIS  10 -33.251 -16.711  -3.987
   72    HE2  HIS  10           2HE      HIS  10 -32.413 -17.679  -1.818
   73    H    SER  11           H        SER  11 -27.201 -13.904  -4.475
   74    HA   SER  11           HA       SER  11 -27.966 -11.770  -6.131
   75    HB2  SER  11           2HB      SER  11 -30.073 -12.340  -4.593
   76    HB3  SER  11           1HB      SER  11 -29.194 -11.322  -3.454
   77    HG   SER  11           HG       SER  11 -30.758 -10.425  -5.219
   78    H    SER  12           H        SER  12 -26.974 -12.724  -2.877
   79    HA   SER  12           HA       SER  12 -25.293 -12.013  -1.519
   80    HB2  SER  12           2HB      SER  12 -24.079 -12.358  -3.814
   81    HB3  SER  12           1HB      SER  12 -23.992 -10.597  -3.820
   82    HG   SER  12           HG       SER  12 -22.198 -11.131  -2.758
   83    H    GLY  13           H        GLY  13 -23.790  -9.756  -1.328
   84    HA2  GLY  13           2HA      GLY  13 -25.733  -7.541  -1.408
   85    HA3  GLY  13           1HA      GLY  13 -24.864  -7.909   0.074
   86    H    LEU  14           H        LEU  14 -22.351  -8.175  -0.459
   87    HA   LEU  14           HA       LEU  14 -21.418  -5.601  -1.049
   88    HB2  LEU  14           2HB      LEU  14 -20.342  -7.734   0.162
   89    HB3  LEU  14           1HB      LEU  14 -19.568  -7.895  -1.402
   90    HG   LEU  14           HG       LEU  14 -18.996  -5.340  -1.001
   91   HD11  LEU  14          1HD1      LEU  14 -20.328  -5.748   1.296
   92   HD12  LEU  14          2HD1      LEU  14 -19.025  -4.573   1.119
   93   HD13  LEU  14          3HD1      LEU  14 -18.692  -6.158   1.814
   94   HD21  LEU  14          3HD2      LEU  14 -17.392  -7.300   0.582
   95   HD22  LEU  14          1HD2      LEU  14 -16.849  -6.006  -0.486
   96   HD23  LEU  14          2HD2      LEU  14 -17.527  -7.486  -1.167
   97    H    VAL  15           H        VAL  15 -20.287  -4.760  -2.813
   98    HA   VAL  15           HA       VAL  15 -21.250  -5.434  -5.350
   99    HB   VAL  15           HB       VAL  15 -20.373  -3.207  -4.808
  100   HG11  VAL  15          1HG1      VAL  15 -18.000  -2.776  -4.650
  101   HG12  VAL  15          2HG1      VAL  15 -17.643  -4.487  -4.888
  102   HG13  VAL  15          3HG1      VAL  15 -18.472  -3.954  -3.425
  103   HG21  VAL  15          3HG2      VAL  15 -20.538  -3.668  -7.122
  104   HG22  VAL  15          1HG2      VAL  15 -19.076  -4.656  -7.105
  105   HG23  VAL  15          2HG2      VAL  15 -18.963  -2.909  -6.886
  106    HA   PRO  16           HA       PRO  16 -18.923  -8.984  -6.610
  107    HB2  PRO  16           2HB      PRO  16 -18.818  -7.591  -9.246
  108    HB3  PRO  16           1HB      PRO  16 -19.339  -9.236  -8.861
  109    HG2  PRO  16           2HG      PRO  16 -21.129  -7.344  -9.400
  110    HG3  PRO  16           1HG      PRO  16 -21.431  -8.548  -8.133
  111    HD2  PRO  16           2HD      PRO  16 -20.642  -5.681  -7.878
  112    HD3  PRO  16           1HD      PRO  16 -21.713  -6.654  -6.849
  113    H    ARG  17           H        ARG  17 -17.769  -6.097  -8.367
  114    HA   ARG  17           HA       ARG  17 -15.067  -6.647  -7.343
  115    HB2  ARG  17           2HB      ARG  17 -15.759  -5.855 -10.177
  116    HB3  ARG  17           1HB      ARG  17 -14.134  -6.046  -9.537
  117    HG2  ARG  17           2HG      ARG  17 -14.929  -8.456  -8.969
  118    HG3  ARG  17           1HG      ARG  17 -16.171  -8.128 -10.178
  119    HD2  ARG  17           2HD      ARG  17 -13.975  -7.272 -11.492
  120    HD3  ARG  17           1HD      ARG  17 -13.270  -8.545 -10.497
  121    HE   ARG  17           HE       ARG  17 -14.264 -10.069 -11.864
  122   HH11  ARG  17          1HH1      ARG  17 -15.998  -7.055 -12.157
  123   HH12  ARG  17          2HH1      ARG  17 -17.048  -7.637 -13.406
  124   HH21  ARG  17          1HH2      ARG  17 -15.644 -10.836 -13.504
  125   HH22  ARG  17          2HH2      ARG  17 -16.847  -9.783 -14.171
  126    H    GLY  18           H        GLY  18 -13.617  -4.633  -8.127
  127    HA2  GLY  18           2HA      GLY  18 -13.138  -2.417  -7.770
  128    HA3  GLY  18           1HA      GLY  18 -14.783  -2.088  -8.296
  129    H    SER  19           H        SER  19 -12.705  -2.688  -5.550
  130    HA   SER  19           HA       SER  19 -14.633  -2.657  -3.516
  131    HB2  SER  19           2HB      SER  19 -12.637  -1.773  -2.113
  132    HB3  SER  19           1HB      SER  19 -12.504  -3.370  -2.846
  133    HG   SER  19           HG       SER  19 -10.976  -2.663  -4.123
  134    H    HIS  20           H        HIS  20 -15.555  -1.046  -2.310
  135    HA   HIS  20           HA       HIS  20 -15.357   1.654  -3.442
  136    HB2  HIS  20           2HB      HIS  20 -17.497   2.045  -2.175
  137    HB3  HIS  20           1HB      HIS  20 -17.605   0.834  -3.448
  138    HD1  HIS  20           1HD      HIS  20 -17.598   1.190   0.289
  139    HD2  HIS  20           2HD      HIS  20 -18.196  -1.743  -2.594
  140    HE1  HIS  20           1HE      HIS  20 -18.541  -0.786   1.526
  141    HE2  HIS  20           2HE      HIS  20 -18.974  -2.518  -0.252
  142    H    MET  21           H        MET  21 -13.353   0.587  -1.639
  143    HA   MET  21           HA       MET  21 -13.588   2.607   0.475
  144    HB2  MET  21           2HB      MET  21 -14.077   0.134   1.189
  145    HB3  MET  21           1HB      MET  21 -12.330  -0.038   1.101
  146    HG2  MET  21           2HG      MET  21 -11.975   1.196   2.950
  147    HG3  MET  21           1HG      MET  21 -13.319   2.286   2.614
  148    HE1  MET  21           3HE      MET  21 -14.809   1.403   5.858
  149    HE2  MET  21           1HE      MET  21 -15.504   2.154   4.421
  150    HE3  MET  21           2HE      MET  21 -13.844   2.519   4.893
  151    H    SER  22           H        SER  22 -12.139   3.951  -0.569
  152    HA   SER  22           HA       SER  22  -9.527   2.919  -1.285
  153    HB2  SER  22           2HB      SER  22  -9.111   5.080  -2.293
  154    HB3  SER  22           1HB      SER  22 -10.717   4.533  -2.775
  155    HG   SER  22           HG       SER  22 -10.680   6.734  -2.094
  156    H    ASP  23           H        ASP  23 -10.798   3.670   1.505
  157    HA   ASP  23           HA       ASP  23  -8.943   5.496   2.625
  158    HB2  ASP  23           2HB      ASP  23 -10.737   3.502   3.980
  159    HB3  ASP  23           1HB      ASP  23  -9.895   4.819   4.793
  160    H    GLU  24           H        GLU  24  -8.762   2.314   1.820
  161    HA   GLU  24           HA       GLU  24  -7.021   1.315   3.780
  162    HB2  GLU  24           2HB      GLU  24  -8.336  -0.049   2.099
  163    HB3  GLU  24           1HB      GLU  24  -7.107   0.398   0.923
  164    HG2  GLU  24           2HG      GLU  24  -5.411  -0.621   2.481
  165    HG3  GLU  24           1HG      GLU  24  -6.771  -1.265   3.401
  166    H    LYS  25           H        LYS  25  -6.579   3.475   1.329
  167    HA   LYS  25           HA       LYS  25  -3.702   3.092   1.108
  168    HB2  LYS  25           2HB      LYS  25  -5.189   3.633  -0.883
  169    HB3  LYS  25           1HB      LYS  25  -5.358   5.248  -0.205
  170    HG2  LYS  25           2HG      LYS  25  -2.680   5.022  -0.199
  171    HG3  LYS  25           1HG      LYS  25  -3.075   3.995  -1.578
  172    HD2  LYS  25           2HD      LYS  25  -3.065   5.924  -2.731
  173    HD3  LYS  25           1HD      LYS  25  -4.674   6.143  -2.042
  174    HE2  LYS  25           2HE      LYS  25  -3.782   8.123  -1.395
  175    HE3  LYS  25           1HE      LYS  25  -3.223   7.145  -0.039
  176    HZ1  LYS  25           3HZ      LYS  25  -1.608   8.663  -1.474
  177    HZ2  LYS  25           1HZ      LYS  25  -1.493   7.238  -2.380
  178    HZ3  LYS  25           2HZ      LYS  25  -1.091   7.231  -0.738
  179    H    THR  26           H        THR  26  -6.031   5.151   2.653
  180    HA   THR  26           HA       THR  26  -4.294   7.306   3.245
  181    HB   THR  26           HB       THR  26  -6.214   7.319   5.244
  182    HG1  THR  26           1HG      THR  26  -7.368   5.645   4.394
  183   HG21  THR  26          3HG2      THR  26  -7.326   8.575   2.974
  184   HG22  THR  26          1HG2      THR  26  -5.577   8.817   2.915
  185   HG23  THR  26          2HG2      THR  26  -6.495   9.313   4.343
  186    H    GLN  27           H        GLN  27  -4.839   4.208   4.708
  187    HA   GLN  27           HA       GLN  27  -3.811   4.722   7.272
  188    HB2  GLN  27           2HB      GLN  27  -4.961   2.612   6.571
  189    HB3  GLN  27           1HB      GLN  27  -3.516   2.172   5.668
  190    HG2  GLN  27           2HG      GLN  27  -2.264   1.828   7.590
  191    HG3  GLN  27           1HG      GLN  27  -3.362   2.780   8.592
  192   HE21  GLN  27          1HE2      GLN  27  -3.882   0.100   6.328
  193   HE22  GLN  27          2HE2      GLN  27  -4.687  -0.926   7.459
  194    H    LEU  28           H        LEU  28  -2.337   4.494   4.179
  195    HA   LEU  28           HA       LEU  28   0.340   4.149   5.199
  196    HB2  LEU  28           2HB      LEU  28  -0.424   3.087   3.088
  197    HB3  LEU  28           1HB      LEU  28  -0.611   4.692   2.405
  198    HG   LEU  28           HG       LEU  28   2.070   4.105   3.490
  199   HD11  LEU  28          1HD1      LEU  28   2.499   2.955   1.156
  200   HD12  LEU  28          2HD1      LEU  28   0.820   2.454   1.359
  201   HD13  LEU  28          3HD1      LEU  28   2.023   2.017   2.572
  202   HD21  LEU  28          3HD2      LEU  28   0.805   5.626   1.300
  203   HD22  LEU  28          1HD2      LEU  28   2.425   5.003   0.990
  204   HD23  LEU  28          2HD2      LEU  28   2.137   6.065   2.368
  205    H    ILE  29           H        ILE  29  -1.747   6.613   4.696
  206    HA   ILE  29           HA       ILE  29  -0.079   8.689   3.825
  207    HB   ILE  29           HB       ILE  29  -2.616   8.790   5.399
  208   HG12  ILE  29          2HG1      ILE  29  -2.608   7.804   3.062
  209   HG13  ILE  29          1HG1      ILE  29  -3.751   9.107   3.364
  210   HG21  ILE  29          1HG2      ILE  29  -1.500  10.865   5.791
  211   HG22  ILE  29          2HG2      ILE  29  -2.773  11.164   4.608
  212   HG23  ILE  29          3HG2      ILE  29  -1.094  11.035   4.084
  213   HD11  ILE  29          3HD1      ILE  29  -2.824   9.480   1.247
  214   HD12  ILE  29          1HD1      ILE  29  -1.179   9.216   1.834
  215   HD13  ILE  29          2HD1      ILE  29  -2.074  10.655   2.328
  216    H    GLU  30           H        GLU  30  -0.273   7.118   6.637
  217    HA   GLU  30           HA       GLU  30   0.615   9.189   8.387
  218    HB2  GLU  30           2HB      GLU  30   0.220   6.240   8.733
  219    HB3  GLU  30           1HB      GLU  30   1.021   7.191   9.976
  220    HG2  GLU  30           2HG      GLU  30  -0.888   8.290  10.570
  221    HG3  GLU  30           1HG      GLU  30  -1.608   8.128   8.967
  222    H    ALA  31           H        ALA  31   2.115   7.767   6.017
  223    HA   ALA  31           HA       ALA  31   4.688   7.348   7.324
  224    HB1  ALA  31           1HB      ALA  31   5.408   6.281   5.380
  225    HB2  ALA  31           2HB      ALA  31   4.205   7.091   4.376
  226    HB3  ALA  31           3HB      ALA  31   3.708   5.825   5.500
  227    H    PHE  32           H        PHE  32   3.061   9.589   5.188
  228    HA   PHE  32           HA       PHE  32   5.283  11.007   4.237
  229    HB2  PHE  32           2HB      PHE  32   2.416  11.818   4.702
  230    HB3  PHE  32           1HB      PHE  32   3.601  12.917   4.003
  231    HD1  PHE  32           2HD      PHE  32   5.082  11.525   2.103
  232    HD2  PHE  32           1HD      PHE  32   0.999  10.934   3.146
  233    HE1  PHE  32           2HE      PHE  32   4.657  10.568  -0.123
  234    HE2  PHE  32           1HE      PHE  32   0.566   9.977   0.920
  235    HZ   PHE  32           HZ       PHE  32   2.397   9.794  -0.718
  236    H    TYR  33           H        TYR  33   3.618  11.102   7.296
  237    HA   TYR  33           HA       TYR  33   5.103  13.483   8.123
  238    HB2  TYR  33           2HB      TYR  33   3.073  11.951   9.750
  239    HB3  TYR  33           1HB      TYR  33   3.636  13.600  10.002
  240    HD1  TYR  33           1HD      TYR  33   2.903  15.404   8.467
  241    HD2  TYR  33           2HD      TYR  33   1.323  11.462   8.199
  242    HE1  TYR  33           1HE      TYR  33   1.030  16.253   7.119
  243    HE2  TYR  33           2HE      TYR  33  -0.554  12.300   6.850
  244    HH   TYR  33           HH       TYR  33  -1.122  14.175   5.447
  245    H    ASN  34           H        ASN  34   6.606  11.138   7.654
  246    HA   ASN  34           HA       ASN  34   7.963  10.930  10.172
  247    HB2  ASN  34           2HB      ASN  34   5.963   9.132   9.939
  248    HB3  ASN  34           1HB      ASN  34   7.258   8.240   9.144
  249   HD21  ASN  34          1HD2      ASN  34   9.450   8.897  10.535
  250   HD22  ASN  34          2HD2      ASN  34   9.308   8.395  12.182
  251    H    PHE  35           H        PHE  35   8.489  11.763   7.421
  252    HA   PHE  35           HA       PHE  35  11.078  10.726   7.120
  253    HB2  PHE  35           2HB      PHE  35   9.832   8.710   6.363
  254    HB3  PHE  35           1HB      PHE  35   9.112   9.671   5.077
  255    HD1  PHE  35           2HD      PHE  35  12.573   9.244   6.413
  256    HD2  PHE  35           1HD      PHE  35   9.993   9.174   3.029
  257    HE1  PHE  35           2HE      PHE  35  14.495   8.736   4.963
  258    HE2  PHE  35           1HE      PHE  35  11.910   8.665   1.573
  259    HZ   PHE  35           HZ       PHE  35  14.166   8.445   2.539
  260    H    ASP  36           H        ASP  36   9.787  13.249   7.144
  261    HA   ASP  36           HA       ASP  36  10.237  14.199   4.393
  262    HB2  ASP  36           2HB      ASP  36   8.009  14.575   5.874
  263    HB3  ASP  36           1HB      ASP  36   8.933  15.996   6.357
  264    H    GLY  37           H        GLY  37  12.409  13.664   6.131
  265    HA2  GLY  37           2HA      GLY  37  13.284  16.297   7.070
  266    HA3  GLY  37           1HA      GLY  37  14.073  14.763   7.407
  267    H    ASP  38           H        ASP  38  13.057  15.892   4.229
  268    HA   ASP  38           HA       ASP  38  14.212  16.334   2.323
  269    HB2  ASP  38           2HB      ASP  38  15.119  18.201   3.675
  270    HB3  ASP  38           1HB      ASP  38  16.431  17.156   4.213
  271    H    TYR  39           H        TYR  39  14.126  13.884   2.272
  272    HA   TYR  39           HA       TYR  39  16.864  12.879   1.929
  273    HB2  TYR  39           2HB      TYR  39  15.365  12.075   4.038
  274    HB3  TYR  39           1HB      TYR  39  14.865  10.895   2.831
  275    HD1  TYR  39           1HD      TYR  39  16.834   9.731   1.530
  276    HD2  TYR  39           2HD      TYR  39  17.251  11.642   5.307
  277    HE1  TYR  39           1HE      TYR  39  18.869   8.421   1.961
  278    HE2  TYR  39           2HE      TYR  39  19.289  10.339   5.748
  279    HH   TYR  39           HH       TYR  39  20.358   8.298   5.045
  280    H    ASP  40           H        ASP  40  17.120  11.290   0.315
  281    HA   ASP  40           HA       ASP  40  15.510  11.617  -1.960
  282    HB2  ASP  40           2HB      ASP  40  16.822   9.760  -2.920
  283    HB3  ASP  40           1HB      ASP  40  17.850  10.944  -2.117
  284    H    GLY  41           H        GLY  41  14.287   9.958  -3.111
  285    HA2  GLY  41           2HA      GLY  41  12.320   8.769  -1.434
  286    HA3  GLY  41           1HA      GLY  41  12.451   8.573  -3.175
  287    H    PHE  42           H        PHE  42  15.202   7.548  -2.998
  288    HA   PHE  42           HA       PHE  42  14.613   4.799  -2.828
  289    HB2  PHE  42           2HB      PHE  42  16.420   5.691  -4.234
  290    HB3  PHE  42           1HB      PHE  42  17.308   6.177  -2.793
  291    HD1  PHE  42           2HD      PHE  42  15.759   3.135  -4.297
  292    HD2  PHE  42           1HD      PHE  42  18.944   4.777  -2.002
  293    HE1  PHE  42           2HE      PHE  42  16.841   0.927  -4.227
  294    HE2  PHE  42           1HE      PHE  42  20.033   2.572  -1.928
  295    HZ   PHE  42           HZ       PHE  42  18.981   0.642  -3.041
  296    H    VAL  43           H        VAL  43  14.465   3.506  -1.131
  297    HA   VAL  43           HA       VAL  43  16.044   4.070   1.267
  298    HB   VAL  43           HB       VAL  43  13.879   5.099   1.710
  299   HG11  VAL  43          1HG1      VAL  43  12.567   3.732   0.130
  300   HG12  VAL  43          2HG1      VAL  43  11.823   3.838   1.724
  301   HG13  VAL  43          3HG1      VAL  43  12.681   2.372   1.248
  302   HG21  VAL  43          3HG2      VAL  43  15.168   3.793   3.478
  303   HG22  VAL  43          1HG2      VAL  43  13.954   2.530   3.268
  304   HG23  VAL  43          2HG2      VAL  43  13.473   4.138   3.815
  305    H    SER  44           H        SER  44  16.778   2.278   2.289
  306    HA   SER  44           HA       SER  44  16.354  -0.261   0.965
  307    HB2  SER  44           2HB      SER  44  18.258  -1.023   2.095
  308    HB3  SER  44           1HB      SER  44  18.601   0.689   1.855
  309    HG   SER  44           HG       SER  44  19.022   0.348   3.963
  310    H    VAL  45           H        VAL  45  15.641  -2.163   1.981
  311    HA   VAL  45           HA       VAL  45  13.375  -1.962   3.572
  312    HB   VAL  45           HB       VAL  45  15.228  -4.332   3.288
  313   HG11  VAL  45          1HG1      VAL  45  13.391  -5.707   3.984
  314   HG12  VAL  45          2HG1      VAL  45  12.331  -4.304   4.111
  315   HG13  VAL  45          3HG1      VAL  45  13.688  -4.489   5.224
  316   HG21  VAL  45          3HG2      VAL  45  13.753  -5.067   1.524
  317   HG22  VAL  45          1HG2      VAL  45  14.350  -3.450   1.157
  318   HG23  VAL  45          2HG2      VAL  45  12.712  -3.664   1.770
  319    H    GLU  46           H        GLU  46  16.616  -3.069   4.557
  320    HA   GLU  46           HA       GLU  46  16.217  -3.492   7.225
  321    HB2  GLU  46           2HB      GLU  46  18.673  -2.094   6.183
  322    HB3  GLU  46           1HB      GLU  46  18.554  -3.200   7.545
  323    HG2  GLU  46           2HG      GLU  46  17.845  -4.950   5.821
  324    HG3  GLU  46           1HG      GLU  46  18.451  -3.816   4.614
  325    H    GLU  47           H        GLU  47  16.408  -0.434   5.567
  326    HA   GLU  47           HA       GLU  47  16.463   1.061   8.071
  327    HB2  GLU  47           2HB      GLU  47  17.667   1.641   5.787
  328    HB3  GLU  47           1HB      GLU  47  16.113   2.372   5.408
  329    HG2  GLU  47           2HG      GLU  47  16.276   3.870   7.242
  330    HG3  GLU  47           1HG      GLU  47  17.681   3.021   7.887
  331    H    PHE  48           H        PHE  48  14.267   0.074   5.566
  332    HA   PHE  48           HA       PHE  48  12.178   1.909   6.103
  333    HB2  PHE  48           2HB      PHE  48  12.662  -0.057   4.217
  334    HB3  PHE  48           1HB      PHE  48  11.308  -0.708   5.133
  335    HD1  PHE  48           2HD      PHE  48   9.784   1.684   5.808
  336    HD2  PHE  48           1HD      PHE  48  11.799   0.652   2.205
  337    HE1  PHE  48           2HE      PHE  48   8.240   3.120   4.539
  338    HE2  PHE  48           1HE      PHE  48  10.260   2.086   0.928
  339    HZ   PHE  48           HZ       PHE  48   8.477   3.321   2.096
  340    H    ARG  49           H        ARG  49  12.988  -1.280   7.369
  341    HA   ARG  49           HA       ARG  49  10.641  -1.832   8.763
  342    HB2  ARG  49           2HB      ARG  49  13.415  -2.539   9.720
  343    HB3  ARG  49           1HB      ARG  49  11.918  -3.402  10.046
  344    HG2  ARG  49           2HG      ARG  49  11.850  -3.642   7.438
  345    HG3  ARG  49           1HG      ARG  49  13.586  -3.357   7.582
  346    HD2  ARG  49           2HD      ARG  49  12.103  -5.455   9.153
  347    HD3  ARG  49           1HD      ARG  49  12.889  -5.771   7.607
  348    HE   ARG  49           HE       ARG  49  14.779  -4.592   9.269
  349   HH11  ARG  49          1HH1      ARG  49  12.893  -7.526   9.154
  350   HH12  ARG  49          2HH1      ARG  49  14.073  -8.465  10.006
  351   HH21  ARG  49          1HH2      ARG  49  16.331  -5.826  10.387
  352   HH22  ARG  49          2HH2      ARG  49  16.024  -7.500  10.706
  353    H    GLY  50           H        GLY  50  13.587  -0.187   9.912
  354    HA2  GLY  50           2HA      GLY  50  12.761   0.326  12.522
  355    HA3  GLY  50           1HA      GLY  50  13.904   1.311  11.622
  356    H    ILE  51           H        ILE  51  11.797   1.854   9.557
  357    HA   ILE  51           HA       ILE  51  10.656   4.160  10.886
  358    HB   ILE  51           HB       ILE  51  10.323   3.305   8.009
  359   HG12  ILE  51          2HG1      ILE  51  12.241   5.412   8.961
  360   HG13  ILE  51          1HG1      ILE  51  12.723   3.719   8.926
  361   HG21  ILE  51          1HG2      ILE  51   9.707   5.602   7.602
  362   HG22  ILE  51          2HG2      ILE  51   9.998   6.014   9.292
  363   HG23  ILE  51          3HG2      ILE  51   8.672   4.933   8.864
  364   HD11  ILE  51          3HD1      ILE  51  13.447   4.345   6.876
  365   HD12  ILE  51          1HD1      ILE  51  12.221   5.600   6.702
  366   HD13  ILE  51          2HD1      ILE  51  11.791   3.907   6.452
  367    H    ILE  52           H        ILE  52   9.504   1.239   9.242
  368    HA   ILE  52           HA       ILE  52   6.740   1.824   9.561
  369    HB   ILE  52           HB       ILE  52   8.115  -0.823   9.077
  370   HG12  ILE  52          2HG1      ILE  52   8.454   0.941   7.338
  371   HG13  ILE  52          1HG1      ILE  52   7.591  -0.477   6.748
  372   HG21  ILE  52          1HG2      ILE  52   6.026  -1.446   9.861
  373   HG22  ILE  52          2HG2      ILE  52   5.777  -1.366   8.115
  374   HG23  ILE  52          3HG2      ILE  52   5.226  -0.044   9.146
  375   HD11  ILE  52          3HD1      ILE  52   6.052   0.904   5.963
  376   HD12  ILE  52          1HD1      ILE  52   6.779   2.278   6.794
  377   HD13  ILE  52          2HD1      ILE  52   5.606   1.261   7.632
  378    H    ARG  53           H        ARG  53   9.112   0.067  11.478
  379    HA   ARG  53           HA       ARG  53   7.450  -1.272  13.245
  380    HB2  ARG  53           2HB      ARG  53   9.915  -1.527  13.131
  381    HB3  ARG  53           1HB      ARG  53  10.092   0.043  13.902
  382    HG2  ARG  53           2HG      ARG  53   8.644  -0.990  15.784
  383    HG3  ARG  53           1HG      ARG  53   9.115  -2.530  15.061
  384    HD2  ARG  53           2HD      ARG  53  11.064  -0.398  15.918
  385    HD3  ARG  53           1HD      ARG  53  10.589  -1.762  16.928
  386    HE   ARG  53           HE       ARG  53  11.435  -2.948  14.651
  387   HH11  ARG  53          1HH1      ARG  53  12.866  -0.579  16.777
  388   HH12  ARG  53          2HH1      ARG  53  14.489  -1.083  16.450
  389   HH21  ARG  53          1HH2      ARG  53  13.570  -3.614  14.220
  390   HH22  ARG  53          2HH2      ARG  53  14.889  -2.806  14.999
  391    H    ASP  54           H        ASP  54   8.726   2.034  13.490
  392    HA   ASP  54           HA       ASP  54   6.775   2.547  15.634
  393    HB2  ASP  54           2HB      ASP  54   9.375   3.960  15.013
  394    HB3  ASP  54           1HB      ASP  54   8.244   4.447  16.272
  395    H    GLY  55           H        GLY  55   6.672   2.756  12.518
  396    HA2  GLY  55           2HA      GLY  55   5.810   5.575  12.401
  397    HA3  GLY  55           1HA      GLY  55   6.306   4.621  11.012
  398    H    LEU  56           H        LEU  56   4.872   3.084  10.138
  399    HA   LEU  56           HA       LEU  56   2.067   3.647  10.787
  400    HB2  LEU  56           2HB      LEU  56   3.205   2.302   8.339
  401    HB3  LEU  56           1HB      LEU  56   1.542   2.810   8.574
  402    HG   LEU  56           HG       LEU  56   2.786   5.176   8.918
  403   HD11  LEU  56          1HD1      LEU  56   4.355   4.197   6.621
  404   HD12  LEU  56          2HD1      LEU  56   4.916   3.709   8.220
  405   HD13  LEU  56          3HD1      LEU  56   4.746   5.420   7.830
  406   HD21  LEU  56          3HD2      LEU  56   1.024   4.141   7.166
  407   HD22  LEU  56          1HD2      LEU  56   2.388   4.445   6.091
  408   HD23  LEU  56          2HD2      LEU  56   1.696   5.766   7.032
  409    HA   PRO  57           HA       PRO  57   1.618  -0.445  12.431
  410    HB2  PRO  57           2HB      PRO  57  -1.066  -0.633  12.457
  411    HB3  PRO  57           1HB      PRO  57  -0.197   0.448  13.553
  412    HG2  PRO  57           2HG      PRO  57  -1.612   1.083  10.994
  413    HG3  PRO  57           1HG      PRO  57  -1.620   1.973  12.526
  414    HD2  PRO  57           2HD      PRO  57  -0.074   2.670  10.383
  415    HD3  PRO  57           1HD      PRO  57   0.363   3.028  12.066
  416    H    MET  58           H        MET  58   2.263  -2.060  11.145
  417    HA   MET  58           HA       MET  58   0.359  -3.136   9.228
  418    HB2  MET  58           2HB      MET  58   2.596  -1.601   8.402
  419    HB3  MET  58           1HB      MET  58   2.954  -3.276   8.012
  420    HG2  MET  58           2HG      MET  58   1.042  -3.465   6.642
  421    HG3  MET  58           1HG      MET  58   0.378  -1.947   7.239
  422    HE1  MET  58           3HE      MET  58   3.146  -2.564   3.729
  423    HE2  MET  58           1HE      MET  58   1.727  -3.482   4.235
  424    HE3  MET  58           2HE      MET  58   3.234  -3.618   5.140
  425    H    THR  59           H        THR  59   0.423  -5.323   9.095
  426    HA   THR  59           HA       THR  59   1.975  -6.738  11.046
  427    HB   THR  59           HB       THR  59   0.873  -8.722   9.581
  428    HG1  THR  59           1HG      THR  59  -1.138  -7.964   8.822
  429   HG21  THR  59          3HG2      THR  59   0.353  -7.644  12.016
  430   HG22  THR  59          1HG2      THR  59  -0.515  -9.002  11.301
  431   HG23  THR  59          2HG2      THR  59  -1.170  -7.370  11.171
  432    H    GLU  60           H        GLU  60   3.612  -8.226  10.716
  433    HA   GLU  60           HA       GLU  60   5.661  -7.764   9.032
  434    HB2  GLU  60           2HB      GLU  60   6.018 -10.367   9.128
  435    HB3  GLU  60           1HB      GLU  60   6.160  -9.394  10.585
  436    HG2  GLU  60           2HG      GLU  60   3.471 -10.454  10.000
  437    HG3  GLU  60           1HG      GLU  60   4.704 -11.645  10.408
  438    H    ALA  61           H        ALA  61   2.999  -9.964   8.327
  439    HA   ALA  61           HA       ALA  61   3.721 -10.928   5.875
  440    HB1  ALA  61           1HB      ALA  61   1.482 -11.016   7.469
  441    HB2  ALA  61           2HB      ALA  61   1.678 -11.821   5.910
  442    HB3  ALA  61           3HB      ALA  61   0.898 -10.241   5.995
  443    H    GLU  62           H        GLU  62   1.729  -8.018   6.463
  444    HA   GLU  62           HA       GLU  62   1.507  -7.165   3.833
  445    HB2  GLU  62           2HB      GLU  62   1.959  -5.003   5.801
  446    HB3  GLU  62           1HB      GLU  62   0.645  -5.224   4.657
  447    HG2  GLU  62           2HG      GLU  62  -0.050  -7.144   6.286
  448    HG3  GLU  62           1HG      GLU  62   0.943  -6.245   7.431
  449    H    ILE  63           H        ILE  63   3.848  -5.936   6.214
  450    HA   ILE  63           HA       ILE  63   5.458  -4.530   4.401
  451    HB   ILE  63           HB       ILE  63   6.615  -5.844   6.843
  452   HG12  ILE  63          2HG1      ILE  63   5.727  -3.384   7.713
  453   HG13  ILE  63          1HG1      ILE  63   4.383  -3.953   6.725
  454   HG21  ILE  63          1HG2      ILE  63   7.828  -4.310   5.079
  455   HG22  ILE  63          2HG2      ILE  63   8.169  -4.164   6.805
  456   HG23  ILE  63          3HG2      ILE  63   7.080  -3.020   6.022
  457   HD11  ILE  63          3HD1      ILE  63   4.991  -6.172   8.165
  458   HD12  ILE  63          1HD1      ILE  63   3.741  -5.002   8.574
  459   HD13  ILE  63          2HD1      ILE  63   5.332  -4.881   9.319
  460    H    THR  64           H        THR  64   6.236  -7.637   5.947
  461    HA   THR  64           HA       THR  64   8.475  -8.311   4.513
  462    HB   THR  64           HB       THR  64   6.292 -10.132   5.510
  463    HG1  THR  64           1HG      THR  64   7.176  -8.963   7.181
  464   HG21  THR  64          3HG2      THR  64   9.118 -10.775   4.736
  465   HG22  THR  64          1HG2      THR  64   7.634 -11.424   4.040
  466   HG23  THR  64          2HG2      THR  64   8.082 -11.834   5.695
  467    H    GLU  65           H        GLU  65   5.120  -9.247   3.720
  468    HA   GLU  65           HA       GLU  65   5.822 -10.484   1.286
  469    HB2  GLU  65           2HB      GLU  65   3.162  -9.325   2.081
  470    HB3  GLU  65           1HB      GLU  65   3.429 -10.430   0.743
  471    HG2  GLU  65           2HG      GLU  65   4.404 -11.410   3.321
  472    HG3  GLU  65           1HG      GLU  65   2.661 -11.161   3.244
  473    H    PHE  66           H        PHE  66   5.620  -7.333   2.194
  474    HA   PHE  66           HA       PHE  66   5.233  -6.335  -0.502
  475    HB2  PHE  66           2HB      PHE  66   5.176  -5.066   2.204
  476    HB3  PHE  66           1HB      PHE  66   5.535  -4.062   0.806
  477    HD1  PHE  66           2HD      PHE  66   3.258  -6.940   0.631
  478    HD2  PHE  66           1HD      PHE  66   3.575  -2.712   1.003
  479    HE1  PHE  66           2HE      PHE  66   0.852  -6.721   0.164
  480    HE2  PHE  66           1HE      PHE  66   1.171  -2.486   0.536
  481    HZ   PHE  66           HZ       PHE  66  -0.194  -4.493   0.116
  482    H    PHE  67           H        PHE  67   7.695  -6.925   1.836
  483    HA   PHE  67           HA       PHE  67   9.656  -5.159   0.701
  484    HB2  PHE  67           2HB      PHE  67   9.629  -7.269   2.812
  485    HB3  PHE  67           1HB      PHE  67  11.181  -6.797   2.129
  486    HD1  PHE  67           2HD      PHE  67  10.253  -3.813   1.720
  487    HD2  PHE  67           1HD      PHE  67  10.193  -6.522   5.008
  488    HE1  PHE  67           2HE      PHE  67  10.333  -1.918   3.287
  489    HE2  PHE  67           1HE      PHE  67  10.276  -4.628   6.574
  490    HZ   PHE  67           HZ       PHE  67  10.347  -2.325   5.713
  491    H    GLU  68           H        GLU  68   8.698  -8.489   0.264
  492    HA   GLU  68           HA       GLU  68  11.006  -9.114  -1.373
  493    HB2  GLU  68           2HB      GLU  68   8.532 -10.800  -1.034
  494    HB3  GLU  68           1HB      GLU  68  10.144 -11.326  -1.494
  495    HG2  GLU  68           2HG      GLU  68  10.757 -10.345   0.878
  496    HG3  GLU  68           1HG      GLU  68   9.050 -10.668   1.183
  497    H    ALA  69           H        ALA  69   7.679  -8.155  -1.786
  498    HA   ALA  69           HA       ALA  69   7.521  -8.822  -4.548
  499    HB1  ALA  69           1HB      ALA  69   5.414  -7.633  -4.537
  500    HB2  ALA  69           2HB      ALA  69   5.817  -6.924  -2.972
  501    HB3  ALA  69           3HB      ALA  69   5.535  -8.660  -3.107
  502    H    ALA  70           H        ALA  70   9.034  -6.441  -2.905
  503    HA   ALA  70           HA       ALA  70   8.944  -4.500  -5.096
  504    HB1  ALA  70           1HB      ALA  70   9.841  -4.301  -2.237
  505    HB2  ALA  70           2HB      ALA  70   8.555  -3.416  -3.057
  506    HB3  ALA  70           3HB      ALA  70  10.242  -3.065  -3.429
  507    H    ASP  71           H        ASP  71  11.081  -6.699  -3.435
  508    HA   ASP  71           HA       ASP  71  13.223  -5.974  -5.323
  509    HB2  ASP  71           2HB      ASP  71  13.505  -5.557  -2.735
  510    HB3  ASP  71           1HB      ASP  71  13.848  -7.284  -2.707
  511    HA   PRO  72           HA       PRO  72  12.423 -10.192  -6.673
  512    HB2  PRO  72           2HB      PRO  72  14.410 -10.255  -8.553
  513    HB3  PRO  72           1HB      PRO  72  12.823  -9.530  -8.827
  514    HG2  PRO  72           2HG      PRO  72  15.409  -8.210  -8.105
  515    HG3  PRO  72           1HG      PRO  72  14.175  -7.696  -9.271
  516    HD2  PRO  72           2HD      PRO  72  14.372  -6.596  -6.820
  517    HD3  PRO  72           1HD      PRO  72  12.805  -6.823  -7.626
  518    H    ASN  73           H        ASN  73  15.804  -9.087  -6.365
  519    HA   ASN  73           HA       ASN  73  16.820 -11.669  -5.770
  520    HB2  ASN  73           2HB      ASN  73  18.844 -10.316  -4.951
  521    HB3  ASN  73           1HB      ASN  73  18.395 -10.159  -6.646
  522   HD21  ASN  73          1HD2      ASN  73  19.343  -8.161  -6.876
  523   HD22  ASN  73          2HD2      ASN  73  18.701  -6.731  -6.153
  524    H    ASN  74           H        ASN  74  15.589  -9.038  -3.823
  525    HA   ASN  74           HA       ASN  74  14.865  -8.998  -1.661
  526    HB2  ASN  74           2HB      ASN  74  15.848 -11.826  -1.293
  527    HB3  ASN  74           1HB      ASN  74  14.583 -10.987  -0.401
  528   HD21  ASN  74          1HD2      ASN  74  12.618 -10.467  -1.557
  529   HD22  ASN  74          2HD2      ASN  74  12.087 -11.504  -2.834
  530    H    THR  75           H        THR  75  17.120  -7.766  -2.136
  531    HA   THR  75           HA       THR  75  19.127  -8.718  -0.237
  532    HB   THR  75           HB       THR  75  20.666  -7.232  -1.261
  533    HG1  THR  75           1HG      THR  75  20.096  -5.466  -2.295
  534   HG21  THR  75          3HG2      THR  75  20.128  -7.531  -3.806
  535   HG22  THR  75          1HG2      THR  75  18.900  -8.634  -3.187
  536   HG23  THR  75          2HG2      THR  75  20.599  -8.905  -2.804
  537    H    GLY  76           H        GLY  76  16.544  -7.585   0.598
  538    HA2  GLY  76           2HA      GLY  76  15.740  -6.150   2.195
  539    HA3  GLY  76           1HA      GLY  76  17.406  -6.001   2.738
  540    H    PHE  77           H        PHE  77  16.509  -5.128  -0.506
  541    HA   PHE  77           HA       PHE  77  16.613  -2.285   0.237
  542    HB2  PHE  77           2HB      PHE  77  18.329  -3.787  -1.640
  543    HB3  PHE  77           1HB      PHE  77  17.705  -2.261  -2.260
  544    HD1  PHE  77           1HD      PHE  77  19.854  -3.840   0.241
  545    HD2  PHE  77           2HD      PHE  77  18.394  -0.157  -1.310
  546    HE1  PHE  77           1HE      PHE  77  21.612  -2.633   1.467
  547    HE2  PHE  77           2HE      PHE  77  20.150   1.058  -0.088
  548    HZ   PHE  77           HZ       PHE  77  21.763  -0.179   1.302
  549    H    ILE  78           H        ILE  78  15.052  -1.051  -0.622
  550    HA   ILE  78           HA       ILE  78  13.249  -2.312  -2.577
  551    HB   ILE  78           HB       ILE  78  12.747  -0.018  -0.673
  552   HG12  ILE  78          2HG1      ILE  78  11.630  -2.822  -0.753
  553   HG13  ILE  78          1HG1      ILE  78  12.773  -2.197   0.437
  554   HG21  ILE  78          1HG2      ILE  78  10.858  -1.314  -2.634
  555   HG22  ILE  78          2HG2      ILE  78  11.525   0.316  -2.760
  556   HG23  ILE  78          3HG2      ILE  78  10.427  -0.090  -1.443
  557   HD11  ILE  78          3HD1      ILE  78  11.138  -1.318   1.652
  558   HD12  ILE  78          1HD1      ILE  78  10.017  -2.223   0.634
  559   HD13  ILE  78          2HD1      ILE  78  10.406  -0.546   0.242
  560    H    ASP  79           H        ASP  79  12.409  -1.105  -4.287
  561    HA   ASP  79           HA       ASP  79  14.131   1.101  -5.177
  562    HB2  ASP  79           2HB      ASP  79  12.528  -0.989  -6.589
  563    HB3  ASP  79           1HB      ASP  79  12.693   0.581  -7.369
  564    H    TYR  80           H        TYR  80  13.230   2.823  -4.135
  565    HA   TYR  80           HA       TYR  80  10.862   3.475  -3.242
  566    HB2  TYR  80           2HB      TYR  80  12.747   5.062  -3.378
  567    HB3  TYR  80           1HB      TYR  80  12.379   5.341  -5.076
  568    HD1  TYR  80           2HD      TYR  80  10.439   5.287  -1.875
  569    HD2  TYR  80           1HD      TYR  80  11.336   7.348  -5.486
  570    HE1  TYR  80           2HE      TYR  80   8.874   7.073  -1.236
  571    HE2  TYR  80           1HE      TYR  80   9.774   9.140  -4.858
  572    HH   TYR  80           HH       TYR  80   7.569   8.832  -2.261
  573    H    LYS  81           H        LYS  81  11.539   3.473  -6.726
  574    HA   LYS  81           HA       LYS  81   9.010   4.467  -7.509
  575    HB2  LYS  81           2HB      LYS  81  10.794   2.646  -9.130
  576    HB3  LYS  81           1HB      LYS  81   9.597   3.781  -9.738
  577    HG2  LYS  81           2HG      LYS  81  11.165   5.476  -8.377
  578    HG3  LYS  81           1HG      LYS  81  12.355   4.246  -8.812
  579    HD2  LYS  81           2HD      LYS  81  12.512   5.417 -10.728
  580    HD3  LYS  81           1HD      LYS  81  11.041   4.548 -11.165
  581    HE2  LYS  81           2HE      LYS  81  10.572   6.802 -11.621
  582    HE3  LYS  81           1HE      LYS  81   9.775   6.472 -10.084
  583    HZ1  LYS  81           3HZ      LYS  81  12.257   8.000 -10.574
  584    HZ2  LYS  81           1HZ      LYS  81  11.891   7.381  -9.042
  585    HZ3  LYS  81           2HZ      LYS  81  10.853   8.497  -9.773
  586    H    ALA  82           H        ALA  82  10.296   1.136  -7.505
  587    HA   ALA  82           HA       ALA  82   7.981  -0.189  -8.268
  588    HB1  ALA  82           1HB      ALA  82   9.171  -2.048  -7.879
  589    HB2  ALA  82           2HB      ALA  82   9.489  -1.605  -6.201
  590    HB3  ALA  82           3HB      ALA  82  10.499  -0.953  -7.491
  591    H    PHE  83           H        PHE  83   8.835   1.267  -5.238
  592    HA   PHE  83           HA       PHE  83   6.635   0.022  -3.809
  593    HB2  PHE  83           2HB      PHE  83   9.117   1.174  -3.081
  594    HB3  PHE  83           1HB      PHE  83   7.861   2.165  -2.344
  595    HD1  PHE  83           2HD      PHE  83   8.583  -1.451  -2.888
  596    HD2  PHE  83           1HD      PHE  83   7.224   1.573  -0.222
  597    HE1  PHE  83           2HE      PHE  83   8.312  -3.137  -1.123
  598    HE2  PHE  83           1HE      PHE  83   6.950  -0.110   1.553
  599    HZ   PHE  83           HZ       PHE  83   7.495  -2.470   1.104
  600    H    ALA  84           H        ALA  84   7.477   3.076  -5.295
  601    HA   ALA  84           HA       ALA  84   5.237   4.509  -4.200
  602    HB1  ALA  84           1HB      ALA  84   7.383   5.593  -4.844
  603    HB2  ALA  84           2HB      ALA  84   5.958   6.346  -5.560
  604    HB3  ALA  84           3HB      ALA  84   6.979   5.287  -6.533
  605    H    ALA  85           H        ALA  85   5.892   2.650  -7.077
  606    HA   ALA  85           HA       ALA  85   3.646   3.591  -8.546
  607    HB1  ALA  85           1HB      ALA  85   5.642   2.645  -9.636
  608    HB2  ALA  85           2HB      ALA  85   4.153   1.835 -10.128
  609    HB3  ALA  85           3HB      ALA  85   5.226   1.072  -8.954
  610    H    MET  86           H        MET  86   3.958   1.584  -5.983
  611    HA   MET  86           HA       MET  86   1.933  -0.336  -6.487
  612    HB2  MET  86           2HB      MET  86   3.466   0.566  -4.100
  613    HB3  MET  86           1HB      MET  86   1.968  -0.309  -3.819
  614    HG2  MET  86           2HG      MET  86   3.115  -1.908  -5.654
  615    HG3  MET  86           1HG      MET  86   4.549  -1.251  -4.866
  616    HE1  MET  86           3HE      MET  86   4.922  -4.075  -4.284
  617    HE2  MET  86           1HE      MET  86   4.940  -4.074  -2.521
  618    HE3  MET  86           2HE      MET  86   5.651  -2.728  -3.410
  619    H    LEU  87           H        LEU  87   1.982   2.722  -4.684
  620    HA   LEU  87           HA       LEU  87  -0.850   2.616  -4.232
  621    HB2  LEU  87           2HB      LEU  87   1.187   4.740  -3.686
  622    HB3  LEU  87           1HB      LEU  87  -0.499   4.871  -3.222
  623    HG   LEU  87           HG       LEU  87   0.177   2.502  -2.054
  624   HD11  LEU  87          1HD1      LEU  87   2.504   4.100  -1.237
  625   HD12  LEU  87          2HD1      LEU  87   2.611   3.372  -2.839
  626   HD13  LEU  87          3HD1      LEU  87   2.329   2.355  -1.425
  627   HD21  LEU  87          3HD2      LEU  87   0.497   3.947   0.034
  628   HD22  LEU  87          1HD2      LEU  87  -1.030   4.091  -0.838
  629   HD23  LEU  87          2HD2      LEU  87   0.218   5.323  -1.034
  630    H    TYR  88           H        TYR  88   1.027   3.409  -6.680
  631    HA   TYR  88           HA       TYR  88  -0.946   5.238  -7.866
  632    HB2  TYR  88           2HB      TYR  88   2.022   5.115  -8.442
  633    HB3  TYR  88           1HB      TYR  88   0.871   6.186  -9.235
  634    HD1  TYR  88           1HD      TYR  88  -0.751   7.087  -6.933
  635    HD2  TYR  88           2HD      TYR  88   3.454   6.556  -7.296
  636    HE1  TYR  88           1HE      TYR  88  -0.393   8.773  -5.179
  637    HE2  TYR  88           2HE      TYR  88   3.824   8.239  -5.543
  638    HH   TYR  88           HH       TYR  88   1.579   9.234  -3.443
  639    H    SER  89           H        SER  89  -0.656   2.232  -7.888
  640    HA   SER  89           HA       SER  89  -0.220   1.739 -10.737
  641    HB2  SER  89           2HB      SER  89   0.859   0.089  -9.450
  642    HB3  SER  89           1HB      SER  89  -0.502  -0.061  -8.339
  643    HG   SER  89           HG       SER  89  -0.689  -0.745 -11.078
  644    H    VAL  90           H        VAL  90  -2.586   3.183  -9.573
  645    HA   VAL  90           HA       VAL  90  -4.845   3.303  -9.848
  646    HB   VAL  90           HB       VAL  90  -4.453   1.374 -12.132
  647   HG11  VAL  90          1HG1      VAL  90  -6.590   3.207 -11.250
  648   HG12  VAL  90          2HG1      VAL  90  -6.690   1.693 -12.147
  649   HG13  VAL  90          3HG1      VAL  90  -6.250   3.183 -12.980
  650   HG21  VAL  90          3HG2      VAL  90  -2.770   3.124 -12.304
  651   HG22  VAL  90          1HG2      VAL  90  -4.015   4.359 -12.110
  652   HG23  VAL  90          2HG2      VAL  90  -4.007   3.331 -13.544
  653    H    ASP  91           H        ASP  91  -3.788   1.174  -8.118
  654    HA   ASP  91           HA       ASP  91  -5.540  -1.090  -8.488
  655    HB2  ASP  91           2HB      ASP  91  -3.123  -0.850  -7.314
  656    HB3  ASP  91           1HB      ASP  91  -4.157  -0.713  -5.896
  657    H    GLU  92           H        GLU  92  -6.954  -1.832  -6.689
  658    HA   GLU  92           HA       GLU  92  -7.981   0.166  -4.884
  659    HB2  GLU  92           2HB      GLU  92  -9.444  -0.622  -7.365
  660    HB3  GLU  92           1HB      GLU  92 -10.372  -0.346  -5.898
  661    HG2  GLU  92           2HG      GLU  92 -10.433   1.762  -6.653
  662    HG3  GLU  92           1HG      GLU  92  -8.841   1.862  -5.901
  663    H    SER  93           H        SER  93  -8.570  -2.978  -6.423
  664    HA   SER  93           HA       SER  93  -9.310  -4.034  -3.771
  665    HB2  SER  93           2HB      SER  93 -10.548  -4.417  -6.444
  666    HB3  SER  93           1HB      SER  93 -10.457  -5.837  -5.403
  667    HG   SER  93           HG       SER  93 -11.732  -4.864  -3.935
  Start of MODEL   12
    1    H1   MET   1           1HT      MET   1  -5.854 -15.509 -25.857
    2    H2   MET   1           2HT      MET   1  -6.371 -15.879 -27.451
    3    H3   MET   1           3HT      MET   1  -6.580 -17.025 -26.190
    4    HA   MET   1           HA       MET   1  -8.606 -15.851 -26.834
    5    HB2  MET   1           2HB      MET   1  -7.815 -16.783 -24.474
    6    HB3  MET   1           1HB      MET   1  -7.931 -15.087 -24.027
    7    HG2  MET   1           2HG      MET   1 -10.295 -15.365 -25.232
    8    HG3  MET   1           1HG      MET   1 -10.053 -17.027 -24.698
    9    HE1  MET   1           2HE      MET   1 -12.656 -15.948 -23.055
   10    HE2  MET   1           3HE      MET   1 -11.962 -16.782 -21.665
   11    HE3  MET   1           1HE      MET   1 -11.714 -17.420 -23.292
   12    H    GLY   2           H        GLY   2  -9.687 -13.954 -27.134
   13    HA2  GLY   2           2HA      GLY   2  -8.237 -11.611 -27.647
   14    HA3  GLY   2           1HA      GLY   2  -9.986 -11.706 -27.494
   15    H    SER   3           H        SER   3 -10.813 -11.793 -25.205
   16    HA   SER   3           HA       SER   3  -9.551  -9.655 -23.716
   17    HB2  SER   3           2HB      SER   3 -12.192 -11.027 -23.673
   18    HB3  SER   3           1HB      SER   3 -11.641 -10.296 -22.166
   19    HG   SER   3           HG       SER   3 -11.451  -8.323 -23.246
   20    H    SER   4           H        SER   4  -8.700  -9.788 -21.663
   21    HA   SER   4           HA       SER   4  -8.431 -12.476 -20.501
   22    HB2  SER   4           2HB      SER   4  -6.361 -11.471 -21.801
   23    HB3  SER   4           1HB      SER   4  -6.138 -10.563 -20.305
   24    HG   SER   4           HG       SER   4  -5.558 -12.336 -19.309
   25    H    HIS   5           H        HIS   5 -10.263 -10.400 -19.793
   26    HA   HIS   5           HA       HIS   5  -9.195  -9.418 -17.241
   27    HB2  HIS   5           2HB      HIS   5 -10.555  -8.038 -19.115
   28    HB3  HIS   5           1HB      HIS   5 -11.902  -8.602 -18.133
   29    HD1  HIS   5           1HD      HIS   5  -9.137  -6.161 -18.191
   30    HD2  HIS   5           2HD      HIS   5 -11.884  -7.628 -15.441
   31    HE1  HIS   5           1HE      HIS   5  -9.081  -4.551 -16.260
   32    HE2  HIS   5           2HE      HIS   5 -10.815  -5.411 -14.647
   33    H    HIS   6           H        HIS   6 -11.827 -11.299 -18.644
   34    HA   HIS   6           HA       HIS   6 -12.670 -12.086 -15.939
   35    HB2  HIS   6           2HB      HIS   6 -14.745 -12.904 -17.067
   36    HB3  HIS   6           1HB      HIS   6 -14.488 -11.169 -17.228
   37    HD1  HIS   6           1HD      HIS   6 -14.858 -10.321 -19.514
   38    HD2  HIS   6           2HD      HIS   6 -13.695 -14.309 -19.525
   39    HE1  HIS   6           1HE      HIS   6 -14.900 -11.026 -21.927
   40    HE2  HIS   6           2HE      HIS   6 -14.107 -13.418 -21.917
   41    H    HIS   7           H        HIS   7 -13.679 -14.424 -16.013
   42    HA   HIS   7           HA       HIS   7 -11.599 -16.166 -17.148
   43    HB2  HIS   7           2HB      HIS   7 -12.339 -15.982 -14.563
   44    HB3  HIS   7           1HB      HIS   7 -13.463 -17.226 -15.099
   45    HD1  HIS   7           1HD      HIS   7 -12.585 -19.515 -14.849
   46    HD2  HIS   7           2HD      HIS   7  -9.532 -16.751 -15.400
   47    HE1  HIS   7           1HE      HIS   7 -10.449 -20.834 -14.702
   48    HE2  HIS   7           2HE      HIS   7  -8.618 -19.156 -15.126
   49    H    HIS   8           H        HIS   8 -12.691 -18.580 -17.178
   50    HA   HIS   8           HA       HIS   8 -14.812 -18.320 -19.181
   51    HB2  HIS   8           2HB      HIS   8 -12.508 -19.710 -19.327
   52    HB3  HIS   8           1HB      HIS   8 -13.559 -20.957 -18.667
   53    HD1  HIS   8           1HD      HIS   8 -12.639 -19.306 -21.787
   54    HD2  HIS   8           2HD      HIS   8 -15.861 -21.513 -20.370
   55    HE1  HIS   8           1HE      HIS   8 -13.906 -20.034 -23.832
   56    HE2  HIS   8           2HE      HIS   8 -15.803 -21.440 -22.955
   57    H    HIS   9           H        HIS   9 -15.444 -18.033 -16.397
   58    HA   HIS   9           HA       HIS   9 -17.307 -20.286 -16.128
   59    HB2  HIS   9           2HB      HIS   9 -15.318 -19.304 -14.139
   60    HB3  HIS   9           1HB      HIS   9 -16.893 -19.807 -13.537
   61    HD1  HIS   9           1HD      HIS   9 -17.052 -22.206 -12.974
   62    HD2  HIS   9           2HD      HIS   9 -14.109 -21.481 -15.817
   63    HE1  HIS   9           1HE      HIS   9 -15.958 -24.431 -13.393
   64    HE2  HIS   9           2HE      HIS   9 -14.123 -23.952 -15.051
   65    H    HIS  10           H        HIS  10 -19.024 -19.740 -14.415
   66    HA   HIS  10           HA       HIS  10 -20.291 -17.316 -15.215
   67    HB2  HIS  10           2HB      HIS  10 -22.025 -17.980 -13.529
   68    HB3  HIS  10           1HB      HIS  10 -21.672 -19.219 -14.729
   69    HD1  HIS  10           1HD      HIS  10 -22.253 -21.248 -13.349
   70    HD2  HIS  10           2HD      HIS  10 -19.538 -18.735 -11.459
   71    HE1  HIS  10           1HE      HIS  10 -21.455 -22.518 -11.331
   72    HE2  HIS  10           2HE      HIS  10 -19.748 -21.012 -10.251
   73    H    SER  11           H        SER  11 -21.332 -15.921 -13.389
   74    HA   SER  11           HA       SER  11 -19.483 -15.431 -11.186
   75    HB2  SER  11           2HB      SER  11 -20.101 -13.448 -13.373
   76    HB3  SER  11           1HB      SER  11 -19.566 -12.932 -11.773
   77    HG   SER  11           HG       SER  11 -17.702 -13.163 -12.830
   78    H    SER  12           H        SER  12 -21.044 -15.950  -9.701
   79    HA   SER  12           HA       SER  12 -23.529 -14.378  -9.751
   80    HB2  SER  12           2HB      SER  12 -22.838 -17.099  -8.778
   81    HB3  SER  12           1HB      SER  12 -24.017 -16.194  -7.828
   82    HG   SER  12           HG       SER  12 -25.075 -15.830  -9.953
   83    H    GLY  13           H        GLY  13 -23.970 -12.935  -8.187
   84    HA2  GLY  13           2HA      GLY  13 -21.874 -12.329  -6.278
   85    HA3  GLY  13           1HA      GLY  13 -23.327 -11.385  -6.570
   86    H    LEU  14           H        LEU  14 -22.261 -11.998  -4.013
   87    HA   LEU  14           HA       LEU  14 -24.501 -13.560  -2.925
   88    HB2  LEU  14           2HB      LEU  14 -21.714 -13.642  -1.787
   89    HB3  LEU  14           1HB      LEU  14 -23.088 -14.625  -1.321
   90    HG   LEU  14           HG       LEU  14 -22.933 -15.400  -3.860
   91   HD11  LEU  14          1HD1      LEU  14 -21.143 -14.012  -4.565
   92   HD12  LEU  14          2HD1      LEU  14 -20.499 -15.648  -4.428
   93   HD13  LEU  14          3HD1      LEU  14 -20.160 -14.459  -3.170
   94   HD21  LEU  14          3HD2      LEU  14 -22.009 -17.372  -3.087
   95   HD22  LEU  14          1HD2      LEU  14 -22.639 -16.655  -1.605
   96   HD23  LEU  14          2HD2      LEU  14 -20.918 -16.547  -1.974
   97    H    VAL  15           H        VAL  15 -24.106 -13.254  -0.275
   98    HA   VAL  15           HA       VAL  15 -24.769 -10.479   0.108
   99    HB   VAL  15           HB       VAL  15 -24.435 -12.518   2.300
  100   HG11  VAL  15          1HG1      VAL  15 -25.502 -11.055   3.643
  101   HG12  VAL  15          2HG1      VAL  15 -26.561 -10.481   2.356
  102   HG13  VAL  15          3HG1      VAL  15 -24.911  -9.872   2.476
  103   HG21  VAL  15          3HG2      VAL  15 -25.911 -13.677   0.955
  104   HG22  VAL  15          1HG2      VAL  15 -26.634 -12.207   0.301
  105   HG23  VAL  15          2HG2      VAL  15 -27.011 -12.719   1.946
  106    HA   PRO  16           HA       PRO  16 -20.693 -10.966   2.929
  107    HB2  PRO  16           2HB      PRO  16 -19.264 -12.620   0.898
  108    HB3  PRO  16           1HB      PRO  16 -19.121 -12.630   2.660
  109    HG2  PRO  16           2HG      PRO  16 -20.454 -14.555   1.401
  110    HG3  PRO  16           1HG      PRO  16 -21.041 -13.901   2.941
  111    HD2  PRO  16           2HD      PRO  16 -22.043 -13.425   0.173
  112    HD3  PRO  16           1HD      PRO  16 -22.941 -13.522   1.699
  113    H    ARG  17           H        ARG  17 -18.376 -10.187   2.279
  114    HA   ARG  17           HA       ARG  17 -17.108  -8.582   1.288
  115    HB2  ARG  17           2HB      ARG  17 -18.524  -9.849  -1.005
  116    HB3  ARG  17           1HB      ARG  17 -17.682  -8.336  -1.304
  117    HG2  ARG  17           2HG      ARG  17 -15.962  -9.717  -1.742
  118    HG3  ARG  17           1HG      ARG  17 -15.758  -9.654   0.011
  119    HD2  ARG  17           2HD      ARG  17 -16.724 -11.745   0.325
  120    HD3  ARG  17           1HD      ARG  17 -17.535 -11.712  -1.241
  121    HE   ARG  17           HE       ARG  17 -14.854 -12.591  -0.694
  122   HH11  ARG  17          1HH1      ARG  17 -17.012 -11.345  -3.136
  123   HH12  ARG  17          2HH1      ARG  17 -16.098 -11.997  -4.455
  124   HH21  ARG  17          1HH2      ARG  17 -13.650 -13.450  -2.427
  125   HH22  ARG  17          2HH2      ARG  17 -14.190 -13.193  -4.052
  126    H    GLY  18           H        GLY  18 -17.818  -6.759   2.319
  127    HA2  GLY  18           2HA      GLY  18 -20.275  -5.455   1.709
  128    HA3  GLY  18           1HA      GLY  18 -18.957  -4.789   2.660
  129    H    SER  19           H        SER  19 -18.169  -2.974   1.853
  130    HA   SER  19           HA       SER  19 -17.763  -2.755  -1.037
  131    HB2  SER  19           2HB      SER  19 -19.970  -1.628  -0.103
  132    HB3  SER  19           1HB      SER  19 -18.849  -0.356   0.380
  133    HG   SER  19           HG       SER  19 -19.222   0.261  -1.616
  134    H    HIS  20           H        HIS  20 -15.559  -2.838  -0.826
  135    HA   HIS  20           HA       HIS  20 -14.035  -1.519   1.118
  136    HB2  HIS  20           2HB      HIS  20 -13.541  -2.999  -1.335
  137    HB3  HIS  20           1HB      HIS  20 -12.401  -1.671  -1.137
  138    HD1  HIS  20           1HD      HIS  20 -13.766  -3.624   1.776
  139    HD2  HIS  20           2HD      HIS  20 -10.256  -3.266  -0.420
  140    HE1  HIS  20           1HE      HIS  20 -12.034  -4.919   3.060
  141    HE2  HIS  20           2HE      HIS  20  -9.941  -4.759   1.669
  142    H    MET  21           H        MET  21 -12.183   0.062   0.156
  143    HA   MET  21           HA       MET  21 -13.229   2.097  -1.595
  144    HB2  MET  21           2HB      MET  21 -14.037   2.386   0.951
  145    HB3  MET  21           1HB      MET  21 -12.478   3.190   1.058
  146    HG2  MET  21           2HG      MET  21 -13.131   4.936  -0.210
  147    HG3  MET  21           1HG      MET  21 -14.192   3.952  -1.217
  148    HE1  MET  21           3HE      MET  21 -13.861   6.057   2.087
  149    HE2  MET  21           1HE      MET  21 -15.457   6.793   1.934
  150    HE3  MET  21           2HE      MET  21 -14.306   6.899   0.601
  151    H    SER  22           H        SER  22 -11.611   4.149  -1.249
  152    HA   SER  22           HA       SER  22  -8.983   3.000  -1.718
  153    HB2  SER  22           2HB      SER  22 -10.344   5.517  -2.518
  154    HB3  SER  22           1HB      SER  22  -8.590   5.575  -2.336
  155    HG   SER  22           HG       SER  22  -8.681   4.840  -4.321
  156    H    ASP  23           H        ASP  23 -10.486   3.915   0.902
  157    HA   ASP  23           HA       ASP  23  -8.675   5.734   2.109
  158    HB2  ASP  23           2HB      ASP  23 -10.667   3.881   3.386
  159    HB3  ASP  23           1HB      ASP  23  -9.867   5.225   4.198
  160    H    GLU  24           H        GLU  24  -8.555   2.512   1.478
  161    HA   GLU  24           HA       GLU  24  -7.055   1.550   3.650
  162    HB2  GLU  24           2HB      GLU  24  -7.184   0.555   0.815
  163    HB3  GLU  24           1HB      GLU  24  -6.428  -0.323   2.137
  164    HG2  GLU  24           2HG      GLU  24  -9.181   0.485   2.679
  165    HG3  GLU  24           1HG      GLU  24  -9.008  -0.616   1.313
  166    H    LYS  25           H        LYS  25  -6.288   3.555   1.151
  167    HA   LYS  25           HA       LYS  25  -3.424   3.043   1.219
  168    HB2  LYS  25           2HB      LYS  25  -4.499   3.477  -0.954
  169    HB3  LYS  25           1HB      LYS  25  -5.007   5.062  -0.383
  170    HG2  LYS  25           2HG      LYS  25  -2.363   5.238   0.061
  171    HG3  LYS  25           1HG      LYS  25  -2.374   4.137  -1.319
  172    HD2  LYS  25           2HD      LYS  25  -2.417   6.058  -2.506
  173    HD3  LYS  25           1HD      LYS  25  -4.148   5.984  -2.164
  174    HE2  LYS  25           2HE      LYS  25  -2.464   7.266  -0.107
  175    HE3  LYS  25           1HE      LYS  25  -2.612   8.129  -1.637
  176    HZ1  LYS  25           3HZ      LYS  25  -4.638   7.571   0.386
  177    HZ2  LYS  25           1HZ      LYS  25  -5.145   7.548  -1.229
  178    HZ3  LYS  25           2HZ      LYS  25  -4.429   8.938  -0.586
  179    H    THR  26           H        THR  26  -5.786   5.275   2.440
  180    HA   THR  26           HA       THR  26  -4.033   7.396   3.077
  181    HB   THR  26           HB       THR  26  -6.122   7.492   4.934
  182    HG1  THR  26           1HG      THR  26  -7.405   6.022   4.060
  183   HG21  THR  26          3HG2      THR  26  -6.972   8.821   2.606
  184   HG22  THR  26          1HG2      THR  26  -5.212   8.969   2.669
  185   HG23  THR  26          2HG2      THR  26  -6.198   9.506   4.034
  186    H    GLN  27           H        GLN  27  -4.805   4.396   4.654
  187    HA   GLN  27           HA       GLN  27  -3.941   5.002   7.254
  188    HB2  GLN  27           2HB      GLN  27  -4.247   2.520   5.643
  189    HB3  GLN  27           1HB      GLN  27  -3.232   2.421   7.075
  190    HG2  GLN  27           2HG      GLN  27  -5.877   3.699   7.398
  191    HG3  GLN  27           1HG      GLN  27  -5.852   1.959   7.117
  192   HE21  GLN  27          1HE2      GLN  27  -4.154   0.801   8.502
  193   HE22  GLN  27          2HE2      GLN  27  -4.113   1.250  10.169
  194    H    LEU  28           H        LEU  28  -2.249   4.552   4.296
  195    HA   LEU  28           HA       LEU  28   0.328   4.163   5.540
  196    HB2  LEU  28           2HB      LEU  28  -0.301   3.008   3.442
  197    HB3  LEU  28           1HB      LEU  28  -0.401   4.575   2.659
  198    HG   LEU  28           HG       LEU  28   2.184   4.137   3.939
  199   HD11  LEU  28          1HD1      LEU  28   1.058   2.025   2.231
  200   HD12  LEU  28          2HD1      LEU  28   2.372   1.961   3.405
  201   HD13  LEU  28          3HD1      LEU  28   2.670   2.585   1.783
  202   HD21  LEU  28          3HD2      LEU  28   2.842   4.652   1.484
  203   HD22  LEU  28          1HD2      LEU  28   2.095   5.916   2.462
  204   HD23  LEU  28          2HD2      LEU  28   1.130   5.025   1.284
  205    H    ILE  29           H        ILE  29  -1.611   6.670   4.748
  206    HA   ILE  29           HA       ILE  29   0.210   8.631   3.909
  207    HB   ILE  29           HB       ILE  29  -2.441   8.927   5.255
  208   HG12  ILE  29          2HG1      ILE  29  -2.283   7.762   3.002
  209   HG13  ILE  29          1HG1      ILE  29  -3.404   9.113   3.124
  210   HG21  ILE  29          1HG2      ILE  29  -0.734  11.006   3.895
  211   HG22  ILE  29          2HG2      ILE  29  -1.266  10.984   5.577
  212   HG23  ILE  29          3HG2      ILE  29  -2.438  11.237   4.284
  213   HD11  ILE  29          3HD1      ILE  29  -2.414  10.130   1.456
  214   HD12  ILE  29          1HD1      ILE  29  -1.382   8.715   1.251
  215   HD13  ILE  29          2HD1      ILE  29  -0.847  10.050   2.273
  216    H    GLU  30           H        GLU  30  -0.280   7.228   6.771
  217    HA   GLU  30           HA       GLU  30   0.515   9.362   8.486
  218    HB2  GLU  30           2HB      GLU  30  -0.198   6.515   8.872
  219    HB3  GLU  30           1HB      GLU  30   0.831   7.246  10.094
  220    HG2  GLU  30           2HG      GLU  30  -1.550   8.798   9.331
  221    HG3  GLU  30           1HG      GLU  30  -1.853   7.279  10.171
  222    H    ALA  31           H        ALA  31   2.170   7.795   6.322
  223    HA   ALA  31           HA       ALA  31   4.617   7.387   7.859
  224    HB1  ALA  31           1HB      ALA  31   5.295   5.987   6.232
  225    HB2  ALA  31           2HB      ALA  31   4.712   7.038   4.940
  226    HB3  ALA  31           3HB      ALA  31   3.587   5.979   5.791
  227    H    PHE  32           H        PHE  32   3.391   9.362   5.187
  228    HA   PHE  32           HA       PHE  32   5.749  10.759   4.620
  229    HB2  PHE  32           2HB      PHE  32   2.846  11.243   4.159
  230    HB3  PHE  32           1HB      PHE  32   3.948  12.597   3.940
  231    HD1  PHE  32           2HD      PHE  32   6.198  11.779   2.604
  232    HD2  PHE  32           1HD      PHE  32   2.284  10.149   2.237
  233    HE1  PHE  32           2HE      PHE  32   6.754  10.960   0.351
  234    HE2  PHE  32           1HE      PHE  32   2.833   9.325  -0.016
  235    HZ   PHE  32           HZ       PHE  32   5.071   9.732  -0.963
  236    H    TYR  33           H        TYR  33   3.417  11.136   7.177
  237    HA   TYR  33           HA       TYR  33   4.595  13.682   7.998
  238    HB2  TYR  33           2HB      TYR  33   2.283  12.201   9.261
  239    HB3  TYR  33           1HB      TYR  33   2.748  13.876   9.535
  240    HD1  TYR  33           2HD      TYR  33   3.094  15.020   6.944
  241    HD2  TYR  33           1HD      TYR  33   0.243  12.120   8.191
  242    HE1  TYR  33           2HE      TYR  33   1.585  15.737   5.139
  243    HE2  TYR  33           1HE      TYR  33  -1.274  12.826   6.390
  244    HH   TYR  33           HH       TYR  33  -1.680  14.780   4.984
  245    H    ASN  34           H        ASN  34   6.283  11.448   8.179
  246    HA   ASN  34           HA       ASN  34   7.014  11.603  10.947
  247    HB2  ASN  34           2HB      ASN  34   5.228   9.633  10.471
  248    HB3  ASN  34           1HB      ASN  34   6.723   8.774  10.113
  249   HD21  ASN  34          1HD2      ASN  34   8.483   9.701  11.880
  250   HD22  ASN  34          2HD2      ASN  34   7.973   9.379  13.498
  251    H    PHE  35           H        PHE  35   8.128  12.189   8.308
  252    HA   PHE  35           HA       PHE  35  10.769  11.350   8.728
  253    HB2  PHE  35           2HB      PHE  35   9.588   9.200   7.860
  254    HB3  PHE  35           1HB      PHE  35   9.637  10.001   6.293
  255    HD1  PHE  35           2HD      PHE  35  11.822   8.979   9.121
  256    HD2  PHE  35           1HD      PHE  35  11.523   9.830   4.963
  257    HE1  PHE  35           2HE      PHE  35  14.131   8.195   8.800
  258    HE2  PHE  35           1HE      PHE  35  13.832   9.045   4.632
  259    HZ   PHE  35           HZ       PHE  35  15.139   8.227   6.552
  260    H    ASP  36           H        ASP  36  10.670  13.700   8.425
  261    HA   ASP  36           HA       ASP  36  10.764  14.426   5.570
  262    HB2  ASP  36           2HB      ASP  36  10.181  16.764   6.379
  263    HB3  ASP  36           1HB      ASP  36   8.892  15.567   6.484
  264    H    GLY  37           H        GLY  37  13.023  13.411   6.647
  265    HA2  GLY  37           2HA      GLY  37  14.672  15.666   7.529
  266    HA3  GLY  37           1HA      GLY  37  15.137  13.972   7.559
  267    H    ASP  38           H        ASP  38  13.676  15.393   4.733
  268    HA   ASP  38           HA       ASP  38  14.444  15.747   2.623
  269    HB2  ASP  38           2HB      ASP  38  17.020  16.360   4.084
  270    HB3  ASP  38           1HB      ASP  38  16.725  16.704   2.382
  271    H    TYR  39           H        TYR  39  14.105  13.312   2.612
  272    HA   TYR  39           HA       TYR  39  16.634  11.880   2.187
  273    HB2  TYR  39           2HB      TYR  39  14.434  11.143   3.655
  274    HB3  TYR  39           1HB      TYR  39  14.158  10.302   2.132
  275    HD1  TYR  39           1HD      TYR  39  16.888  10.895   4.616
  276    HD2  TYR  39           2HD      TYR  39  15.087   8.203   1.857
  277    HE1  TYR  39           1HE      TYR  39  18.464   9.140   5.309
  278    HE2  TYR  39           2HE      TYR  39  16.657   6.440   2.542
  279    HH   TYR  39           HH       TYR  39  19.404   7.084   4.494
  280    H    ASP  40           H        ASP  40  16.999  10.702   0.301
  281    HA   ASP  40           HA       ASP  40  15.947  11.829  -2.074
  282    HB2  ASP  40           2HB      ASP  40  17.300  10.150  -3.238
  283    HB3  ASP  40           1HB      ASP  40  18.221  10.907  -1.943
  284    H    GLY  41           H        GLY  41  15.435   9.904  -3.861
  285    HA2  GLY  41           2HA      GLY  41  12.856   8.886  -2.933
  286    HA3  GLY  41           1HA      GLY  41  13.379   9.017  -4.605
  287    H    PHE  42           H        PHE  42  15.037   7.484  -1.872
  288    HA   PHE  42           HA       PHE  42  14.422   4.835  -2.851
  289    HB2  PHE  42           2HB      PHE  42  17.182   6.023  -3.067
  290    HB3  PHE  42           1HB      PHE  42  16.929   4.283  -2.962
  291    HD1  PHE  42           1HD      PHE  42  15.128   3.355  -4.673
  292    HD2  PHE  42           2HD      PHE  42  17.328   6.966  -5.150
  293    HE1  PHE  42           1HE      PHE  42  14.746   3.261  -7.102
  294    HE2  PHE  42           2HE      PHE  42  16.950   6.880  -7.580
  295    HZ   PHE  42           HZ       PHE  42  15.658   5.027  -8.559
  296    H    VAL  43           H        VAL  43  14.145   3.570  -1.142
  297    HA   VAL  43           HA       VAL  43  15.724   4.101   1.283
  298    HB   VAL  43           HB       VAL  43  13.455   4.952   1.633
  299   HG11  VAL  43          1HG1      VAL  43  12.651   2.160   0.856
  300   HG12  VAL  43          2HG1      VAL  43  12.131   3.689   0.146
  301   HG13  VAL  43          3HG1      VAL  43  11.590   3.239   1.763
  302   HG21  VAL  43          3HG2      VAL  43  14.772   3.845   3.471
  303   HG22  VAL  43          1HG2      VAL  43  13.801   2.398   3.195
  304   HG23  VAL  43          2HG2      VAL  43  13.027   3.894   3.717
  305    H    SER  44           H        SER  44  16.507   2.345   2.347
  306    HA   SER  44           HA       SER  44  16.313  -0.201   0.958
  307    HB2  SER  44           2HB      SER  44  18.180  -0.899   2.311
  308    HB3  SER  44           1HB      SER  44  18.512   0.736   1.741
  309    HG   SER  44           HG       SER  44  18.712   0.041   4.148
  310    H    VAL  45           H        VAL  45  15.747  -2.166   1.985
  311    HA   VAL  45           HA       VAL  45  13.444  -2.082   3.562
  312    HB   VAL  45           HB       VAL  45  15.375  -4.393   3.299
  313   HG11  VAL  45          1HG1      VAL  45  13.660  -5.808   4.013
  314   HG12  VAL  45          2HG1      VAL  45  12.425  -4.572   3.794
  315   HG13  VAL  45          3HG1      VAL  45  13.577  -4.440   5.122
  316   HG21  VAL  45          3HG2      VAL  45  14.256  -5.073   1.367
  317   HG22  VAL  45          1HG2      VAL  45  14.441  -3.333   1.157
  318   HG23  VAL  45          2HG2      VAL  45  12.890  -3.998   1.668
  319    H    GLU  46           H        GLU  46  16.778  -2.906   4.486
  320    HA   GLU  46           HA       GLU  46  16.403  -3.447   7.162
  321    HB2  GLU  46           2HB      GLU  46  18.780  -1.898   6.147
  322    HB3  GLU  46           1HB      GLU  46  18.721  -3.059   7.466
  323    HG2  GLU  46           2HG      GLU  46  18.093  -4.775   5.673
  324    HG3  GLU  46           1HG      GLU  46  18.652  -3.569   4.517
  325    H    GLU  47           H        GLU  47  16.395  -0.371   5.531
  326    HA   GLU  47           HA       GLU  47  16.418   1.111   8.041
  327    HB2  GLU  47           2HB      GLU  47  17.568   1.805   5.803
  328    HB3  GLU  47           1HB      GLU  47  15.958   2.345   5.343
  329    HG2  GLU  47           2HG      GLU  47  15.979   4.090   6.781
  330    HG3  GLU  47           1HG      GLU  47  16.964   3.242   7.972
  331    H    PHE  48           H        PHE  48  14.233   0.108   5.508
  332    HA   PHE  48           HA       PHE  48  12.059   1.780   6.081
  333    HB2  PHE  48           2HB      PHE  48  12.595  -0.194   4.243
  334    HB3  PHE  48           1HB      PHE  48  11.340  -0.937   5.232
  335    HD1  PHE  48           1HD      PHE  48   9.723   1.452   5.926
  336    HD2  PHE  48           2HD      PHE  48  11.516   0.273   2.249
  337    HE1  PHE  48           1HE      PHE  48   8.012   2.717   4.691
  338    HE2  PHE  48           2HE      PHE  48   9.808   1.538   1.007
  339    HZ   PHE  48           HZ       PHE  48   8.054   2.762   2.228
  340    H    ARG  49           H        ARG  49  12.964  -1.388   7.378
  341    HA   ARG  49           HA       ARG  49  10.684  -1.905   8.888
  342    HB2  ARG  49           2HB      ARG  49  13.537  -2.622   9.588
  343    HB3  ARG  49           1HB      ARG  49  12.090  -3.395  10.222
  344    HG2  ARG  49           2HG      ARG  49  11.663  -4.515   8.264
  345    HG3  ARG  49           1HG      ARG  49  12.535  -3.341   7.277
  346    HD2  ARG  49           2HD      ARG  49  14.652  -4.149   8.137
  347    HD3  ARG  49           1HD      ARG  49  13.814  -5.270   9.210
  348    HE   ARG  49           HE       ARG  49  12.916  -5.963   6.750
  349   HH11  ARG  49          1HH1      ARG  49  16.101  -5.555   8.116
  350   HH12  ARG  49          2HH1      ARG  49  16.831  -6.742   7.088
  351   HH21  ARG  49          1HH2      ARG  49  13.874  -7.524   5.397
  352   HH22  ARG  49          2HH2      ARG  49  15.567  -7.861   5.545
  353    H    GLY  50           H        GLY  50  13.664  -0.203   9.835
  354    HA2  GLY  50           2HA      GLY  50  12.945   0.330  12.490
  355    HA3  GLY  50           1HA      GLY  50  14.081   1.276  11.540
  356    H    ILE  51           H        ILE  51  11.967   1.869   9.523
  357    HA   ILE  51           HA       ILE  51  10.876   4.189  10.878
  358    HB   ILE  51           HB       ILE  51  10.426   3.409   8.001
  359   HG12  ILE  51          2HG1      ILE  51  12.540   5.374   8.732
  360   HG13  ILE  51          1HG1      ILE  51  12.914   3.666   8.942
  361   HG21  ILE  51          1HG2      ILE  51   8.970   5.154   8.862
  362   HG22  ILE  51          2HG2      ILE  51  10.112   5.820   7.694
  363   HG23  ILE  51          3HG2      ILE  51  10.370   6.068   9.420
  364   HD11  ILE  51          3HD1      ILE  51  11.831   3.706   6.441
  365   HD12  ILE  51          1HD1      ILE  51  13.555   3.753   6.811
  366   HD13  ILE  51          2HD1      ILE  51  12.678   5.253   6.509
  367    H    ILE  52           H        ILE  52   9.620   1.440   9.005
  368    HA   ILE  52           HA       ILE  52   6.907   2.007   9.267
  369    HB   ILE  52           HB       ILE  52   8.164   0.191   7.856
  370   HG12  ILE  52          2HG1      ILE  52   5.911  -1.181   7.953
  371   HG13  ILE  52          1HG1      ILE  52   5.389   0.167   8.960
  372   HG21  ILE  52          1HG2      ILE  52   7.294  -1.458  10.220
  373   HG22  ILE  52          2HG2      ILE  52   8.966  -1.074   9.815
  374   HG23  ILE  52          3HG2      ILE  52   7.996  -2.056   8.718
  375   HD11  ILE  52          3HD1      ILE  52   6.714   0.963   6.479
  376   HD12  ILE  52          1HD1      ILE  52   5.224   1.552   7.219
  377   HD13  ILE  52          2HD1      ILE  52   5.207   0.074   6.257
  378    H    ARG  53           H        ARG  53   9.069   0.202  11.405
  379    HA   ARG  53           HA       ARG  53   7.303  -0.965  13.146
  380    HB2  ARG  53           2HB      ARG  53   9.984  -0.714  13.090
  381    HB3  ARG  53           1HB      ARG  53   9.618   0.394  14.405
  382    HG2  ARG  53           2HG      ARG  53   8.972  -1.261  15.804
  383    HG3  ARG  53           1HG      ARG  53   8.313  -2.256  14.504
  384    HD2  ARG  53           2HD      ARG  53  11.264  -1.821  14.902
  385    HD3  ARG  53           1HD      ARG  53  10.381  -3.146  15.659
  386    HE   ARG  53           HE       ARG  53  10.006  -3.001  12.817
  387   HH11  ARG  53          1HH1      ARG  53  12.071  -4.202  15.362
  388   HH12  ARG  53          2HH1      ARG  53  12.725  -5.484  14.398
  389   HH21  ARG  53          1HH2      ARG  53  10.866  -4.686  11.547
  390   HH22  ARG  53          2HH2      ARG  53  12.041  -5.758  12.232
  391    H    ASP  54           H        ASP  54   8.863   2.160  13.875
  392    HA   ASP  54           HA       ASP  54   6.609   2.839  15.598
  393    HB2  ASP  54           2HB      ASP  54   9.244   3.157  16.017
  394    HB3  ASP  54           1HB      ASP  54   8.888   4.715  15.278
  395    H    GLY  55           H        GLY  55   6.805   2.955  12.488
  396    HA2  GLY  55           2HA      GLY  55   5.986   5.773  12.194
  397    HA3  GLY  55           1HA      GLY  55   6.610   4.770  10.894
  398    H    LEU  56           H        LEU  56   5.197   2.615  10.727
  399    HA   LEU  56           HA       LEU  56   2.364   3.414  10.798
  400    HB2  LEU  56           2HB      LEU  56   3.798   2.003   8.547
  401    HB3  LEU  56           1HB      LEU  56   2.065   2.255   8.627
  402    HG   LEU  56           HG       LEU  56   2.769   4.793   8.831
  403   HD11  LEU  56          1HD1      LEU  56   5.250   3.803   8.715
  404   HD12  LEU  56          2HD1      LEU  56   4.817   5.394   8.089
  405   HD13  LEU  56          3HD1      LEU  56   4.946   4.019   6.991
  406   HD21  LEU  56          3HD2      LEU  56   3.095   3.709   6.089
  407   HD22  LEU  56          1HD2      LEU  56   2.072   5.021   6.677
  408   HD23  LEU  56          2HD2      LEU  56   1.595   3.344   6.942
  409    HA   PRO  57           HA       PRO  57   1.906  -0.577  12.702
  410    HB2  PRO  57           2HB      PRO  57  -0.770  -0.696  12.816
  411    HB3  PRO  57           1HB      PRO  57   0.144   0.455  13.800
  412    HG2  PRO  57           2HG      PRO  57  -1.342   0.910  11.244
  413    HG3  PRO  57           1HG      PRO  57  -1.277   1.924  12.696
  414    HD2  PRO  57           2HD      PRO  57   0.217   2.369  10.430
  415    HD3  PRO  57           1HD      PRO  57   0.675   2.925  12.052
  416    H    MET  58           H        MET  58   2.718  -1.028  10.222
  417    HA   MET  58           HA       MET  58   0.695  -2.434   8.692
  418    HB2  MET  58           2HB      MET  58   2.667  -1.005   7.780
  419    HB3  MET  58           1HB      MET  58   3.635  -2.442   8.076
  420    HG2  MET  58           2HG      MET  58   2.722  -3.579   6.360
  421    HG3  MET  58           1HG      MET  58   1.136  -2.839   6.563
  422    HE1  MET  58           3HE      MET  58   2.404  -3.015   3.289
  423    HE2  MET  58           1HE      MET  58   3.636  -3.531   4.439
  424    HE3  MET  58           2HE      MET  58   3.959  -2.184   3.346
  425    H    THR  59           H        THR  59   0.507  -4.616   8.476
  426    HA   THR  59           HA       THR  59   1.733  -6.254  10.501
  427    HB   THR  59           HB       THR  59   0.451  -8.086   9.116
  428    HG1  THR  59           1HG      THR  59  -1.030  -5.813   8.342
  429   HG21  THR  59          3HG2      THR  59  -1.488  -7.775  10.380
  430   HG22  THR  59          1HG2      THR  59  -1.255  -6.029  10.469
  431   HG23  THR  59          2HG2      THR  59  -0.187  -7.107  11.366
  432    H    GLU  60           H        GLU  60   3.222  -7.825  10.272
  433    HA   GLU  60           HA       GLU  60   5.364  -7.649   8.673
  434    HB2  GLU  60           2HB      GLU  60   5.992  -9.527   9.733
  435    HB3  GLU  60           1HB      GLU  60   4.413  -9.485  10.494
  436    HG2  GLU  60           2HG      GLU  60   3.518 -10.978   8.835
  437    HG3  GLU  60           1HG      GLU  60   5.050 -10.971   7.963
  438    H    ALA  61           H        ALA  61   2.523  -9.580   7.917
  439    HA   ALA  61           HA       ALA  61   3.239 -10.723   5.542
  440    HB1  ALA  61           1HB      ALA  61   0.784 -10.572   4.949
  441    HB2  ALA  61           2HB      ALA  61   0.577  -9.673   6.453
  442    HB3  ALA  61           3HB      ALA  61   1.171 -11.334   6.493
  443    H    GLU  62           H        GLU  62   1.590  -7.571   5.875
  444    HA   GLU  62           HA       GLU  62   1.644  -6.901   3.166
  445    HB2  GLU  62           2HB      GLU  62   2.070  -4.620   4.977
  446    HB3  GLU  62           1HB      GLU  62   0.825  -4.877   3.768
  447    HG2  GLU  62           2HG      GLU  62   0.885  -5.931   6.578
  448    HG3  GLU  62           1HG      GLU  62  -0.199  -4.713   5.913
  449    H    ILE  63           H        ILE  63   3.884  -5.748   5.692
  450    HA   ILE  63           HA       ILE  63   5.731  -4.543   3.965
  451    HB   ILE  63           HB       ILE  63   6.542  -5.875   6.539
  452   HG12  ILE  63          2HG1      ILE  63   5.962  -3.297   7.245
  453   HG13  ILE  63          1HG1      ILE  63   4.660  -3.656   6.115
  454   HG21  ILE  63          1HG2      ILE  63   8.130  -4.678   4.846
  455   HG22  ILE  63          2HG2      ILE  63   8.305  -4.402   6.579
  456   HG23  ILE  63          3HG2      ILE  63   7.476  -3.212   5.576
  457   HD11  ILE  63          3HD1      ILE  63   3.608  -4.612   7.802
  458   HD12  ILE  63          1HD1      ILE  63   5.039  -4.536   8.829
  459   HD13  ILE  63          2HD1      ILE  63   4.810  -5.898   7.728
  460    H    THR  64           H        THR  64   6.082  -7.682   5.606
  461    HA   THR  64           HA       THR  64   8.359  -8.564   4.316
  462    HB   THR  64           HB       THR  64   6.000 -10.148   5.317
  463    HG1  THR  64           1HG      THR  64   7.012  -8.986   6.943
  464   HG21  THR  64          3HG2      THR  64   8.772 -11.124   4.699
  465   HG22  THR  64          1HG2      THR  64   7.290 -11.559   3.849
  466   HG23  THR  64          2HG2      THR  64   7.517 -12.043   5.531
  467    H    GLU  65           H        GLU  65   4.967  -9.203   3.417
  468    HA   GLU  65           HA       GLU  65   5.624 -10.619   1.070
  469    HB2  GLU  65           2HB      GLU  65   3.391 -10.665   2.253
  470    HB3  GLU  65           1HB      GLU  65   3.074  -9.099   1.522
  471    HG2  GLU  65           2HG      GLU  65   2.985  -9.989  -0.633
  472    HG3  GLU  65           1HG      GLU  65   3.788 -11.481  -0.145
  473    H    PHE  66           H        PHE  66   5.745  -7.427   1.840
  474    HA   PHE  66           HA       PHE  66   5.605  -6.521  -0.914
  475    HB2  PHE  66           2HB      PHE  66   5.548  -5.119   1.726
  476    HB3  PHE  66           1HB      PHE  66   6.066  -4.231   0.300
  477    HD1  PHE  66           1HD      PHE  66   3.522  -6.875   0.145
  478    HD2  PHE  66           2HD      PHE  66   4.243  -2.685   0.349
  479    HE1  PHE  66           1HE      PHE  66   1.174  -6.446  -0.450
  480    HE2  PHE  66           2HE      PHE  66   1.896  -2.250  -0.244
  481    HZ   PHE  66           HZ       PHE  66   0.358  -4.131  -0.645
  482    H    PHE  67           H        PHE  67   7.842  -7.144   1.657
  483    HA   PHE  67           HA       PHE  67  10.052  -5.696   0.552
  484    HB2  PHE  67           2HB      PHE  67   9.701  -7.729   2.726
  485    HB3  PHE  67           1HB      PHE  67  11.320  -7.343   2.159
  486    HD1  PHE  67           2HD      PHE  67  10.035  -4.319   1.645
  487    HD2  PHE  67           1HD      PHE  67  10.656  -6.965   4.928
  488    HE1  PHE  67           2HE      PHE  67  10.094  -2.402   3.182
  489    HE2  PHE  67           1HE      PHE  67  10.718  -5.046   6.464
  490    HZ   PHE  67           HZ       PHE  67  10.439  -2.762   5.591
  491    H    GLU  68           H        GLU  68   8.737  -8.900   0.167
  492    HA   GLU  68           HA       GLU  68  11.068  -9.827  -1.308
  493    HB2  GLU  68           2HB      GLU  68   9.655 -11.925  -1.563
  494    HB3  GLU  68           1HB      GLU  68  10.128 -11.498   0.075
  495    HG2  GLU  68           2HG      GLU  68   8.018 -11.207   0.739
  496    HG3  GLU  68           1HG      GLU  68   7.566 -10.366  -0.743
  497    H    ALA  69           H        ALA  69   7.894  -8.549  -1.887
  498    HA   ALA  69           HA       ALA  69   7.903  -9.319  -4.673
  499    HB1  ALA  69           1HB      ALA  69   5.944  -7.609  -3.182
  500    HB2  ALA  69           2HB      ALA  69   5.809  -9.357  -3.380
  501    HB3  ALA  69           3HB      ALA  69   5.713  -8.297  -4.788
  502    H    ALA  70           H        ALA  70   9.099  -6.883  -2.855
  503    HA   ALA  70           HA       ALA  70   8.986  -4.861  -4.962
  504    HB1  ALA  70           1HB      ALA  70  10.098  -3.410  -3.206
  505    HB2  ALA  70           2HB      ALA  70   9.824  -4.737  -2.076
  506    HB3  ALA  70           3HB      ALA  70   8.454  -3.943  -2.857
  507    H    ASP  71           H        ASP  71  11.201  -7.014  -3.347
  508    HA   ASP  71           HA       ASP  71  13.382  -6.002  -5.050
  509    HB2  ASP  71           2HB      ASP  71  13.630  -5.815  -2.506
  510    HB3  ASP  71           1HB      ASP  71  13.778  -7.570  -2.505
  511    HA   PRO  72           HA       PRO  72  12.919 -10.004  -7.022
  512    HB2  PRO  72           2HB      PRO  72  15.082  -9.782  -8.671
  513    HB3  PRO  72           1HB      PRO  72  13.522  -9.022  -9.000
  514    HG2  PRO  72           2HG      PRO  72  15.999  -7.827  -7.823
  515    HG3  PRO  72           1HG      PRO  72  14.892  -7.147  -9.029
  516    HD2  PRO  72           2HD      PRO  72  14.808  -6.418  -6.433
  517    HD3  PRO  72           1HD      PRO  72  13.344  -6.513  -7.434
  518    H    ASN  73           H        ASN  73  16.205  -8.906  -6.163
  519    HA   ASN  73           HA       ASN  73  17.100 -11.608  -5.719
  520    HB2  ASN  73           2HB      ASN  73  18.453  -8.955  -5.185
  521    HB3  ASN  73           1HB      ASN  73  19.229 -10.529  -5.039
  522   HD21  ASN  73          1HD2      ASN  73  19.280  -8.003  -6.901
  523   HD22  ASN  73          2HD2      ASN  73  19.459  -8.712  -8.466
  524    H    ASN  74           H        ASN  74  15.881  -8.974  -3.804
  525    HA   ASN  74           HA       ASN  74  15.120  -8.928  -1.653
  526    HB2  ASN  74           2HB      ASN  74  16.154 -11.730  -1.231
  527    HB3  ASN  74           1HB      ASN  74  14.855 -10.906  -0.377
  528   HD21  ASN  74          1HD2      ASN  74  12.833 -10.767  -1.310
  529   HD22  ASN  74          2HD2      ASN  74  12.375 -11.710  -2.683
  530    H    THR  75           H        THR  75  17.392  -7.694  -2.159
  531    HA   THR  75           HA       THR  75  19.388  -8.571  -0.215
  532    HB   THR  75           HB       THR  75  20.907  -7.078  -1.258
  533    HG1  THR  75           1HG      THR  75  19.860  -5.219  -1.561
  534   HG21  THR  75          3HG2      THR  75  20.899  -7.648  -3.576
  535   HG22  THR  75          1HG2      THR  75  19.185  -8.057  -3.518
  536   HG23  THR  75          2HG2      THR  75  20.358  -9.048  -2.649
  537    H    GLY  76           H        GLY  76  16.812  -7.507   0.643
  538    HA2  GLY  76           2HA      GLY  76  15.984  -6.076   2.229
  539    HA3  GLY  76           1HA      GLY  76  17.655  -5.836   2.724
  540    H    PHE  77           H        PHE  77  16.539  -5.080  -0.494
  541    HA   PHE  77           HA       PHE  77  16.554  -2.218   0.169
  542    HB2  PHE  77           2HB      PHE  77  18.497  -3.599  -1.399
  543    HB3  PHE  77           1HB      PHE  77  17.575  -2.553  -2.475
  544    HD1  PHE  77           1HD      PHE  77  19.770  -2.649   0.468
  545    HD2  PHE  77           2HD      PHE  77  17.755  -0.178  -2.350
  546    HE1  PHE  77           1HE      PHE  77  21.095  -0.717   1.221
  547    HE2  PHE  77           2HE      PHE  77  19.077   1.757  -1.604
  548    HZ   PHE  77           HZ       PHE  77  20.750   1.490   0.182
  549    H    ILE  78           H        ILE  78  14.868  -1.130  -0.622
  550    HA   ILE  78           HA       ILE  78  13.106  -2.516  -2.527
  551    HB   ILE  78           HB       ILE  78  12.527  -0.232  -0.631
  552   HG12  ILE  78          2HG1      ILE  78  11.539  -3.085  -0.675
  553   HG13  ILE  78          1HG1      ILE  78  12.690  -2.410   0.478
  554   HG21  ILE  78          1HG2      ILE  78  10.678  -1.617  -2.570
  555   HG22  ILE  78          2HG2      ILE  78  11.238   0.055  -2.668
  556   HG23  ILE  78          3HG2      ILE  78  10.188  -0.448  -1.345
  557   HD11  ILE  78          3HD1      ILE  78   9.948  -2.556   0.766
  558   HD12  ILE  78          1HD1      ILE  78  10.247  -0.866   0.352
  559   HD13  ILE  78          2HD1      ILE  78  11.060  -1.592   1.740
  560    H    ASP  79           H        ASP  79  12.147  -1.379  -4.233
  561    HA   ASP  79           HA       ASP  79  13.750   0.868  -5.224
  562    HB2  ASP  79           2HB      ASP  79  12.187  -1.311  -6.495
  563    HB3  ASP  79           1HB      ASP  79  12.068   0.263  -7.277
  564    H    TYR  80           H        TYR  80  12.899   2.578  -4.122
  565    HA   TYR  80           HA       TYR  80  10.578   3.208  -3.091
  566    HB2  TYR  80           2HB      TYR  80  12.502   4.782  -3.405
  567    HB3  TYR  80           1HB      TYR  80  11.892   5.131  -5.017
  568    HD1  TYR  80           2HD      TYR  80   9.760   6.339  -5.301
  569    HD2  TYR  80           1HD      TYR  80  11.461   5.710  -1.453
  570    HE1  TYR  80           2HE      TYR  80   8.291   8.081  -4.376
  571    HE2  TYR  80           1HE      TYR  80   9.997   7.449  -0.515
  572    HH   TYR  80           HH       TYR  80   8.540   9.707  -2.153
  573    H    LYS  81           H        LYS  81  11.066   3.230  -6.605
  574    HA   LYS  81           HA       LYS  81   8.490   4.200  -7.249
  575    HB2  LYS  81           2HB      LYS  81  10.646   2.773  -8.758
  576    HB3  LYS  81           1HB      LYS  81   9.053   2.930  -9.488
  577    HG2  LYS  81           2HG      LYS  81   9.890   4.844 -10.299
  578    HG3  LYS  81           1HG      LYS  81   9.480   5.476  -8.702
  579    HD2  LYS  81           2HD      LYS  81  11.918   4.464  -8.187
  580    HD3  LYS  81           1HD      LYS  81  12.117   4.876  -9.892
  581    HE2  LYS  81           2HE      LYS  81  11.913   7.118  -9.516
  582    HE3  LYS  81           1HE      LYS  81  10.858   6.898  -8.120
  583    HZ1  LYS  81           3HZ      LYS  81  12.742   6.252  -6.800
  584    HZ2  LYS  81           1HZ      LYS  81  13.069   7.745  -7.526
  585    HZ3  LYS  81           2HZ      LYS  81  13.773   6.334  -8.138
  586    H    ALA  82           H        ALA  82   9.805   0.882  -7.371
  587    HA   ALA  82           HA       ALA  82   7.477  -0.466  -8.018
  588    HB1  ALA  82           1HB      ALA  82  10.041  -1.201  -7.359
  589    HB2  ALA  82           2HB      ALA  82   8.714  -2.308  -7.710
  590    HB3  ALA  82           3HB      ALA  82   9.090  -1.886  -6.039
  591    H    PHE  83           H        PHE  83   8.445   0.979  -5.019
  592    HA   PHE  83           HA       PHE  83   6.323  -0.310  -3.507
  593    HB2  PHE  83           2HB      PHE  83   8.828   0.849  -2.875
  594    HB3  PHE  83           1HB      PHE  83   7.600   1.817  -2.066
  595    HD1  PHE  83           2HD      PHE  83   8.250  -1.798  -2.716
  596    HD2  PHE  83           1HD      PHE  83   7.141   1.201   0.091
  597    HE1  PHE  83           2HE      PHE  83   8.079  -3.511  -0.962
  598    HE2  PHE  83           1HE      PHE  83   6.967  -0.509   1.854
  599    HZ   PHE  83           HZ       PHE  83   7.435  -2.870   1.328
  600    H    ALA  84           H        ALA  84   7.077   2.764  -4.992
  601    HA   ALA  84           HA       ALA  84   4.890   4.173  -3.770
  602    HB1  ALA  84           1HB      ALA  84   5.540   6.032  -5.117
  603    HB2  ALA  84           2HB      ALA  84   6.479   4.996  -6.192
  604    HB3  ALA  84           3HB      ALA  84   7.012   5.255  -4.532
  605    H    ALA  85           H        ALA  85   5.384   2.303  -6.662
  606    HA   ALA  85           HA       ALA  85   3.096   3.261  -8.049
  607    HB1  ALA  85           1HB      ALA  85   4.598   0.700  -8.480
  608    HB2  ALA  85           2HB      ALA  85   5.029   2.254  -9.197
  609    HB3  ALA  85           3HB      ALA  85   3.505   1.478  -9.626
  610    H    MET  86           H        MET  86   3.466   1.294  -5.465
  611    HA   MET  86           HA       MET  86   1.270  -0.501  -5.911
  612    HB2  MET  86           2HB      MET  86   2.681   0.146  -3.317
  613    HB3  MET  86           1HB      MET  86   1.644  -1.241  -3.626
  614    HG2  MET  86           2HG      MET  86   3.451  -1.597  -5.570
  615    HG3  MET  86           1HG      MET  86   4.451  -0.762  -4.384
  616    HE1  MET  86           3HE      MET  86   4.267  -3.785  -5.755
  617    HE2  MET  86           1HE      MET  86   2.622  -4.182  -5.257
  618    HE3  MET  86           2HE      MET  86   3.988  -5.064  -4.572
  619    H    LEU  87           H        LEU  87   1.787   2.534  -4.211
  620    HA   LEU  87           HA       LEU  87  -0.899   2.549  -3.168
  621    HB2  LEU  87           2HB      LEU  87   1.315   4.556  -3.052
  622    HB3  LEU  87           1HB      LEU  87  -0.244   4.796  -2.284
  623    HG   LEU  87           HG       LEU  87   1.173   2.309  -1.546
  624   HD11  LEU  87          1HD1      LEU  87   2.999   3.993  -1.681
  625   HD12  LEU  87          2HD1      LEU  87   2.718   3.367  -0.056
  626   HD13  LEU  87          3HD1      LEU  87   2.125   4.967  -0.500
  627   HD21  LEU  87          3HD2      LEU  87  -0.460   4.416  -0.165
  628   HD22  LEU  87          1HD2      LEU  87   0.409   3.169   0.732
  629   HD23  LEU  87          2HD2      LEU  87  -0.843   2.713  -0.423
  630    H    TYR  88           H        TYR  88   0.485   3.248  -5.949
  631    HA   TYR  88           HA       TYR  88  -1.657   5.089  -6.764
  632    HB2  TYR  88           2HB      TYR  88   1.159   5.100  -7.863
  633    HB3  TYR  88           1HB      TYR  88  -0.140   6.207  -8.292
  634    HD1  TYR  88           2HD      TYR  88  -1.262   7.058  -5.796
  635    HD2  TYR  88           1HD      TYR  88   2.808   6.260  -6.741
  636    HE1  TYR  88           2HE      TYR  88  -0.554   8.587  -4.005
  637    HE2  TYR  88           1HE      TYR  88   3.529   7.786  -4.953
  638    HH   TYR  88           HH       TYR  88   1.739  10.038  -3.624
  639    H    SER  89           H        SER  89  -1.263   2.102  -6.903
  640    HA   SER  89           HA       SER  89  -0.914   1.456  -9.664
  641    HB2  SER  89           2HB      SER  89  -1.629  -0.016  -7.186
  642    HB3  SER  89           1HB      SER  89  -2.164  -0.726  -8.710
  643    HG   SER  89           HG       SER  89   0.467  -0.147  -7.861
  644    H    VAL  90           H        VAL  90  -2.398   2.902 -10.680
  645    HA   VAL  90           HA       VAL  90  -5.149   1.872 -10.671
  646    HB   VAL  90           HB       VAL  90  -6.011   4.179 -10.951
  647   HG11  VAL  90          1HG1      VAL  90  -5.623   2.879  -8.690
  648   HG12  VAL  90          2HG1      VAL  90  -6.222   4.538  -8.702
  649   HG13  VAL  90          3HG1      VAL  90  -4.518   4.218  -8.379
  650   HG21  VAL  90          3HG2      VAL  90  -3.130   4.870 -10.471
  651   HG22  VAL  90          1HG2      VAL  90  -4.426   6.011 -10.118
  652   HG23  VAL  90          2HG2      VAL  90  -4.198   5.418 -11.763
  653    H    ASP  91           H        ASP  91  -2.894   1.416 -12.463
  654    HA   ASP  91           HA       ASP  91  -4.244   1.847 -14.939
  655    HB2  ASP  91           2HB      ASP  91  -1.986   3.625 -14.171
  656    HB3  ASP  91           1HB      ASP  91  -2.018   3.032 -15.829
  657    H    GLU  92           H        GLU  92  -3.205   0.773 -16.726
  658    HA   GLU  92           HA       GLU  92  -1.675  -1.519 -15.845
  659    HB2  GLU  92           2HB      GLU  92  -3.543  -1.808 -17.414
  660    HB3  GLU  92           1HB      GLU  92  -2.721  -0.789 -18.587
  661    HG2  GLU  92           2HG      GLU  92  -0.853  -2.452 -18.591
  662    HG3  GLU  92           1HG      GLU  92  -1.870  -3.498 -17.601
  663    H    SER  93           H        SER  93  -1.284   0.816 -18.519
  664    HA   SER  93           HA       SER  93   1.380   1.465 -17.921
  665    HB2  SER  93           2HB      SER  93   1.332  -1.069 -18.847
  666    HB3  SER  93           1HB      SER  93   1.450  -0.197 -20.376
  667    HG   SER  93           HG       SER  93   3.250   0.960 -19.300
  Start of MODEL   13
    1    H1   MET   1           1HT      MET   1 -42.182  19.151   4.925
    2    H2   MET   1           2HT      MET   1 -43.614  18.946   4.002
    3    H3   MET   1           3HT      MET   1 -42.439  17.697   4.053
    4    HA   MET   1           HA       MET   1 -44.064  18.675   6.305
    5    HB2  MET   1           2HB      MET   1 -45.166  17.319   4.457
    6    HB3  MET   1           1HB      MET   1 -44.106  15.993   4.917
    7    HG2  MET   1           2HG      MET   1 -46.183  15.626   5.979
    8    HG3  MET   1           1HG      MET   1 -45.053  16.149   7.225
    9    HE1  MET   1           2HE      MET   1 -46.066  19.126   8.664
   10    HE2  MET   1           3HE      MET   1 -45.331  17.523   8.720
   11    HE3  MET   1           1HE      MET   1 -47.023  17.735   9.173
   12    H    GLY   2           H        GLY   2 -42.999  18.480   8.160
   13    HA2  GLY   2           2HA      GLY   2 -40.822  16.509   8.341
   14    HA3  GLY   2           1HA      GLY   2 -40.997  17.927   9.363
   15    H    SER   3           H        SER   3 -41.415  14.620   9.177
   16    HA   SER   3           HA       SER   3 -43.646  14.385  10.978
   17    HB2  SER   3           2HB      SER   3 -41.741  12.477   9.679
   18    HB3  SER   3           1HB      SER   3 -42.678  11.933  11.072
   19    HG   SER   3           HG       SER   3 -44.561  12.693   9.884
   20    H    SER   4           H        SER   4 -43.227  15.373  12.903
   21    HA   SER   4           HA       SER   4 -42.399  15.663  15.000
   22    HB2  SER   4           2HB      SER   4 -42.788  13.191  15.089
   23    HB3  SER   4           1HB      SER   4 -41.110  12.954  14.605
   24    HG   SER   4           HG       SER   4 -40.783  13.023  16.688
   25    H    HIS   5           H        HIS   5 -40.329  15.828  16.293
   26    HA   HIS   5           HA       HIS   5 -38.425  17.292  14.834
   27    HB2  HIS   5           2HB      HIS   5 -37.105  17.275  16.927
   28    HB3  HIS   5           1HB      HIS   5 -38.793  17.691  17.208
   29    HD1  HIS   5           1HD      HIS   5 -36.224  15.117  17.973
   30    HD2  HIS   5           2HD      HIS   5 -40.281  15.742  18.619
   31    HE1  HIS   5           1HE      HIS   5 -36.897  13.430  19.712
   32    HE2  HIS   5           2HE      HIS   5 -39.374  13.769  20.024
   33    H    HIS   6           H        HIS   6 -36.903  16.582  13.510
   34    HA   HIS   6           HA       HIS   6 -35.258  14.317  14.216
   35    HB2  HIS   6           2HB      HIS   6 -37.284  13.365  13.020
   36    HB3  HIS   6           1HB      HIS   6 -36.735  14.223  11.584
   37    HD1  HIS   6           1HD      HIS   6 -33.828  13.061  13.327
   38    HD2  HIS   6           2HD      HIS   6 -36.603  11.350  10.753
   39    HE1  HIS   6           1HE      HIS   6 -32.729  10.979  12.443
   40    HE2  HIS   6           2HE      HIS   6 -34.460   9.914  10.954
   41    H    HIS   7           H        HIS   7 -36.092  16.137  11.260
   42    HA   HIS   7           HA       HIS   7 -33.683  17.639  11.269
   43    HB2  HIS   7           2HB      HIS   7 -32.775  15.407  10.647
   44    HB3  HIS   7           1HB      HIS   7 -33.825  15.405   9.235
   45    HD1  HIS   7           1HD      HIS   7 -32.538  15.961   7.210
   46    HD2  HIS   7           2HD      HIS   7 -31.158  18.052  10.526
   47    HE1  HIS   7           1HE      HIS   7 -30.655  17.396   6.365
   48    HE2  HIS   7           2HE      HIS   7 -29.779  18.587   8.404
   49    H    HIS   8           H        HIS   8 -33.602  19.181   9.597
   50    HA   HIS   8           HA       HIS   8 -36.170  19.845   8.503
   51    HB2  HIS   8           2HB      HIS   8 -34.085  21.350   9.305
   52    HB3  HIS   8           1HB      HIS   8 -33.762  21.304   7.575
   53    HD1  HIS   8           1HD      HIS   8 -34.322  24.003   8.319
   54    HD2  HIS   8           2HD      HIS   8 -37.455  21.331   7.761
   55    HE1  HIS   8           1HE      HIS   8 -36.354  25.426   7.899
   56    HE2  HIS   8           2HE      HIS   8 -38.252  23.789   7.650
   57    H    HIS   9           H        HIS   9 -36.709  20.075   6.303
   58    HA   HIS   9           HA       HIS   9 -36.831  19.418   4.130
   59    HB2  HIS   9           2HB      HIS   9 -33.822  19.173   4.262
   60    HB3  HIS   9           1HB      HIS   9 -34.807  19.416   2.824
   61    HD1  HIS   9           1HD      HIS   9 -36.167  21.802   2.836
   62    HD2  HIS   9           2HD      HIS   9 -32.865  21.471   5.333
   63    HE1  HIS   9           1HE      HIS   9 -35.510  24.164   3.397
   64    HE2  HIS   9           2HE      HIS   9 -33.563  23.935   4.979
   65    H    HIS  10           H        HIS  10 -35.606  17.592   2.579
   66    HA   HIS  10           HA       HIS  10 -36.559  15.137   3.609
   67    HB2  HIS  10           2HB      HIS  10 -35.671  14.148   1.551
   68    HB3  HIS  10           1HB      HIS  10 -36.541  15.640   1.206
   69    HD1  HIS  10           1HD      HIS  10 -33.536  16.873   2.473
   70    HD2  HIS  10           2HD      HIS  10 -34.548  14.995  -1.093
   71    HE1  HIS  10           1HE      HIS  10 -31.721  17.494   0.849
   72    HE2  HIS  10           2HE      HIS  10 -32.308  16.275  -1.277
   73    H    SER  11           H        SER  11 -35.393  13.213   4.073
   74    HA   SER  11           HA       SER  11 -32.720  13.741   5.179
   75    HB2  SER  11           2HB      SER  11 -34.167  13.023   6.919
   76    HB3  SER  11           1HB      SER  11 -34.855  11.742   5.922
   77    HG   SER  11           HG       SER  11 -33.399  10.541   6.839
   78    H    SER  12           H        SER  12 -34.402  10.803   4.071
   79    HA   SER  12           HA       SER  12 -33.664   9.012   2.869
   80    HB2  SER  12           2HB      SER  12 -32.336   9.733   0.751
   81    HB3  SER  12           1HB      SER  12 -34.005  10.273   0.933
   82    HG   SER  12           HG       SER  12 -31.622  11.724   1.165
   83    H    GLY  13           H        GLY  13 -32.042   9.679   5.126
   84    HA2  GLY  13           2HA      GLY  13 -29.305   9.169   4.204
   85    HA3  GLY  13           1HA      GLY  13 -29.773   9.653   5.827
   86    H    LEU  14           H        LEU  14 -29.514   6.985   3.582
   87    HA   LEU  14           HA       LEU  14 -29.080   5.137   5.722
   88    HB2  LEU  14           2HB      LEU  14 -30.937   3.635   5.231
   89    HB3  LEU  14           1HB      LEU  14 -31.510   5.197   5.782
   90    HG   LEU  14           HG       LEU  14 -31.313   4.761   2.846
   91   HD11  LEU  14          1HD1      LEU  14 -33.566   3.744   2.839
   92   HD12  LEU  14          2HD1      LEU  14 -33.461   3.566   4.590
   93   HD13  LEU  14          3HD1      LEU  14 -32.338   2.696   3.546
   94   HD21  LEU  14          3HD2      LEU  14 -32.989   6.354   2.738
   95   HD22  LEU  14          1HD2      LEU  14 -32.050   6.885   4.134
   96   HD23  LEU  14          2HD2      LEU  14 -33.564   6.011   4.370
   97    H    VAL  15           H        VAL  15 -27.657   6.057   3.415
   98    HA   VAL  15           HA       VAL  15 -27.760   4.285   1.243
   99    HB   VAL  15           HB       VAL  15 -25.428   4.997   0.777
  100   HG11  VAL  15          1HG1      VAL  15 -27.431   6.336   0.111
  101   HG12  VAL  15          2HG1      VAL  15 -25.950   7.278   0.289
  102   HG13  VAL  15          3HG1      VAL  15 -27.182   7.321   1.552
  103   HG21  VAL  15          3HG2      VAL  15 -25.455   6.958   2.982
  104   HG22  VAL  15          1HG2      VAL  15 -24.107   6.082   2.254
  105   HG23  VAL  15          2HG2      VAL  15 -25.142   5.282   3.438
  106    HA   PRO  16           HA       PRO  16 -26.002   0.434   2.427
  107    HB2  PRO  16           2HB      PRO  16 -23.898   0.869   0.361
  108    HB3  PRO  16           1HB      PRO  16 -24.983  -0.509   0.592
  109    HG2  PRO  16           2HG      PRO  16 -25.420   1.245  -1.361
  110    HG3  PRO  16           1HG      PRO  16 -26.769   0.555  -0.438
  111    HD2  PRO  16           2HD      PRO  16 -25.540   3.269  -0.262
  112    HD3  PRO  16           1HD      PRO  16 -27.237   2.783  -0.074
  113    H    ARG  17           H        ARG  17 -23.407   2.727   1.555
  114    HA   ARG  17           HA       ARG  17 -22.164   2.219   4.161
  115    HB2  ARG  17           2HB      ARG  17 -20.954   1.780   1.468
  116    HB3  ARG  17           1HB      ARG  17 -19.927   2.403   2.752
  117    HG2  ARG  17           2HG      ARG  17 -21.577   0.058   3.437
  118    HG3  ARG  17           1HG      ARG  17 -20.282  -0.207   2.268
  119    HD2  ARG  17           2HD      ARG  17 -19.209  -0.607   4.273
  120    HD3  ARG  17           1HD      ARG  17 -18.824   1.088   3.980
  121    HE   ARG  17           HE       ARG  17 -21.195   0.717   5.552
  122   HH11  ARG  17          1HH1      ARG  17 -17.712   0.928   5.660
  123   HH12  ARG  17          2HH1      ARG  17 -17.669   1.431   7.315
  124   HH21  ARG  17          1HH2      ARG  17 -21.139   1.379   7.732
  125   HH22  ARG  17          2HH2      ARG  17 -19.613   1.687   8.493
  126    H    GLY  18           H        GLY  18 -21.555   4.095   1.181
  127    HA2  GLY  18           2HA      GLY  18 -21.760   6.450   1.010
  128    HA3  GLY  18           1HA      GLY  18 -21.716   6.555   2.764
  129    H    SER  19           H        SER  19 -19.387   4.828   3.024
  130    HA   SER  19           HA       SER  19 -17.364   6.821   2.338
  131    HB2  SER  19           2HB      SER  19 -15.930   5.289   3.862
  132    HB3  SER  19           1HB      SER  19 -17.198   6.262   4.610
  133    HG   SER  19           HG       SER  19 -17.576   4.296   5.413
  134    H    HIS  20           H        HIS  20 -16.153   6.562   0.591
  135    HA   HIS  20           HA       HIS  20 -16.205   4.279  -1.040
  136    HB2  HIS  20           2HB      HIS  20 -15.346   6.846  -1.356
  137    HB3  HIS  20           1HB      HIS  20 -13.812   5.988  -1.268
  138    HD1  HIS  20           1HD      HIS  20 -16.893   4.552  -2.893
  139    HD2  HIS  20           2HD      HIS  20 -13.213   6.161  -3.958
  140    HE1  HIS  20           1HE      HIS  20 -16.655   4.115  -5.358
  141    HE2  HIS  20           2HE      HIS  20 -14.459   5.173  -5.996
  142    H    MET  21           H        MET  21 -14.060   3.199  -1.756
  143    HA   MET  21           HA       MET  21 -12.828   2.106   0.667
  144    HB2  MET  21           2HB      MET  21 -13.242   1.077  -2.114
  145    HB3  MET  21           1HB      MET  21 -11.948   0.407  -1.131
  146    HG2  MET  21           2HG      MET  21 -14.595   0.580   0.151
  147    HG3  MET  21           1HG      MET  21 -14.440  -0.568  -1.178
  148    HE1  MET  21           3HE      MET  21 -14.661  -0.169   2.173
  149    HE2  MET  21           1HE      MET  21 -13.692  -1.396   2.990
  150    HE3  MET  21           2HE      MET  21 -15.019  -1.878   1.934
  151    H    SER  22           H        SER  22 -12.047   4.689  -0.435
  152    HA   SER  22           HA       SER  22  -9.354   4.128  -1.418
  153    HB2  SER  22           2HB      SER  22 -11.085   6.583  -1.517
  154    HB3  SER  22           1HB      SER  22  -9.347   6.682  -1.802
  155    HG   SER  22           HG       SER  22 -11.218   6.017  -3.526
  156    H    ASP  23           H        ASP  23 -10.701   4.347   1.427
  157    HA   ASP  23           HA       ASP  23  -8.948   6.213   2.725
  158    HB2  ASP  23           2HB      ASP  23 -10.842   4.188   3.889
  159    HB3  ASP  23           1HB      ASP  23 -10.024   5.452   4.806
  160    H    GLU  24           H        GLU  24  -8.783   3.074   1.768
  161    HA   GLU  24           HA       GLU  24  -7.161   1.940   3.760
  162    HB2  GLU  24           2HB      GLU  24  -7.401   1.231   0.848
  163    HB3  GLU  24           1HB      GLU  24  -6.567   0.243   2.041
  164    HG2  GLU  24           2HG      GLU  24  -9.309   0.927   2.780
  165    HG3  GLU  24           1HG      GLU  24  -9.179  -0.026   1.303
  166    H    LYS  25           H        LYS  25  -6.553   4.209   1.450
  167    HA   LYS  25           HA       LYS  25  -3.680   3.757   1.331
  168    HB2  LYS  25           2HB      LYS  25  -5.239   4.543  -0.626
  169    HB3  LYS  25           1HB      LYS  25  -5.038   6.130   0.105
  170    HG2  LYS  25           2HG      LYS  25  -2.475   5.399  -0.004
  171    HG3  LYS  25           1HG      LYS  25  -3.096   4.452  -1.358
  172    HD2  LYS  25           2HD      LYS  25  -2.693   6.360  -2.504
  173    HD3  LYS  25           1HD      LYS  25  -4.276   6.814  -1.868
  174    HE2  LYS  25           2HE      LYS  25  -3.329   8.121  -0.156
  175    HE3  LYS  25           1HE      LYS  25  -1.733   7.407  -0.385
  176    HZ1  LYS  25           3HZ      LYS  25  -3.125   9.373  -2.096
  177    HZ2  LYS  25           1HZ      LYS  25  -1.832   8.451  -2.684
  178    HZ3  LYS  25           2HZ      LYS  25  -1.601   9.497  -1.374
  179    H    THR  26           H        THR  26  -6.011   5.776   2.912
  180    HA   THR  26           HA       THR  26  -4.302   7.884   3.673
  181    HB   THR  26           HB       THR  26  -6.292   7.534   5.671
  182    HG1  THR  26           1HG      THR  26  -7.324   7.269   3.049
  183   HG21  THR  26          3HG2      THR  26  -7.300   9.371   3.891
  184   HG22  THR  26          1HG2      THR  26  -5.554   9.473   3.640
  185   HG23  THR  26          2HG2      THR  26  -6.234   9.713   5.253
  186    H    GLN  27           H        GLN  27  -4.823   4.690   4.949
  187    HA   GLN  27           HA       GLN  27  -3.757   5.048   7.523
  188    HB2  GLN  27           2HB      GLN  27  -4.832   2.943   6.226
  189    HB3  GLN  27           1HB      GLN  27  -3.130   2.519   6.102
  190    HG2  GLN  27           2HG      GLN  27  -2.883   2.288   8.384
  191    HG3  GLN  27           1HG      GLN  27  -4.282   3.299   8.741
  192   HE21  GLN  27          1HE2      GLN  27  -3.828   0.793   9.895
  193   HE22  GLN  27          2HE2      GLN  27  -5.072  -0.285   9.371
  194    H    LEU  28           H        LEU  28  -2.320   4.975   4.400
  195    HA   LEU  28           HA       LEU  28   0.366   4.557   5.371
  196    HB2  LEU  28           2HB      LEU  28  -0.436   3.613   3.216
  197    HB3  LEU  28           1HB      LEU  28  -0.602   5.254   2.619
  198    HG   LEU  28           HG       LEU  28   2.076   4.564   3.652
  199   HD11  LEU  28          1HD1      LEU  28   2.471   3.547   1.253
  200   HD12  LEU  28          2HD1      LEU  28   0.784   3.065   1.434
  201   HD13  LEU  28          3HD1      LEU  28   1.984   2.534   2.613
  202   HD21  LEU  28          3HD2      LEU  28   2.189   6.579   2.641
  203   HD22  LEU  28          1HD2      LEU  28   0.820   6.246   1.580
  204   HD23  LEU  28          2HD2      LEU  28   2.414   5.599   1.192
  205    H    ILE  29           H        ILE  29  -1.706   7.058   5.022
  206    HA   ILE  29           HA       ILE  29  -0.044   9.165   4.232
  207    HB   ILE  29           HB       ILE  29  -2.541   9.197   5.870
  208   HG12  ILE  29          2HG1      ILE  29  -2.578   8.336   3.477
  209   HG13  ILE  29          1HG1      ILE  29  -3.722   9.610   3.888
  210   HG21  ILE  29          1HG2      ILE  29  -1.427  11.246   6.350
  211   HG22  ILE  29          2HG2      ILE  29  -2.695  11.614   5.181
  212   HG23  ILE  29          3HG2      ILE  29  -1.017  11.494   4.652
  213   HD11  ILE  29          3HD1      ILE  29  -2.939  10.884   2.287
  214   HD12  ILE  29          1HD1      ILE  29  -1.905   9.548   1.784
  215   HD13  ILE  29          2HD1      ILE  29  -1.292  10.754   2.918
  216    H    GLU  30           H        GLU  30  -0.177   7.451   6.961
  217    HA   GLU  30           HA       GLU  30   0.771   9.421   8.793
  218    HB2  GLU  30           2HB      GLU  30   0.146   6.533   8.959
  219    HB3  GLU  30           1HB      GLU  30   1.295   7.163  10.130
  220    HG2  GLU  30           2HG      GLU  30  -1.121   8.782   9.837
  221    HG3  GLU  30           1HG      GLU  30  -1.408   7.145  10.425
  222    H    ALA  31           H        ALA  31   2.192   8.122   6.308
  223    HA   ALA  31           HA       ALA  31   4.801   7.620   7.515
  224    HB1  ALA  31           1HB      ALA  31   3.607   6.339   5.503
  225    HB2  ALA  31           2HB      ALA  31   5.360   6.474   5.638
  226    HB3  ALA  31           3HB      ALA  31   4.473   7.562   4.572
  227    H    PHE  32           H        PHE  32   3.104  10.023   5.652
  228    HA   PHE  32           HA       PHE  32   5.224  11.467   4.576
  229    HB2  PHE  32           2HB      PHE  32   2.477  12.273   5.498
  230    HB3  PHE  32           1HB      PHE  32   3.602  13.460   4.846
  231    HD1  PHE  32           2HD      PHE  32   4.891  12.055   2.672
  232    HD2  PHE  32           1HD      PHE  32   0.825  11.956   3.926
  233    HE1  PHE  32           2HE      PHE  32   4.205  11.450   0.387
  234    HE2  PHE  32           1HE      PHE  32   0.132  11.351   1.644
  235    HZ   PHE  32           HZ       PHE  32   1.822  11.098  -0.128
  236    H    TYR  33           H        TYR  33   4.036  11.314   7.847
  237    HA   TYR  33           HA       TYR  33   5.762  13.537   8.654
  238    HB2  TYR  33           2HB      TYR  33   3.817  11.972  10.357
  239    HB3  TYR  33           1HB      TYR  33   4.593  13.498  10.762
  240    HD1  TYR  33           1HD      TYR  33   2.212  11.952   8.358
  241    HD2  TYR  33           2HD      TYR  33   3.549  15.525  10.239
  242    HE1  TYR  33           1HE      TYR  33   0.304  13.168   7.394
  243    HE2  TYR  33           2HE      TYR  33   1.644  16.750   9.282
  244    HH   TYR  33           HH       TYR  33  -0.362  15.414   6.843
  245    H    ASN  34           H        ASN  34   6.848  10.966   7.795
  246    HA   ASN  34           HA       ASN  34   8.829  10.623   9.741
  247    HB2  ASN  34           2HB      ASN  34   6.663   9.481  10.747
  248    HB3  ASN  34           1HB      ASN  34   7.140   8.157   9.688
  249   HD21  ASN  34          1HD2      ASN  34   8.537  10.382  12.071
  250   HD22  ASN  34          2HD2      ASN  34   9.565   9.210  12.815
  251    H    PHE  35           H        PHE  35   9.204  11.026   7.197
  252    HA   PHE  35           HA       PHE  35  10.312   8.504   6.243
  253    HB2  PHE  35           2HB      PHE  35   7.923   9.268   5.220
  254    HB3  PHE  35           1HB      PHE  35   9.013  10.117   4.128
  255    HD1  PHE  35           1HD      PHE  35  11.242   8.260   3.876
  256    HD2  PHE  35           2HD      PHE  35   7.058   7.495   4.024
  257    HE1  PHE  35           1HE      PHE  35  11.579   6.184   2.599
  258    HE2  PHE  35           2HE      PHE  35   7.389   5.417   2.750
  259    HZ   PHE  35           HZ       PHE  35   9.653   4.758   2.036
  260    H    ASP  36           H        ASP  36  11.519  10.821   7.387
  261    HA   ASP  36           HA       ASP  36  13.290  12.212   7.076
  262    HB2  ASP  36           2HB      ASP  36  14.072  10.041   5.893
  263    HB3  ASP  36           1HB      ASP  36  13.775  10.927   4.401
  264    H    GLY  37           H        GLY  37  10.640  12.952   6.050
  265    HA2  GLY  37           2HA      GLY  37   9.670  14.658   4.861
  266    HA3  GLY  37           1HA      GLY  37  11.262  15.401   4.866
  267    H    ASP  38           H        ASP  38  10.807  12.283   3.404
  268    HA   ASP  38           HA       ASP  38  11.024  11.553   1.261
  269    HB2  ASP  38           2HB      ASP  38   9.587  14.162   0.752
  270    HB3  ASP  38           1HB      ASP  38   9.909  12.973  -0.507
  271    H    TYR  39           H        TYR  39  13.313  12.644   2.291
  272    HA   TYR  39           HA       TYR  39  14.518  14.679   0.801
  273    HB2  TYR  39           2HB      TYR  39  15.298  13.464   2.976
  274    HB3  TYR  39           1HB      TYR  39  16.106  12.364   1.863
  275    HD1  TYR  39           2HD      TYR  39  15.798  15.999   2.646
  276    HD2  TYR  39           1HD      TYR  39  18.240  12.877   1.102
  277    HE1  TYR  39           2HE      TYR  39  17.686  17.566   2.481
  278    HE2  TYR  39           1HE      TYR  39  20.135  14.435   0.934
  279    HH   TYR  39           HH       TYR  39  20.090  17.372   0.732
  280    H    ASP  40           H        ASP  40  15.225  11.193   0.505
  281    HA   ASP  40           HA       ASP  40  15.919  11.664  -2.312
  282    HB2  ASP  40           2HB      ASP  40  17.442  10.486  -0.432
  283    HB3  ASP  40           1HB      ASP  40  16.579   9.071  -1.028
  284    H    GLY  41           H        GLY  41  15.452   9.799  -3.802
  285    HA2  GLY  41           2HA      GLY  41  12.693   8.914  -3.320
  286    HA3  GLY  41           1HA      GLY  41  13.475   9.024  -4.889
  287    H    PHE  42           H        PHE  42  15.015   7.558  -2.113
  288    HA   PHE  42           HA       PHE  42  14.335   4.875  -2.992
  289    HB2  PHE  42           2HB      PHE  42  17.109   6.028  -3.172
  290    HB3  PHE  42           1HB      PHE  42  16.845   4.296  -2.984
  291    HD1  PHE  42           2HD      PHE  42  15.060   3.306  -4.693
  292    HD2  PHE  42           1HD      PHE  42  17.353   6.840  -5.298
  293    HE1  PHE  42           2HE      PHE  42  14.748   3.089  -7.125
  294    HE2  PHE  42           1HE      PHE  42  17.045   6.630  -7.730
  295    HZ   PHE  42           HZ       PHE  42  15.741   4.752  -8.645
  296    H    VAL  43           H        VAL  43  13.981   3.669  -1.259
  297    HA   VAL  43           HA       VAL  43  15.488   4.247   1.204
  298    HB   VAL  43           HB       VAL  43  13.229   5.159   1.451
  299   HG11  VAL  43          1HG1      VAL  43  12.139   3.616  -0.162
  300   HG12  VAL  43          2HG1      VAL  43  11.264   3.786   1.358
  301   HG13  VAL  43          3HG1      VAL  43  12.230   2.342   1.055
  302   HG21  VAL  43          3HG2      VAL  43  14.419   4.145   3.385
  303   HG22  VAL  43          1HG2      VAL  43  13.540   2.644   3.088
  304   HG23  VAL  43          2HG2      VAL  43  12.663   4.108   3.536
  305    H    SER  44           H        SER  44  16.538   2.531   1.950
  306    HA   SER  44           HA       SER  44  16.185  -0.049   0.762
  307    HB2  SER  44           2HB      SER  44  17.806   0.347   3.247
  308    HB3  SER  44           1HB      SER  44  18.146  -0.654   1.836
  309    HG   SER  44           HG       SER  44  19.442   1.291   2.021
  310    H    VAL  45           H        VAL  45  15.848  -2.029   2.021
  311    HA   VAL  45           HA       VAL  45  13.457  -1.933   3.508
  312    HB   VAL  45           HB       VAL  45  15.465  -4.189   3.413
  313   HG11  VAL  45          1HG1      VAL  45  13.778  -5.614   4.151
  314   HG12  VAL  45          2HG1      VAL  45  12.505  -4.446   3.796
  315   HG13  VAL  45          3HG1      VAL  45  13.587  -4.185   5.163
  316   HG21  VAL  45          3HG2      VAL  45  14.502  -4.971   1.459
  317   HG22  VAL  45          1HG2      VAL  45  14.532  -3.228   1.194
  318   HG23  VAL  45          2HG2      VAL  45  13.034  -4.020   1.682
  319    H    GLU  46           H        GLU  46  16.803  -2.602   4.512
  320    HA   GLU  46           HA       GLU  46  16.411  -3.012   7.208
  321    HB2  GLU  46           2HB      GLU  46  18.746  -1.441   6.133
  322    HB3  GLU  46           1HB      GLU  46  18.711  -2.520   7.520
  323    HG2  GLU  46           2HG      GLU  46  18.175  -4.368   5.839
  324    HG3  GLU  46           1HG      GLU  46  18.685  -3.215   4.606
  325    H    GLU  47           H        GLU  47  16.392  -0.013   5.422
  326    HA   GLU  47           HA       GLU  47  16.306   1.594   7.844
  327    HB2  GLU  47           2HB      GLU  47  17.419   2.168   5.515
  328    HB3  GLU  47           1HB      GLU  47  15.798   2.729   5.125
  329    HG2  GLU  47           2HG      GLU  47  15.870   4.207   7.095
  330    HG3  GLU  47           1HG      GLU  47  17.525   3.684   7.397
  331    H    PHE  48           H        PHE  48  14.176   0.293   5.426
  332    HA   PHE  48           HA       PHE  48  11.935   1.951   5.932
  333    HB2  PHE  48           2HB      PHE  48  12.578  -0.056   4.119
  334    HB3  PHE  48           1HB      PHE  48  11.262  -0.748   5.063
  335    HD1  PHE  48           2HD      PHE  48   9.689   1.709   5.637
  336    HD2  PHE  48           1HD      PHE  48  11.582   0.375   2.067
  337    HE1  PHE  48           2HE      PHE  48   8.066   2.989   4.303
  338    HE2  PHE  48           1HE      PHE  48   9.961   1.653   0.726
  339    HZ   PHE  48           HZ       PHE  48   8.201   2.962   1.844
  340    H    ARG  49           H        ARG  49  13.014  -1.146   7.245
  341    HA   ARG  49           HA       ARG  49  10.750  -1.820   8.718
  342    HB2  ARG  49           2HB      ARG  49  13.676  -2.387   9.135
  343    HB3  ARG  49           1HB      ARG  49  12.455  -3.000  10.241
  344    HG2  ARG  49           2HG      ARG  49  11.725  -4.557   8.787
  345    HG3  ARG  49           1HG      ARG  49  11.959  -3.513   7.384
  346    HD2  ARG  49           2HD      ARG  49  13.458  -5.551   7.537
  347    HD3  ARG  49           1HD      ARG  49  14.261  -4.003   7.274
  348    HE   ARG  49           HE       ARG  49  15.271  -4.214   9.320
  349   HH11  ARG  49          1HH1      ARG  49  12.669  -6.528   9.096
  350   HH12  ARG  49          2HH1      ARG  49  13.102  -7.346  10.559
  351   HH21  ARG  49          1HH2      ARG  49  15.843  -5.289  11.245
  352   HH22  ARG  49          2HH2      ARG  49  14.905  -6.642  11.780
  353    H    GLY  50           H        GLY  50  13.588   0.088   9.706
  354    HA2  GLY  50           2HA      GLY  50  12.826   0.578  12.347
  355    HA3  GLY  50           1HA      GLY  50  13.860   1.626  11.388
  356    H    ILE  51           H        ILE  51  11.700   2.014   9.382
  357    HA   ILE  51           HA       ILE  51  10.381   4.208  10.745
  358    HB   ILE  51           HB       ILE  51  10.127   3.393   7.849
  359   HG12  ILE  51          2HG1      ILE  51  11.882   5.623   8.825
  360   HG13  ILE  51          1HG1      ILE  51  12.490   3.971   8.809
  361   HG21  ILE  51          1HG2      ILE  51   9.426   5.718   7.522
  362   HG22  ILE  51          2HG2      ILE  51   9.552   5.996   9.260
  363   HG23  ILE  51          3HG2      ILE  51   8.355   4.862   8.631
  364   HD11  ILE  51          3HD1      ILE  51  11.593   4.056   6.325
  365   HD12  ILE  51          1HD1      ILE  51  13.193   4.651   6.766
  366   HD13  ILE  51          2HD1      ILE  51  11.857   5.784   6.558
  367    H    ILE  52           H        ILE  52   9.494   1.235   9.039
  368    HA   ILE  52           HA       ILE  52   6.690   1.574   9.296
  369    HB   ILE  52           HB       ILE  52   8.333  -0.921   8.845
  370   HG12  ILE  52          2HG1      ILE  52   8.454   0.823   7.080
  371   HG13  ILE  52          1HG1      ILE  52   7.693  -0.661   6.517
  372   HG21  ILE  52          1HG2      ILE  52   6.318  -1.742   9.695
  373   HG22  ILE  52          2HG2      ILE  52   6.097  -1.793   7.946
  374   HG23  ILE  52          3HG2      ILE  52   5.363  -0.497   8.890
  375   HD11  ILE  52          3HD1      ILE  52   6.050   0.613   5.758
  376   HD12  ILE  52          1HD1      ILE  52   6.648   2.024   6.629
  377   HD13  ILE  52          2HD1      ILE  52   5.584   0.874   7.439
  378    H    ARG  53           H        ARG  53   9.157   0.252  11.383
  379    HA   ARG  53           HA       ARG  53   7.688  -1.340  13.093
  380    HB2  ARG  53           2HB      ARG  53  10.126  -1.100  13.221
  381    HB3  ARG  53           1HB      ARG  53   9.940   0.544  13.815
  382    HG2  ARG  53           2HG      ARG  53  10.434  -0.900  15.659
  383    HG3  ARG  53           1HG      ARG  53   8.762  -0.349  15.799
  384    HD2  ARG  53           2HD      ARG  53   9.152  -2.862  14.314
  385    HD3  ARG  53           1HD      ARG  53   9.542  -2.929  16.032
  386    HE   ARG  53           HE       ARG  53   7.003  -1.706  15.473
  387   HH11  ARG  53          1HH1      ARG  53   8.664  -4.726  16.019
  388   HH12  ARG  53          2HH1      ARG  53   7.241  -5.558  16.551
  389   HH21  ARG  53          1HH2      ARG  53   5.129  -2.797  16.170
  390   HH22  ARG  53          2HH2      ARG  53   5.234  -4.463  16.636
  391    H    ASP  54           H        ASP  54   8.349   2.139  13.498
  392    HA   ASP  54           HA       ASP  54   6.000   2.290  15.265
  393    HB2  ASP  54           2HB      ASP  54   8.645   3.646  15.297
  394    HB3  ASP  54           1HB      ASP  54   7.251   4.591  15.815
  395    H    GLY  55           H        GLY  55   6.425   2.608  12.188
  396    HA2  GLY  55           2HA      GLY  55   5.357   5.327  11.895
  397    HA3  GLY  55           1HA      GLY  55   5.996   4.330  10.599
  398    H    LEU  56           H        LEU  56   4.693   2.650   9.735
  399    HA   LEU  56           HA       LEU  56   1.830   3.177  10.079
  400    HB2  LEU  56           2HB      LEU  56   3.358   1.798   7.874
  401    HB3  LEU  56           1HB      LEU  56   1.609   1.911   7.928
  402    HG   LEU  56           HG       LEU  56   2.463   3.588   6.426
  403   HD11  LEU  56          1HD1      LEU  56   1.091   5.231   7.126
  404   HD12  LEU  56          2HD1      LEU  56   1.847   5.334   8.716
  405   HD13  LEU  56          3HD1      LEU  56   0.673   4.064   8.380
  406   HD21  LEU  56          3HD2      LEU  56   4.669   3.658   7.987
  407   HD22  LEU  56          1HD2      LEU  56   3.864   5.143   8.493
  408   HD23  LEU  56          2HD2      LEU  56   4.261   4.891   6.794
  409    HA   PRO  57           HA       PRO  57   1.413  -0.752  12.113
  410    HB2  PRO  57           2HB      PRO  57  -1.268  -0.921  12.169
  411    HB3  PRO  57           1HB      PRO  57  -0.389   0.247  13.163
  412    HG2  PRO  57           2HG      PRO  57  -1.818   0.665  10.567
  413    HG3  PRO  57           1HG      PRO  57  -1.811   1.685  12.017
  414    HD2  PRO  57           2HD      PRO  57  -0.273   2.176   9.806
  415    HD3  PRO  57           1HD      PRO  57   0.167   2.692  11.444
  416    H    MET  58           H        MET  58   2.385  -1.658  10.051
  417    HA   MET  58           HA       MET  58   0.373  -3.077   8.446
  418    HB2  MET  58           2HB      MET  58   2.829  -1.760   7.787
  419    HB3  MET  58           1HB      MET  58   2.980  -3.465   7.386
  420    HG2  MET  58           2HG      MET  58   1.169  -3.387   5.896
  421    HG3  MET  58           1HG      MET  58   0.625  -1.828   6.515
  422    HE1  MET  58           3HE      MET  58   2.341  -3.524   3.630
  423    HE2  MET  58           1HE      MET  58   3.644  -3.644   4.811
  424    HE3  MET  58           2HE      MET  58   3.842  -2.632   3.379
  425    H    THR  59           H        THR  59   0.393  -5.284   8.269
  426    HA   THR  59           HA       THR  59   1.668  -6.723  10.415
  427    HB   THR  59           HB       THR  59   0.529  -8.629   8.768
  428    HG1  THR  59           1HG      THR  59  -1.185  -6.379   8.729
  429   HG21  THR  59          3HG2      THR  59   0.083  -7.646  11.315
  430   HG22  THR  59          1HG2      THR  59  -0.691  -9.043  10.566
  431   HG23  THR  59          2HG2      THR  59  -1.467  -7.460  10.493
  432    H    GLU  60           H        GLU  60   3.157  -8.419  10.210
  433    HA   GLU  60           HA       GLU  60   5.386  -8.130   8.729
  434    HB2  GLU  60           2HB      GLU  60   5.480 -10.758   8.792
  435    HB3  GLU  60           1HB      GLU  60   5.585  -9.827  10.278
  436    HG2  GLU  60           2HG      GLU  60   2.870 -10.608   9.434
  437    HG3  GLU  60           1HG      GLU  60   3.940 -11.921   9.921
  438    H    ALA  61           H        ALA  61   2.600 -10.049   7.735
  439    HA   ALA  61           HA       ALA  61   3.466 -11.028   5.327
  440    HB1  ALA  61           1HB      ALA  61   1.365 -11.758   5.146
  441    HB2  ALA  61           2HB      ALA  61   0.697 -10.129   5.246
  442    HB3  ALA  61           3HB      ALA  61   1.105 -11.006   6.723
  443    H    GLU  62           H        GLU  62   1.743  -7.947   5.881
  444    HA   GLU  62           HA       GLU  62   1.768  -7.045   3.240
  445    HB2  GLU  62           2HB      GLU  62   2.229  -4.967   5.299
  446    HB3  GLU  62           1HB      GLU  62   1.016  -5.043   4.032
  447    HG2  GLU  62           2HG      GLU  62   0.968  -6.385   6.712
  448    HG3  GLU  62           1HG      GLU  62  -0.103  -5.122   6.115
  449    H    ILE  63           H        ILE  63   3.997  -6.074   5.836
  450    HA   ILE  63           HA       ILE  63   5.859  -4.752   4.216
  451    HB   ILE  63           HB       ILE  63   6.667  -6.263   6.689
  452   HG12  ILE  63          2HG1      ILE  63   6.007  -3.740   7.567
  453   HG13  ILE  63          1HG1      ILE  63   4.703  -4.103   6.437
  454   HG21  ILE  63          1HG2      ILE  63   8.173  -4.799   5.055
  455   HG22  ILE  63          2HG2      ILE  63   8.437  -4.843   6.799
  456   HG23  ILE  63          3HG2      ILE  63   7.551  -3.500   6.074
  457   HD11  ILE  63          3HD1      ILE  63   3.747  -5.145   8.144
  458   HD12  ILE  63          1HD1      ILE  63   5.241  -5.179   9.079
  459   HD13  ILE  63          2HD1      ILE  63   4.928  -6.423   7.866
  460    H    THR  64           H        THR  64   6.224  -7.985   5.655
  461    HA   THR  64           HA       THR  64   8.516  -8.773   4.339
  462    HB   THR  64           HB       THR  64   6.161 -10.438   5.202
  463    HG1  THR  64           1HG      THR  64   7.086  -9.373   6.924
  464   HG21  THR  64          3HG2      THR  64   8.953 -11.304   4.524
  465   HG22  THR  64          1HG2      THR  64   7.452 -11.799   3.738
  466   HG23  THR  64          2HG2      THR  64   7.783 -12.292   5.399
  467    H    GLU  65           H        GLU  65   5.147  -9.416   3.355
  468    HA   GLU  65           HA       GLU  65   5.859 -10.686   0.945
  469    HB2  GLU  65           2HB      GLU  65   3.606 -10.810   2.106
  470    HB3  GLU  65           1HB      GLU  65   3.281  -9.226   1.413
  471    HG2  GLU  65           2HG      GLU  65   3.536 -10.149  -0.830
  472    HG3  GLU  65           1HG      GLU  65   3.877 -11.734  -0.142
  473    H    PHE  66           H        PHE  66   5.924  -7.542   1.887
  474    HA   PHE  66           HA       PHE  66   5.793  -6.483  -0.809
  475    HB2  PHE  66           2HB      PHE  66   5.716  -5.240   1.908
  476    HB3  PHE  66           1HB      PHE  66   6.243  -4.266   0.544
  477    HD1  PHE  66           1HD      PHE  66   3.708  -6.902   0.208
  478    HD2  PHE  66           2HD      PHE  66   4.416  -2.730   0.670
  479    HE1  PHE  66           1HE      PHE  66   1.363  -6.442  -0.378
  480    HE2  PHE  66           2HE      PHE  66   2.071  -2.264   0.087
  481    HZ   PHE  66           HZ       PHE  66   0.542  -4.121  -0.437
  482    H    PHE  67           H        PHE  67   8.031  -7.229   1.733
  483    HA   PHE  67           HA       PHE  67  10.226  -5.730   0.627
  484    HB2  PHE  67           2HB      PHE  67   9.928  -7.737   2.842
  485    HB3  PHE  67           1HB      PHE  67  11.528  -7.261   2.285
  486    HD1  PHE  67           2HD      PHE  67   9.984  -4.343   1.721
  487    HD2  PHE  67           1HD      PHE  67  10.898  -6.866   5.032
  488    HE1  PHE  67           2HE      PHE  67   9.909  -2.400   3.222
  489    HE2  PHE  67           1HE      PHE  67  10.825  -4.920   6.535
  490    HZ   PHE  67           HZ       PHE  67  10.330  -2.685   5.630
  491    H    GLU  68           H        GLU  68   8.892  -8.902   0.215
  492    HA   GLU  68           HA       GLU  68  11.268  -9.891  -1.143
  493    HB2  GLU  68           2HB      GLU  68   8.597 -11.261  -0.804
  494    HB3  GLU  68           1HB      GLU  68  10.121 -12.007  -1.267
  495    HG2  GLU  68           2HG      GLU  68   9.770 -10.630   1.372
  496    HG3  GLU  68           1HG      GLU  68   9.330 -12.321   1.129
  497    H    ALA  69           H        ALA  69   8.136  -8.572  -1.869
  498    HA   ALA  69           HA       ALA  69   8.304  -9.325  -4.660
  499    HB1  ALA  69           1HB      ALA  69   6.144  -9.439  -3.485
  500    HB2  ALA  69           2HB      ALA  69   6.097  -8.365  -4.884
  501    HB3  ALA  69           3HB      ALA  69   6.218  -7.692  -3.258
  502    H    ALA  70           H        ALA  70   9.326  -6.884  -2.744
  503    HA   ALA  70           HA       ALA  70   9.241  -4.812  -4.796
  504    HB1  ALA  70           1HB      ALA  70  10.149  -3.331  -3.055
  505    HB2  ALA  70           2HB      ALA  70  10.219  -4.699  -1.946
  506    HB3  ALA  70           3HB      ALA  70   8.661  -4.128  -2.543
  507    H    ASP  71           H        ASP  71  11.483  -6.954  -3.193
  508    HA   ASP  71           HA       ASP  71  13.636  -5.921  -4.916
  509    HB2  ASP  71           2HB      ASP  71  13.808  -5.644  -2.328
  510    HB3  ASP  71           1HB      ASP  71  14.190  -7.364  -2.343
  511    HA   PRO  72           HA       PRO  72  13.287 -10.033  -6.682
  512    HB2  PRO  72           2HB      PRO  72  15.501  -9.828  -8.292
  513    HB3  PRO  72           1HB      PRO  72  13.909  -9.188  -8.711
  514    HG2  PRO  72           2HG      PRO  72  16.287  -7.769  -7.583
  515    HG3  PRO  72           1HG      PRO  72  15.156  -7.237  -8.841
  516    HD2  PRO  72           2HD      PRO  72  14.993  -6.336  -6.309
  517    HD3  PRO  72           1HD      PRO  72  13.547  -6.604  -7.304
  518    H    ASN  73           H        ASN  73  16.589  -8.866  -5.965
  519    HA   ASN  73           HA       ASN  73  17.537 -11.490  -5.349
  520    HB2  ASN  73           2HB      ASN  73  18.769  -8.775  -4.832
  521    HB3  ASN  73           1HB      ASN  73  19.599 -10.314  -4.623
  522   HD21  ASN  73          1HD2      ASN  73  19.618  -7.831  -6.540
  523   HD22  ASN  73          2HD2      ASN  73  19.876  -8.567  -8.082
  524    H    ASN  74           H        ASN  74  16.209  -8.837  -3.521
  525    HA   ASN  74           HA       ASN  74  15.389  -8.758  -1.396
  526    HB2  ASN  74           2HB      ASN  74  16.410 -11.553  -0.905
  527    HB3  ASN  74           1HB      ASN  74  15.090 -10.716  -0.094
  528   HD21  ASN  74          1HD2      ASN  74  16.020 -12.675  -2.728
  529   HD22  ASN  74          2HD2      ASN  74  14.463 -12.827  -3.462
  530    H    THR  75           H        THR  75  17.701  -7.556  -1.881
  531    HA   THR  75           HA       THR  75  19.622  -8.388   0.152
  532    HB   THR  75           HB       THR  75  21.190  -6.960  -0.886
  533    HG1  THR  75           1HG      THR  75  19.077  -5.783  -2.361
  534   HG21  THR  75          3HG2      THR  75  21.191  -7.513  -3.221
  535   HG22  THR  75          1HG2      THR  75  19.476  -7.920  -3.162
  536   HG23  THR  75          2HG2      THR  75  20.647  -8.909  -2.290
  537    H    GLY  76           H        GLY  76  17.024  -7.295   0.898
  538    HA2  GLY  76           2HA      GLY  76  16.172  -5.847   2.458
  539    HA3  GLY  76           1HA      GLY  76  17.834  -5.540   2.941
  540    H    PHE  77           H        PHE  77  16.651  -4.947  -0.295
  541    HA   PHE  77           HA       PHE  77  16.645  -2.058   0.246
  542    HB2  PHE  77           2HB      PHE  77  18.293  -3.579  -1.699
  543    HB3  PHE  77           1HB      PHE  77  17.604  -2.062  -2.267
  544    HD1  PHE  77           2HD      PHE  77  19.317  -3.335   0.800
  545    HD2  PHE  77           1HD      PHE  77  18.956  -0.229  -2.086
  546    HE1  PHE  77           2HE      PHE  77  21.136  -2.101   1.906
  547    HE2  PHE  77           1HE      PHE  77  20.775   1.010  -0.987
  548    HZ   PHE  77           HZ       PHE  77  21.866   0.075   1.012
  549    H    ILE  78           H        ILE  78  14.935  -1.006  -0.554
  550    HA   ILE  78           HA       ILE  78  13.133  -2.484  -2.351
  551    HB   ILE  78           HB       ILE  78  12.583  -0.181  -0.473
  552   HG12  ILE  78          2HG1      ILE  78  11.587  -3.032  -0.515
  553   HG13  ILE  78          1HG1      ILE  78  12.736  -2.352   0.636
  554   HG21  ILE  78          1HG2      ILE  78  10.709  -1.534  -2.408
  555   HG22  ILE  78          2HG2      ILE  78  11.261   0.140  -2.475
  556   HG23  ILE  78          3HG2      ILE  78  10.224  -0.392  -1.155
  557   HD11  ILE  78          3HD1      ILE  78  11.103  -1.548   1.905
  558   HD12  ILE  78          1HD1      ILE  78   9.997  -2.514   0.930
  559   HD13  ILE  78          2HD1      ILE  78  10.284  -0.821   0.519
  560    H    ASP  79           H        ASP  79  12.103  -1.403  -4.059
  561    HA   ASP  79           HA       ASP  79  13.654   0.833  -5.158
  562    HB2  ASP  79           2HB      ASP  79  11.988  -1.350  -6.340
  563    HB3  ASP  79           1HB      ASP  79  12.025   0.196  -7.186
  564    H    TYR  80           H        TYR  80  12.806   2.564  -4.082
  565    HA   TYR  80           HA       TYR  80  10.479   3.172  -3.027
  566    HB2  TYR  80           2HB      TYR  80  12.393   4.759  -3.366
  567    HB3  TYR  80           1HB      TYR  80  11.765   5.092  -4.976
  568    HD1  TYR  80           1HD      TYR  80   9.709   6.367  -5.272
  569    HD2  TYR  80           2HD      TYR  80  11.271   5.602  -1.389
  570    HE1  TYR  80           1HE      TYR  80   8.233   8.101  -4.344
  571    HE2  TYR  80           2HE      TYR  80   9.798   7.332  -0.450
  572    HH   TYR  80           HH       TYR  80   7.201   8.636  -2.109
  573    H    LYS  81           H        LYS  81  10.957   3.114  -6.537
  574    HA   LYS  81           HA       LYS  81   8.376   4.078  -7.196
  575    HB2  LYS  81           2HB      LYS  81  10.587   2.725  -8.657
  576    HB3  LYS  81           1HB      LYS  81   8.990   2.667  -9.387
  577    HG2  LYS  81           2HG      LYS  81   9.119   5.281  -8.807
  578    HG3  LYS  81           1HG      LYS  81  10.834   4.938  -9.033
  579    HD2  LYS  81           2HD      LYS  81  10.604   4.609 -11.252
  580    HD3  LYS  81           1HD      LYS  81   9.054   3.784 -11.070
  581    HE2  LYS  81           2HE      LYS  81   8.003   6.002 -10.646
  582    HE3  LYS  81           1HE      LYS  81   9.551   6.757 -11.020
  583    HZ1  LYS  81           3HZ      LYS  81   8.319   6.828 -12.993
  584    HZ2  LYS  81           1HZ      LYS  81   7.777   5.233 -12.832
  585    HZ3  LYS  81           2HZ      LYS  81   9.396   5.543 -13.215
  586    H    ALA  82           H        ALA  82   9.707   0.766  -7.234
  587    HA   ALA  82           HA       ALA  82   7.371  -0.598  -7.844
  588    HB1  ALA  82           1HB      ALA  82   9.033  -1.966  -5.861
  589    HB2  ALA  82           2HB      ALA  82   9.939  -1.322  -7.232
  590    HB3  ALA  82           3HB      ALA  82   8.603  -2.442  -7.505
  591    H    PHE  83           H        PHE  83   8.386   0.897  -4.885
  592    HA   PHE  83           HA       PHE  83   6.296  -0.364  -3.312
  593    HB2  PHE  83           2HB      PHE  83   8.802   0.835  -2.751
  594    HB3  PHE  83           1HB      PHE  83   7.577   1.810  -1.944
  595    HD1  PHE  83           2HD      PHE  83   8.320  -1.799  -2.507
  596    HD2  PHE  83           1HD      PHE  83   7.091   1.225   0.219
  597    HE1  PHE  83           2HE      PHE  83   8.194  -3.474  -0.716
  598    HE2  PHE  83           1HE      PHE  83   6.962  -0.446   2.021
  599    HZ   PHE  83           HZ       PHE  83   7.513  -2.802   1.555
  600    H    ALA  84           H        ALA  84   6.984   2.660  -4.916
  601    HA   ALA  84           HA       ALA  84   4.790   4.075  -3.697
  602    HB1  ALA  84           1HB      ALA  84   6.448   4.854  -6.091
  603    HB2  ALA  84           2HB      ALA  84   6.858   5.221  -4.415
  604    HB3  ALA  84           3HB      ALA  84   5.404   5.909  -5.138
  605    H    ALA  85           H        ALA  85   5.248   2.044  -6.448
  606    HA   ALA  85           HA       ALA  85   3.060   3.002  -7.975
  607    HB1  ALA  85           1HB      ALA  85   3.374   1.042  -9.356
  608    HB2  ALA  85           2HB      ALA  85   4.394   0.319  -8.112
  609    HB3  ALA  85           3HB      ALA  85   4.938   1.761  -8.970
  610    H    MET  86           H        MET  86   3.227   1.269  -5.206
  611    HA   MET  86           HA       MET  86   1.010  -0.484  -5.500
  612    HB2  MET  86           2HB      MET  86   2.515   0.570  -3.117
  613    HB3  MET  86           1HB      MET  86   1.091  -0.442  -2.925
  614    HG2  MET  86           2HG      MET  86   2.127  -2.291  -3.898
  615    HG3  MET  86           1HG      MET  86   3.399  -1.309  -4.623
  616    HE1  MET  86           3HE      MET  86   5.905  -2.915  -2.373
  617    HE2  MET  86           1HE      MET  86   5.402  -2.406  -3.985
  618    HE3  MET  86           2HE      MET  86   4.640  -3.802  -3.224
  619    H    LEU  87           H        LEU  87   1.414   2.784  -4.230
  620    HA   LEU  87           HA       LEU  87  -1.415   2.979  -3.650
  621    HB2  LEU  87           2HB      LEU  87   0.857   4.884  -3.258
  622    HB3  LEU  87           1HB      LEU  87  -0.801   5.269  -2.836
  623    HG   LEU  87           HG       LEU  87  -0.715   3.221  -1.299
  624   HD11  LEU  87          1HD1      LEU  87   2.137   3.451  -2.142
  625   HD12  LEU  87          2HD1      LEU  87   1.150   2.011  -1.887
  626   HD13  LEU  87          3HD1      LEU  87   1.752   2.924  -0.504
  627   HD21  LEU  87          3HD2      LEU  87  -0.422   5.775  -0.767
  628   HD22  LEU  87          1HD2      LEU  87   1.228   5.285  -0.387
  629   HD23  LEU  87          2HD2      LEU  87  -0.129   4.554   0.470
  630    H    TYR  88           H        TYR  88   0.494   3.375  -6.165
  631    HA   TYR  88           HA       TYR  88  -1.324   5.269  -7.489
  632    HB2  TYR  88           2HB      TYR  88   1.659   4.983  -7.887
  633    HB3  TYR  88           1HB      TYR  88   0.613   5.958  -8.915
  634    HD1  TYR  88           1HD      TYR  88   1.329   5.528  -5.267
  635    HD2  TYR  88           2HD      TYR  88   0.550   8.216  -8.470
  636    HE1  TYR  88           1HE      TYR  88   1.607   7.427  -3.730
  637    HE2  TYR  88           2HE      TYR  88   0.824  10.124  -6.942
  638    HH   TYR  88           HH       TYR  88   0.974   9.753  -3.544
  639    H    SER  89           H        SER  89  -1.201   2.263  -7.319
  640    HA   SER  89           HA       SER  89  -0.596   1.471 -10.043
  641    HB2  SER  89           2HB      SER  89  -1.014   0.116  -7.492
  642    HB3  SER  89           1HB      SER  89  -1.849  -0.685  -8.823
  643    HG   SER  89           HG       SER  89   0.867   0.098  -8.971
  644    H    VAL  90           H        VAL  90  -2.116   2.638 -11.240
  645    HA   VAL  90           HA       VAL  90  -4.152   3.206 -12.124
  646    HB   VAL  90           HB       VAL  90  -5.518   1.283 -12.816
  647   HG11  VAL  90          1HG1      VAL  90  -2.541   1.147 -13.137
  648   HG12  VAL  90          2HG1      VAL  90  -3.756   1.720 -14.279
  649   HG13  VAL  90          3HG1      VAL  90  -3.605  -0.004 -13.944
  650   HG21  VAL  90          3HG2      VAL  90  -5.061  -0.943 -12.140
  651   HG22  VAL  90          1HG2      VAL  90  -5.172   0.014 -10.662
  652   HG23  VAL  90          2HG2      VAL  90  -3.593  -0.458 -11.291
  653    H    ASP  91           H        ASP  91  -4.038   3.462  -9.232
  654    HA   ASP  91           HA       ASP  91  -6.454   2.484  -8.088
  655    HB2  ASP  91           2HB      ASP  91  -4.245   3.358  -6.954
  656    HB3  ASP  91           1HB      ASP  91  -5.066   4.914  -7.027
  657    H    GLU  92           H        GLU  92  -8.202   3.876  -7.270
  658    HA   GLU  92           HA       GLU  92  -8.683   6.469  -8.219
  659    HB2  GLU  92           2HB      GLU  92 -10.580   5.796  -9.827
  660    HB3  GLU  92           1HB      GLU  92  -8.928   5.727 -10.419
  661    HG2  GLU  92           2HG      GLU  92  -9.365   3.203  -9.375
  662    HG3  GLU  92           1HG      GLU  92 -10.896   3.623 -10.142
  663    H    SER  93           H        SER  93 -10.502   3.434  -7.759
  664    HA   SER  93           HA       SER  93 -12.489   4.854  -6.179
  665    HB2  SER  93           2HB      SER  93 -13.079   3.090  -7.912
  666    HB3  SER  93           1HB      SER  93 -12.425   1.895  -6.791
  667    HG   SER  93           HG       SER  93 -14.047   2.278  -5.409
  Start of MODEL   14
    1    H1   MET   1           1HT      MET   1 -21.638  20.569  31.564
    2    H2   MET   1           2HT      MET   1 -20.484  21.352  32.563
    3    H3   MET   1           3HT      MET   1 -21.793  22.243  31.901
    4    HA   MET   1           HA       MET   1 -23.299  20.750  33.139
    5    HB2  MET   1           2HB      MET   1 -20.606  19.863  34.093
    6    HB3  MET   1           1HB      MET   1 -21.958  19.829  35.218
    7    HG2  MET   1           2HG      MET   1 -22.948  18.089  34.190
    8    HG3  MET   1           1HG      MET   1 -22.448  18.611  32.583
    9    HE1  MET   1           2HE      MET   1 -20.731  18.093  31.397
   10    HE2  MET   1           3HE      MET   1 -20.765  16.330  31.413
   11    HE3  MET   1           1HE      MET   1 -19.272  17.186  31.793
   12    H    GLY   2           H        GLY   2 -20.477  21.899  34.981
   13    HA2  GLY   2           2HA      GLY   2 -22.212  23.700  36.471
   14    HA3  GLY   2           1HA      GLY   2 -20.528  23.342  36.824
   15    H    SER   3           H        SER   3 -18.917  24.253  35.270
   16    HA   SER   3           HA       SER   3 -19.516  27.041  34.846
   17    HB2  SER   3           2HB      SER   3 -17.253  25.777  35.589
   18    HB3  SER   3           1HB      SER   3 -16.953  25.924  33.858
   19    HG   SER   3           HG       SER   3 -17.350  27.954  35.772
   20    H    SER   4           H        SER   4 -18.935  24.188  32.873
   21    HA   SER   4           HA       SER   4 -18.976  25.674  30.400
   22    HB2  SER   4           2HB      SER   4 -18.725  22.780  31.136
   23    HB3  SER   4           1HB      SER   4 -19.131  23.221  29.478
   24    HG   SER   4           HG       SER   4 -17.208  24.227  29.261
   25    H    HIS   5           H        HIS   5 -20.642  25.897  28.989
   26    HA   HIS   5           HA       HIS   5 -23.181  24.564  29.624
   27    HB2  HIS   5           2HB      HIS   5 -22.697  27.511  29.273
   28    HB3  HIS   5           1HB      HIS   5 -24.272  26.807  28.924
   29    HD1  HIS   5           1HD      HIS   5 -23.164  24.852  31.608
   30    HD2  HIS   5           2HD      HIS   5 -24.529  28.766  31.305
   31    HE1  HIS   5           1HE      HIS   5 -23.916  25.483  33.922
   32    HE2  HIS   5           2HE      HIS   5 -24.655  27.883  33.734
   33    H    HIS   6           H        HIS   6 -24.812  25.128  27.746
   34    HA   HIS   6           HA       HIS   6 -25.381  24.791  25.572
   35    HB2  HIS   6           2HB      HIS   6 -23.876  26.920  25.446
   36    HB3  HIS   6           1HB      HIS   6 -22.707  25.836  24.701
   37    HD1  HIS   6           1HD      HIS   6 -24.537  28.283  23.445
   38    HD2  HIS   6           2HD      HIS   6 -24.814  24.194  22.759
   39    HE1  HIS   6           1HE      HIS   6 -25.675  28.051  21.215
   40    HE2  HIS   6           2HE      HIS   6 -25.752  25.570  20.781
   41    H    HIS   7           H        HIS   7 -24.149  22.652  26.976
   42    HA   HIS   7           HA       HIS   7 -22.131  21.341  25.543
   43    HB2  HIS   7           2HB      HIS   7 -22.832  20.696  27.817
   44    HB3  HIS   7           1HB      HIS   7 -24.365  20.116  27.177
   45    HD1  HIS   7           1HD      HIS   7 -24.330  17.884  25.858
   46    HD2  HIS   7           2HD      HIS   7 -20.647  19.001  27.425
   47    HE1  HIS   7           1HE      HIS   7 -22.874  15.842  25.672
   48    HE2  HIS   7           2HE      HIS   7 -20.625  16.568  26.549
   49    H    HIS   8           H        HIS   8 -25.557  20.352  25.590
   50    HA   HIS   8           HA       HIS   8 -26.891  19.417  24.006
   51    HB2  HIS   8           2HB      HIS   8 -25.891  21.657  22.862
   52    HB3  HIS   8           1HB      HIS   8 -25.317  20.445  21.723
   53    HD1  HIS   8           1HD      HIS   8 -26.865  20.443  19.801
   54    HD2  HIS   8           2HD      HIS   8 -28.890  20.811  23.410
   55    HE1  HIS   8           1HE      HIS   8 -29.307  20.449  19.202
   56    HE2  HIS   8           2HE      HIS   8 -30.511  20.760  21.393
   57    H    HIS   9           H        HIS   9 -26.518  18.315  21.562
   58    HA   HIS   9           HA       HIS   9 -24.534  16.210  22.108
   59    HB2  HIS   9           2HB      HIS   9 -25.934  14.732  20.743
   60    HB3  HIS   9           1HB      HIS   9 -26.861  15.426  22.068
   61    HD1  HIS   9           1HD      HIS   9 -26.875  15.011  18.453
   62    HD2  HIS   9           2HD      HIS   9 -28.598  17.615  21.193
   63    HE1  HIS   9           1HE      HIS   9 -28.748  16.143  17.217
   64    HE2  HIS   9           2HE      HIS   9 -29.723  17.777  18.870
   65    H    HIS  10           H        HIS  10 -23.147  15.519  20.500
   66    HA   HIS  10           HA       HIS  10 -22.840  17.380  18.258
   67    HB2  HIS  10           2HB      HIS  10 -20.558  16.309  18.064
   68    HB3  HIS  10           1HB      HIS  10 -20.846  17.203  19.551
   69    HD1  HIS  10           1HD      HIS  10 -20.036  16.015  21.551
   70    HD2  HIS  10           2HD      HIS  10 -21.197  13.372  18.563
   71    HE1  HIS  10           1HE      HIS  10 -19.573  13.720  22.467
   72    HE2  HIS  10           2HE      HIS  10 -20.202  12.141  20.607
   73    H    SER  11           H        SER  11 -22.429  16.607  16.133
   74    HA   SER  11           HA       SER  11 -22.494  13.904  15.376
   75    HB2  SER  11           2HB      SER  11 -24.727  13.631  14.531
   76    HB3  SER  11           1HB      SER  11 -24.856  14.138  16.215
   77    HG   SER  11           HG       SER  11 -25.580  16.071  15.601
   78    H    SER  12           H        SER  12 -22.043  13.653  13.221
   79    HA   SER  12           HA       SER  12 -22.212  16.023  11.500
   80    HB2  SER  12           2HB      SER  12 -19.933  15.590  10.646
   81    HB3  SER  12           1HB      SER  12 -19.924  15.974  12.368
   82    HG   SER  12           HG       SER  12 -19.762  13.388  11.205
   83    H    GLY  13           H        GLY  13 -23.108  15.568   9.599
   84    HA2  GLY  13           2HA      GLY  13 -23.495  12.763   8.873
   85    HA3  GLY  13           1HA      GLY  13 -24.333  14.141   8.176
   86    H    LEU  14           H        LEU  14 -21.028  12.828   8.424
   87    HA   LEU  14           HA       LEU  14 -20.252  14.049   5.937
   88    HB2  LEU  14           2HB      LEU  14 -18.857  13.308   8.106
   89    HB3  LEU  14           1HB      LEU  14 -18.616  11.878   7.120
   90    HG   LEU  14           HG       LEU  14 -18.085  14.549   5.903
   91   HD11  LEU  14          1HD1      LEU  14 -16.973  14.083   8.302
   92   HD12  LEU  14          2HD1      LEU  14 -16.161  14.963   7.008
   93   HD13  LEU  14          3HD1      LEU  14 -15.813  13.254   7.265
   94   HD21  LEU  14          3HD2      LEU  14 -17.188  11.724   5.539
   95   HD22  LEU  14          1HD2      LEU  14 -16.170  13.049   4.974
   96   HD23  LEU  14          2HD2      LEU  14 -17.810  12.869   4.349
   97    H    VAL  15           H        VAL  15 -20.491  13.227   3.968
   98    HA   VAL  15           HA       VAL  15 -20.563  10.338   3.586
   99    HB   VAL  15           HB       VAL  15 -22.913  10.906   3.875
  100   HG11  VAL  15          1HG1      VAL  15 -22.929  12.607   1.433
  101   HG12  VAL  15          2HG1      VAL  15 -22.417  13.326   2.961
  102   HG13  VAL  15          3HG1      VAL  15 -24.020  12.604   2.818
  103   HG21  VAL  15          3HG2      VAL  15 -23.632   9.601   2.170
  104   HG22  VAL  15          1HG2      VAL  15 -21.902   9.398   1.899
  105   HG23  VAL  15          2HG2      VAL  15 -22.814  10.564   0.942
  106    HA   PRO  16           HA       PRO  16 -17.849  12.508   0.504
  107    HB2  PRO  16           2HB      PRO  16 -16.933   9.672   0.386
  108    HB3  PRO  16           1HB      PRO  16 -15.983  11.162   0.430
  109    HG2  PRO  16           2HG      PRO  16 -16.205   9.635   2.597
  110    HG3  PRO  16           1HG      PRO  16 -16.221  11.404   2.724
  111    HD2  PRO  16           2HD      PRO  16 -18.482   9.468   2.919
  112    HD3  PRO  16           1HD      PRO  16 -18.221  10.990   3.792
  113    H    ARG  17           H        ARG  17 -18.918  12.873  -1.337
  114    HA   ARG  17           HA       ARG  17 -20.235  10.636  -2.702
  115    HB2  ARG  17           2HB      ARG  17 -21.280  12.490  -4.079
  116    HB3  ARG  17           1HB      ARG  17 -21.738  12.440  -2.381
  117    HG2  ARG  17           2HG      ARG  17 -19.418  14.133  -2.993
  118    HG3  ARG  17           1HG      ARG  17 -20.948  14.666  -3.690
  119    HD2  ARG  17           2HD      ARG  17 -21.886  14.252  -1.308
  120    HD3  ARG  17           1HD      ARG  17 -20.196  14.317  -0.814
  121    HE   ARG  17           HE       ARG  17 -21.844  16.518  -1.648
  122   HH11  ARG  17          1HH1      ARG  17 -18.569  15.354  -1.341
  123   HH12  ARG  17          2HH1      ARG  17 -17.877  16.940  -1.280
  124   HH21  ARG  17          1HH2      ARG  17 -20.938  18.606  -1.569
  125   HH22  ARG  17          2HH2      ARG  17 -19.223  18.786  -1.408
  126    H    GLY  18           H        GLY  18 -19.774  10.082  -4.813
  127    HA2  GLY  18           2HA      GLY  18 -18.652  10.999  -6.914
  128    HA3  GLY  18           1HA      GLY  18 -17.261  11.212  -5.863
  129    H    SER  19           H        SER  19 -18.006   8.665  -4.429
  130    HA   SER  19           HA       SER  19 -17.443   6.462  -4.502
  131    HB2  SER  19           2HB      SER  19 -19.228   6.599  -6.378
  132    HB3  SER  19           1HB      SER  19 -17.859   6.471  -7.482
  133    HG   SER  19           HG       SER  19 -18.928   4.447  -6.785
  134    H    HIS  20           H        HIS  20 -15.330   6.332  -4.023
  135    HA   HIS  20           HA       HIS  20 -13.452   6.220  -6.267
  136    HB2  HIS  20           2HB      HIS  20 -11.801   7.378  -4.547
  137    HB3  HIS  20           1HB      HIS  20 -12.825   8.330  -5.615
  138    HD1  HIS  20           1HD      HIS  20 -12.716   7.104  -2.033
  139    HD2  HIS  20           2HD      HIS  20 -14.527  10.046  -4.342
  140    HE1  HIS  20           1HE      HIS  20 -13.905   8.602  -0.401
  141    HE2  HIS  20           2HE      HIS  20 -15.065  10.324  -1.827
  142    H    MET  21           H        MET  21 -13.904   5.690  -2.783
  143    HA   MET  21           HA       MET  21 -13.196   4.039  -1.387
  144    HB2  MET  21           2HB      MET  21 -13.062   2.507  -3.989
  145    HB3  MET  21           1HB      MET  21 -12.883   1.773  -2.401
  146    HG2  MET  21           2HG      MET  21 -15.311   3.383  -3.064
  147    HG3  MET  21           1HG      MET  21 -15.174   1.704  -3.581
  148    HE1  MET  21           3HE      MET  21 -14.603   3.498   0.344
  149    HE2  MET  21           1HE      MET  21 -16.362   3.517   0.215
  150    HE3  MET  21           2HE      MET  21 -15.376   4.259  -1.046
  151    H    SER  22           H        SER  22 -11.247   5.886  -2.550
  152    HA   SER  22           HA       SER  22  -8.840   4.237  -2.641
  153    HB2  SER  22           2HB      SER  22  -7.741   5.986  -3.751
  154    HB3  SER  22           1HB      SER  22  -9.380   6.064  -4.397
  155    HG   SER  22           HG       SER  22  -9.717   7.899  -3.372
  156    H    ASP  23           H        ASP  23 -10.582   5.500  -0.333
  157    HA   ASP  23           HA       ASP  23  -8.772   7.040   1.179
  158    HB2  ASP  23           2HB      ASP  23 -11.114   5.430   2.153
  159    HB3  ASP  23           1HB      ASP  23 -10.322   6.734   3.036
  160    H    GLU  24           H        GLU  24  -8.933   3.814   0.551
  161    HA   GLU  24           HA       GLU  24  -7.905   2.715   2.921
  162    HB2  GLU  24           2HB      GLU  24  -9.000   1.420   1.067
  163    HB3  GLU  24           1HB      GLU  24  -7.511   1.622   0.151
  164    HG2  GLU  24           2HG      GLU  24  -6.291   0.264   1.615
  165    HG3  GLU  24           1HG      GLU  24  -7.529   0.355   2.867
  166    H    LYS  25           H        LYS  25  -6.528   4.583   0.581
  167    HA   LYS  25           HA       LYS  25  -3.794   3.723   1.082
  168    HB2  LYS  25           2HB      LYS  25  -4.711   4.388  -1.223
  169    HB3  LYS  25           1HB      LYS  25  -4.620   6.046  -0.644
  170    HG2  LYS  25           2HG      LYS  25  -2.135   5.131  -0.038
  171    HG3  LYS  25           1HG      LYS  25  -2.495   4.233  -1.515
  172    HD2  LYS  25           2HD      LYS  25  -1.623   6.125  -2.444
  173    HD3  LYS  25           1HD      LYS  25  -3.310   6.627  -2.319
  174    HE2  LYS  25           2HE      LYS  25  -2.829   7.755  -0.212
  175    HE3  LYS  25           1HE      LYS  25  -1.149   7.228  -0.303
  176    HZ1  LYS  25           3HZ      LYS  25  -1.928   9.588  -1.152
  177    HZ2  LYS  25           1HZ      LYS  25  -2.207   8.720  -2.577
  178    HZ3  LYS  25           2HZ      LYS  25  -0.662   8.746  -1.892
  179    H    THR  26           H        THR  26  -5.981   6.344   1.827
  180    HA   THR  26           HA       THR  26  -4.179   8.262   2.711
  181    HB   THR  26           HB       THR  26  -6.420   8.406   4.423
  182    HG1  THR  26           1HG      THR  26  -7.917   7.418   3.366
  183   HG21  THR  26          3HG2      THR  26  -7.015  10.005   2.265
  184   HG22  THR  26          1HG2      THR  26  -5.251   9.911   2.236
  185   HG23  THR  26          2HG2      THR  26  -6.084  10.472   3.690
  186    H    GLN  27           H        GLN  27  -5.161   5.290   4.198
  187    HA   GLN  27           HA       GLN  27  -4.426   5.868   6.857
  188    HB2  GLN  27           2HB      GLN  27  -4.322   3.237   5.364
  189    HB3  GLN  27           1HB      GLN  27  -4.190   3.412   7.109
  190    HG2  GLN  27           2HG      GLN  27  -6.445   4.315   7.206
  191    HG3  GLN  27           1HG      GLN  27  -6.581   4.188   5.453
  192   HE21  GLN  27          1HE2      GLN  27  -6.783   2.155   4.504
  193   HE22  GLN  27          2HE2      GLN  27  -7.240   0.761   5.417
  194    H    LEU  28           H        LEU  28  -2.628   5.311   3.987
  195    HA   LEU  28           HA       LEU  28  -0.141   4.760   5.341
  196    HB2  LEU  28           2HB      LEU  28  -0.706   3.626   3.237
  197    HB3  LEU  28           1HB      LEU  28  -0.771   5.183   2.437
  198    HG   LEU  28           HG       LEU  28   1.330   3.686   2.153
  199   HD11  LEU  28          1HD1      LEU  28   0.863   6.414   1.970
  200   HD12  LEU  28          2HD1      LEU  28   2.208   5.518   1.267
  201   HD13  LEU  28          3HD1      LEU  28   2.388   6.281   2.846
  202   HD21  LEU  28          3HD2      LEU  28   2.414   5.093   4.522
  203   HD22  LEU  28          1HD2      LEU  28   2.872   3.547   3.810
  204   HD23  LEU  28          2HD2      LEU  28   1.428   3.661   4.816
  205    H    ILE  29           H        ILE  29  -1.888   7.383   4.469
  206    HA   ILE  29           HA       ILE  29   0.070   9.236   3.713
  207    HB   ILE  29           HB       ILE  29  -2.598   9.664   4.986
  208   HG12  ILE  29          2HG1      ILE  29  -2.420   8.579   2.691
  209   HG13  ILE  29          1HG1      ILE  29  -3.469   9.985   2.831
  210   HG21  ILE  29          1HG2      ILE  29  -0.610  11.648   3.939
  211   HG22  ILE  29          2HG2      ILE  29  -1.517  11.672   5.451
  212   HG23  ILE  29          3HG2      ILE  29  -2.337  12.007   3.926
  213   HD11  ILE  29          3HD1      ILE  29  -1.552  11.344   1.946
  214   HD12  ILE  29          1HD1      ILE  29  -2.301  10.212   0.822
  215   HD13  ILE  29          2HD1      ILE  29  -0.756   9.814   1.580
  216    H    GLU  30           H        GLU  30  -0.577   7.843   6.551
  217    HA   GLU  30           HA       GLU  30   0.279   9.899   8.318
  218    HB2  GLU  30           2HB      GLU  30  -0.140   6.955   8.784
  219    HB3  GLU  30           1HB      GLU  30   0.301   8.087  10.055
  220    HG2  GLU  30           2HG      GLU  30  -2.034   8.900   8.503
  221    HG3  GLU  30           1HG      GLU  30  -2.240   7.383   9.375
  222    H    ALA  31           H        ALA  31   1.932   8.316   6.157
  223    HA   ALA  31           HA       ALA  31   4.333   7.819   7.735
  224    HB1  ALA  31           1HB      ALA  31   3.440   6.295   5.846
  225    HB2  ALA  31           2HB      ALA  31   5.172   6.617   5.936
  226    HB3  ALA  31           3HB      ALA  31   4.175   7.479   4.765
  227    H    PHE  32           H        PHE  32   3.015  10.101   5.460
  228    HA   PHE  32           HA       PHE  32   5.337  11.358   4.573
  229    HB2  PHE  32           2HB      PHE  32   2.637  11.737   4.209
  230    HB3  PHE  32           1HB      PHE  32   3.105  13.189   5.087
  231    HD1  PHE  32           1HD      PHE  32   5.701  13.858   4.106
  232    HD2  PHE  32           2HD      PHE  32   2.382  12.243   1.987
  233    HE1  PHE  32           1HE      PHE  32   6.557  14.843   2.019
  234    HE2  PHE  32           2HE      PHE  32   3.232  13.224  -0.102
  235    HZ   PHE  32           HZ       PHE  32   5.323  14.527  -0.087
  236    H    TYR  33           H        TYR  33   3.787  11.453   7.663
  237    HA   TYR  33           HA       TYR  33   5.344  13.785   8.496
  238    HB2  TYR  33           2HB      TYR  33   3.257  12.213  10.021
  239    HB3  TYR  33           1HB      TYR  33   4.001  13.722  10.539
  240    HD1  TYR  33           2HD      TYR  33   1.967  12.282   7.765
  241    HD2  TYR  33           1HD      TYR  33   2.971  15.742  10.028
  242    HE1  TYR  33           2HE      TYR  33   0.197  13.542   6.614
  243    HE2  TYR  33           1HE      TYR  33   1.202  17.011   8.885
  244    HH   TYR  33           HH       TYR  33  -1.226  15.957   7.514
  245    H    ASN  34           H        ASN  34   6.618  11.220   7.902
  246    HA   ASN  34           HA       ASN  34   8.414  11.089  10.047
  247    HB2  ASN  34           2HB      ASN  34   6.198   9.881  10.880
  248    HB3  ASN  34           1HB      ASN  34   6.879   8.530   9.978
  249   HD21  ASN  34          1HD2      ASN  34   9.367   8.340  10.428
  250   HD22  ASN  34          2HD2      ASN  34   9.782   8.317  12.106
  251    H    PHE  35           H        PHE  35   8.496  11.239   7.225
  252    HA   PHE  35           HA       PHE  35  10.501   9.329   6.668
  253    HB2  PHE  35           2HB      PHE  35   8.472   7.879   6.454
  254    HB3  PHE  35           1HB      PHE  35   7.927   8.915   5.139
  255    HD1  PHE  35           1HD      PHE  35  11.315   7.595   5.932
  256    HD2  PHE  35           2HD      PHE  35   8.037   7.643   3.218
  257    HE1  PHE  35           1HE      PHE  35  12.620   6.249   4.337
  258    HE2  PHE  35           2HE      PHE  35   9.335   6.295   1.619
  259    HZ   PHE  35           HZ       PHE  35  11.631   5.598   2.178
  260    H    ASP  36           H        ASP  36  10.314  12.108   6.543
  261    HA   ASP  36           HA       ASP  36  11.297  12.583   3.916
  262    HB2  ASP  36           2HB      ASP  36   8.496  13.339   4.559
  263    HB3  ASP  36           1HB      ASP  36   9.462  14.527   3.688
  264    H    GLY  37           H        GLY  37  12.969  13.101   5.559
  265    HA2  GLY  37           2HA      GLY  37  12.588  15.554   7.066
  266    HA3  GLY  37           1HA      GLY  37  14.027  14.545   7.059
  267    H    ASP  38           H        ASP  38  14.968  14.475   4.635
  268    HA   ASP  38           HA       ASP  38  15.139  17.273   3.725
  269    HB2  ASP  38           2HB      ASP  38  17.160  16.098   5.021
  270    HB3  ASP  38           1HB      ASP  38  17.507  15.499   3.402
  271    H    TYR  39           H        TYR  39  13.377  15.374   2.645
  272    HA   TYR  39           HA       TYR  39  12.662  14.580   0.639
  273    HB2  TYR  39           2HB      TYR  39  14.840  16.460  -0.183
  274    HB3  TYR  39           1HB      TYR  39  14.106  15.418  -1.395
  275    HD1  TYR  39           1HD      TYR  39  12.951  17.612   1.410
  276    HD2  TYR  39           2HD      TYR  39  12.411  16.370  -2.622
  277    HE1  TYR  39           1HE      TYR  39  11.095  19.207   1.174
  278    HE2  TYR  39           2HE      TYR  39  10.554  17.961  -2.871
  279    HH   TYR  39           HH       TYR  39  10.009  20.407  -1.332
  280    H    ASP  40           H        ASP  40  12.914  12.757  -0.594
  281    HA   ASP  40           HA       ASP  40  15.344  11.607  -1.370
  282    HB2  ASP  40           2HB      ASP  40  15.282   9.624   0.236
  283    HB3  ASP  40           1HB      ASP  40  15.885  11.146   0.887
  284    H    GLY  41           H        GLY  41  14.881  10.257  -2.987
  285    HA2  GLY  41           2HA      GLY  41  12.152   9.133  -3.086
  286    HA3  GLY  41           1HA      GLY  41  13.111   9.549  -4.498
  287    H    PHE  42           H        PHE  42  14.663   7.964  -1.841
  288    HA   PHE  42           HA       PHE  42  14.284   5.309  -2.917
  289    HB2  PHE  42           2HB      PHE  42  16.932   6.742  -3.116
  290    HB3  PHE  42           1HB      PHE  42  16.802   4.986  -3.146
  291    HD1  PHE  42           2HD      PHE  42  14.989   4.091  -4.883
  292    HD2  PHE  42           1HD      PHE  42  17.000   7.833  -5.126
  293    HE1  PHE  42           2HE      PHE  42  14.553   4.163  -7.304
  294    HE2  PHE  42           1HE      PHE  42  16.566   7.914  -7.547
  295    HZ   PHE  42           HZ       PHE  42  15.343   6.077  -8.638
  296    H    VAL  43           H        VAL  43  14.179   3.955  -1.259
  297    HA   VAL  43           HA       VAL  43  15.802   4.504   1.130
  298    HB   VAL  43           HB       VAL  43  13.496   5.238   1.578
  299   HG11  VAL  43          1HG1      VAL  43  12.232   3.850   0.107
  300   HG12  VAL  43          2HG1      VAL  43  11.719   3.487   1.754
  301   HG13  VAL  43          3HG1      VAL  43  12.804   2.385   0.906
  302   HG21  VAL  43          3HG2      VAL  43  14.922   4.285   3.369
  303   HG22  VAL  43          1HG2      VAL  43  14.172   2.715   3.085
  304   HG23  VAL  43          2HG2      VAL  43  13.196   4.067   3.659
  305    H    SER  44           H        SER  44  16.188   2.626   2.481
  306    HA   SER  44           HA       SER  44  16.192   0.144   0.900
  307    HB2  SER  44           2HB      SER  44  18.147  -0.532   2.132
  308    HB3  SER  44           1HB      SER  44  18.414   1.117   1.565
  309    HG   SER  44           HG       SER  44  18.686   1.643   3.570
  310    H    VAL  45           H        VAL  45  15.687  -1.835   1.909
  311    HA   VAL  45           HA       VAL  45  13.496  -1.828   3.626
  312    HB   VAL  45           HB       VAL  45  15.477  -4.064   3.160
  313   HG11  VAL  45          1HG1      VAL  45  13.873  -5.577   3.997
  314   HG12  VAL  45          2HG1      VAL  45  12.619  -4.341   4.049
  315   HG13  VAL  45          3HG1      VAL  45  13.967  -4.279   5.184
  316   HG21  VAL  45          3HG2      VAL  45  13.901  -4.852   1.480
  317   HG22  VAL  45          1HG2      VAL  45  14.456  -3.223   1.098
  318   HG23  VAL  45          2HG2      VAL  45  12.856  -3.468   1.794
  319    H    GLU  46           H        GLU  46  16.886  -2.616   4.364
  320    HA   GLU  46           HA       GLU  46  16.712  -3.206   7.028
  321    HB2  GLU  46           2HB      GLU  46  18.917  -1.481   5.913
  322    HB3  GLU  46           1HB      GLU  46  19.015  -2.650   7.223
  323    HG2  GLU  46           2HG      GLU  46  18.410  -4.399   5.463
  324    HG3  GLU  46           1HG      GLU  46  18.792  -3.151   4.278
  325    H    GLU  47           H        GLU  47  16.467  -0.075   5.512
  326    HA   GLU  47           HA       GLU  47  16.420   1.272   8.109
  327    HB2  GLU  47           2HB      GLU  47  16.165   2.549   5.386
  328    HB3  GLU  47           1HB      GLU  47  16.582   3.330   6.905
  329    HG2  GLU  47           2HG      GLU  47  18.327   1.181   5.784
  330    HG3  GLU  47           1HG      GLU  47  18.433   2.833   5.177
  331    H    PHE  48           H        PHE  48  14.375   0.349   5.446
  332    HA   PHE  48           HA       PHE  48  12.139   1.959   6.003
  333    HB2  PHE  48           2HB      PHE  48  12.801   0.180   4.046
  334    HB3  PHE  48           1HB      PHE  48  11.592  -0.734   4.936
  335    HD1  PHE  48           1HD      PHE  48   9.827   1.532   5.793
  336    HD2  PHE  48           2HD      PHE  48  11.676   0.653   2.061
  337    HE1  PHE  48           1HE      PHE  48   8.044   2.763   4.624
  338    HE2  PHE  48           2HE      PHE  48   9.899   1.884   0.886
  339    HZ   PHE  48           HZ       PHE  48   8.079   2.940   2.167
  340    H    ARG  49           H        ARG  49  13.193  -1.139   7.282
  341    HA   ARG  49           HA       ARG  49  10.864  -1.981   8.542
  342    HB2  ARG  49           2HB      ARG  49  13.778  -2.385   9.136
  343    HB3  ARG  49           1HB      ARG  49  12.557  -3.018  10.231
  344    HG2  ARG  49           2HG      ARG  49  11.545  -4.139   8.173
  345    HG3  ARG  49           1HG      ARG  49  13.073  -3.759   7.374
  346    HD2  ARG  49           2HD      ARG  49  14.252  -5.258   8.616
  347    HD3  ARG  49           1HD      ARG  49  13.219  -5.064  10.029
  348    HE   ARG  49           HE       ARG  49  11.938  -6.805   9.284
  349   HH11  ARG  49          1HH1      ARG  49  13.908  -5.653   6.643
  350   HH12  ARG  49          2HH1      ARG  49  13.460  -6.946   5.582
  351   HH21  ARG  49          1HH2      ARG  49  11.347  -8.504   7.888
  352   HH22  ARG  49          2HH2      ARG  49  12.005  -8.563   6.287
  353    H    GLY  50           H        GLY  50  13.506  -0.008   9.911
  354    HA2  GLY  50           2HA      GLY  50  12.397   0.397  12.437
  355    HA3  GLY  50           1HA      GLY  50  13.517   1.496  11.647
  356    H    ILE  51           H        ILE  51  11.616   1.898   9.394
  357    HA   ILE  51           HA       ILE  51  10.142   4.071  10.588
  358    HB   ILE  51           HB       ILE  51   9.994   3.164   7.717
  359   HG12  ILE  51          2HG1      ILE  51  11.928   5.175   8.880
  360   HG13  ILE  51          1HG1      ILE  51  12.361   3.514   8.496
  361   HG21  ILE  51          1HG2      ILE  51   8.918   5.093   7.280
  362   HG22  ILE  51          2HG2      ILE  51   9.864   6.010   8.453
  363   HG23  ILE  51          3HG2      ILE  51   8.510   5.018   8.994
  364   HD11  ILE  51          3HD1      ILE  51  13.034   4.479   6.575
  365   HD12  ILE  51          1HD1      ILE  51  11.886   5.811   6.712
  366   HD13  ILE  51          2HD1      ILE  51  11.341   4.235   6.142
  367    H    ILE  52           H        ILE  52   9.495   0.840   9.523
  368    HA   ILE  52           HA       ILE  52   6.609   1.259   9.531
  369    HB   ILE  52           HB       ILE  52   8.211  -1.239   8.962
  370   HG12  ILE  52          2HG1      ILE  52   8.489   0.605   7.309
  371   HG13  ILE  52          1HG1      ILE  52   7.716  -0.825   6.631
  372   HG21  ILE  52          1HG2      ILE  52   6.021  -1.819   9.785
  373   HG22  ILE  52          2HG2      ILE  52   6.087  -2.113   8.048
  374   HG23  ILE  52          3HG2      ILE  52   5.262  -0.683   8.670
  375   HD11  ILE  52          3HD1      ILE  52   6.784   1.865   6.702
  376   HD12  ILE  52          1HD1      ILE  52   5.655   0.832   7.580
  377   HD13  ILE  52          2HD1      ILE  52   6.074   0.458   5.908
  378    H    ARG  53           H        ARG  53   8.942  -0.932  11.109
  379    HA   ARG  53           HA       ARG  53   7.185  -2.069  12.942
  380    HB2  ARG  53           2HB      ARG  53  10.148  -1.695  12.848
  381    HB3  ARG  53           1HB      ARG  53   9.414  -2.280  14.335
  382    HG2  ARG  53           2HG      ARG  53   9.678  -4.301  13.423
  383    HG3  ARG  53           1HG      ARG  53   8.238  -3.892  12.490
  384    HD2  ARG  53           2HD      ARG  53   9.396  -3.639  10.572
  385    HD3  ARG  53           1HD      ARG  53  10.781  -2.910  11.382
  386    HE   ARG  53           HE       ARG  53  10.526  -5.607  10.603
  387   HH11  ARG  53          1HH1      ARG  53  11.710  -3.649  13.238
  388   HH12  ARG  53          2HH1      ARG  53  12.900  -4.807  13.730
  389   HH21  ARG  53          1HH2      ARG  53  12.090  -7.132  11.249
  390   HH22  ARG  53          2HH2      ARG  53  13.116  -6.785  12.600
  391    H    ASP  54           H        ASP  54   8.949   0.963  13.081
  392    HA   ASP  54           HA       ASP  54   7.763   1.486  15.725
  393    HB2  ASP  54           2HB      ASP  54  10.382   1.597  15.117
  394    HB3  ASP  54           1HB      ASP  54   9.923   3.249  14.715
  395    H    GLY  55           H        GLY  55   6.776   1.945  12.792
  396    HA2  GLY  55           2HA      GLY  55   5.910   4.718  13.308
  397    HA3  GLY  55           1HA      GLY  55   6.434   4.220  11.708
  398    H    LEU  56           H        LEU  56   5.108   2.866  10.466
  399    HA   LEU  56           HA       LEU  56   2.295   3.107  11.122
  400    HB2  LEU  56           2HB      LEU  56   3.756   2.152   8.668
  401    HB3  LEU  56           1HB      LEU  56   2.009   2.106   8.815
  402    HG   LEU  56           HG       LEU  56   2.073   4.602   9.192
  403   HD11  LEU  56          1HD1      LEU  56   4.211   5.177   9.801
  404   HD12  LEU  56          2HD1      LEU  56   4.231   5.580   8.084
  405   HD13  LEU  56          3HD1      LEU  56   4.955   4.073   8.646
  406   HD21  LEU  56          3HD2      LEU  56   1.885   3.168   6.914
  407   HD22  LEU  56          1HD2      LEU  56   3.268   4.193   6.531
  408   HD23  LEU  56          2HD2      LEU  56   1.730   4.923   6.988
  409    HA   PRO  57           HA       PRO  57   1.948  -1.087  12.526
  410    HB2  PRO  57           2HB      PRO  57  -0.725  -1.314  12.585
  411    HB3  PRO  57           1HB      PRO  57   0.139  -0.267  13.717
  412    HG2  PRO  57           2HG      PRO  57  -1.330   0.455  11.214
  413    HG3  PRO  57           1HG      PRO  57  -1.323   1.278  12.783
  414    HD2  PRO  57           2HD      PRO  57   0.178   2.071  10.627
  415    HD3  PRO  57           1HD      PRO  57   0.613   2.406  12.315
  416    H    MET  58           H        MET  58   2.373  -2.815  11.349
  417    HA   MET  58           HA       MET  58   0.539  -3.686   9.297
  418    HB2  MET  58           2HB      MET  58   2.834  -2.195   8.570
  419    HB3  MET  58           1HB      MET  58   3.156  -3.867   8.129
  420    HG2  MET  58           2HG      MET  58   1.286  -3.959   6.705
  421    HG3  MET  58           1HG      MET  58   0.624  -2.461   7.353
  422    HE1  MET  58           3HE      MET  58   3.621  -4.045   5.433
  423    HE2  MET  58           1HE      MET  58   3.702  -2.964   4.042
  424    HE3  MET  58           2HE      MET  58   2.249  -3.920   4.331
  425    H    THR  59           H        THR  59   0.513  -5.858   9.097
  426    HA   THR  59           HA       THR  59   1.933  -7.416  11.026
  427    HB   THR  59           HB       THR  59   0.849  -9.268   9.339
  428    HG1  THR  59           1HG      THR  59  -0.975  -7.118   9.257
  429   HG21  THR  59          3HG2      THR  59  -1.322  -8.825  10.771
  430   HG22  THR  59          1HG2      THR  59  -0.205  -7.822  11.698
  431   HG23  THR  59          2HG2      THR  59   0.131  -9.539  11.471
  432    H    GLU  60           H        GLU  60   3.514  -8.974  10.705
  433    HA   GLU  60           HA       GLU  60   5.687  -8.512   9.191
  434    HB2  GLU  60           2HB      GLU  60   6.027 -11.063   9.183
  435    HB3  GLU  60           1HB      GLU  60   5.886 -10.259  10.739
  436    HG2  GLU  60           2HG      GLU  60   3.405 -10.881  10.614
  437    HG3  GLU  60           1HG      GLU  60   3.885 -11.980   9.323
  438    H    ALA  61           H        ALA  61   3.037 -10.609   8.196
  439    HA   ALA  61           HA       ALA  61   3.867 -11.419   5.727
  440    HB1  ALA  61           1HB      ALA  61   1.511 -11.646   5.136
  441    HB2  ALA  61           2HB      ALA  61   1.067 -10.616   6.497
  442    HB3  ALA  61           3HB      ALA  61   1.809 -12.190   6.787
  443    H    GLU  62           H        GLU  62   1.915  -8.496   6.373
  444    HA   GLU  62           HA       GLU  62   1.862  -7.480   3.797
  445    HB2  GLU  62           2HB      GLU  62   2.300  -5.459   5.917
  446    HB3  GLU  62           1HB      GLU  62   1.048  -5.546   4.689
  447    HG2  GLU  62           2HG      GLU  62   0.207  -7.550   6.164
  448    HG3  GLU  62           1HG      GLU  62   1.131  -6.716   7.412
  449    H    ILE  63           H        ILE  63   4.122  -6.461   6.348
  450    HA   ILE  63           HA       ILE  63   5.873  -5.010   4.727
  451    HB   ILE  63           HB       ILE  63   6.796  -6.589   7.118
  452   HG12  ILE  63          2HG1      ILE  63   6.118  -4.111   8.097
  453   HG13  ILE  63          1HG1      ILE  63   4.795  -4.454   6.984
  454   HG21  ILE  63          1HG2      ILE  63   8.676  -5.527   6.560
  455   HG22  ILE  63          2HG2      ILE  63   7.905  -4.096   7.243
  456   HG23  ILE  63          3HG2      ILE  63   7.837  -4.390   5.506
  457   HD11  ILE  63          3HD1      ILE  63   5.131  -6.821   8.348
  458   HD12  ILE  63          1HD1      ILE  63   3.888  -5.608   8.635
  459   HD13  ILE  63          2HD1      ILE  63   5.374  -5.580   9.580
  460    H    THR  64           H        THR  64   6.487  -8.249   6.055
  461    HA   THR  64           HA       THR  64   8.753  -8.881   4.632
  462    HB   THR  64           HB       THR  64   6.513 -10.690   5.511
  463    HG1  THR  64           1HG      THR  64   7.431  -9.641   7.242
  464   HG21  THR  64          3HG2      THR  64   9.322 -11.389   4.717
  465   HG22  THR  64          1HG2      THR  64   7.822 -11.944   3.974
  466   HG23  THR  64          2HG2      THR  64   8.240 -12.462   5.608
  467    H    GLU  65           H        GLU  65   5.390  -9.688   3.740
  468    HA   GLU  65           HA       GLU  65   6.101 -10.821   1.258
  469    HB2  GLU  65           2HB      GLU  65   3.460  -9.614   2.049
  470    HB3  GLU  65           1HB      GLU  65   3.726 -10.667   0.668
  471    HG2  GLU  65           2HG      GLU  65   4.348 -11.568   3.455
  472    HG3  GLU  65           1HG      GLU  65   2.721 -11.681   2.790
  473    H    PHE  66           H        PHE  66   5.975  -7.717   2.326
  474    HA   PHE  66           HA       PHE  66   5.641  -6.548  -0.300
  475    HB2  PHE  66           2HB      PHE  66   5.687  -5.458   2.475
  476    HB3  PHE  66           1HB      PHE  66   6.158  -4.388   1.161
  477    HD1  PHE  66           2HD      PHE  66   3.639  -7.020   0.719
  478    HD2  PHE  66           1HD      PHE  66   4.320  -2.886   1.471
  479    HE1  PHE  66           2HE      PHE  66   1.271  -6.548   0.248
  480    HE2  PHE  66           1HE      PHE  66   1.952  -2.409   1.001
  481    HZ   PHE  66           HZ       PHE  66   0.425  -4.239   0.387
  482    H    PHE  67           H        PHE  67   8.104  -7.348   2.008
  483    HA   PHE  67           HA       PHE  67  10.132  -5.745   0.681
  484    HB2  PHE  67           2HB      PHE  67  10.099  -7.568   3.063
  485    HB3  PHE  67           1HB      PHE  67  11.631  -7.093   2.341
  486    HD1  PHE  67           2HD      PHE  67  10.577  -4.241   1.571
  487    HD2  PHE  67           1HD      PHE  67  10.562  -6.530   5.161
  488    HE1  PHE  67           2HE      PHE  67  10.533  -2.167   2.890
  489    HE2  PHE  67           1HE      PHE  67  10.519  -4.457   6.484
  490    HZ   PHE  67           HZ       PHE  67  10.505  -2.275   5.349
  491    H    GLU  68           H        GLU  68   8.917  -8.984   0.593
  492    HA   GLU  68           HA       GLU  68  11.230  -9.945  -0.905
  493    HB2  GLU  68           2HB      GLU  68   8.734 -11.473  -0.162
  494    HB3  GLU  68           1HB      GLU  68  10.270 -12.138  -0.702
  495    HG2  GLU  68           2HG      GLU  68  10.330 -10.470   1.734
  496    HG3  GLU  68           1HG      GLU  68   9.534 -12.038   1.859
  497    H    ALA  69           H        ALA  69   7.937  -8.926  -1.372
  498    HA   ALA  69           HA       ALA  69   7.838  -9.945  -4.076
  499    HB1  ALA  69           1HB      ALA  69   5.833  -8.258  -2.621
  500    HB2  ALA  69           2HB      ALA  69   5.841 -10.022  -2.630
  501    HB3  ALA  69           3HB      ALA  69   5.567  -9.132  -4.130
  502    H    ALA  70           H        ALA  70   8.931  -7.264  -2.560
  503    HA   ALA  70           HA       ALA  70   8.544  -5.486  -4.854
  504    HB1  ALA  70           1HB      ALA  70   9.221  -3.678  -3.423
  505    HB2  ALA  70           2HB      ALA  70   9.702  -4.805  -2.154
  506    HB3  ALA  70           3HB      ALA  70   7.999  -4.638  -2.590
  507    H    ASP  71           H        ASP  71  10.981  -7.268  -3.130
  508    HA   ASP  71           HA       ASP  71  13.001  -6.275  -5.029
  509    HB2  ASP  71           2HB      ASP  71  13.391  -5.544  -2.666
  510    HB3  ASP  71           1HB      ASP  71  13.536  -7.240  -2.214
  511    HA   PRO  72           HA       PRO  72  12.787 -10.637  -6.179
  512    HB2  PRO  72           2HB      PRO  72  14.558 -10.446  -8.247
  513    HB3  PRO  72           1HB      PRO  72  12.853 -10.004  -8.378
  514    HG2  PRO  72           2HG      PRO  72  15.238  -8.248  -7.949
  515    HG3  PRO  72           1HG      PRO  72  13.839  -7.997  -9.010
  516    HD2  PRO  72           2HD      PRO  72  14.061  -6.771  -6.621
  517    HD3  PRO  72           1HD      PRO  72  12.490  -7.286  -7.272
  518    H    ASN  73           H        ASN  73  15.906  -8.903  -6.153
  519    HA   ASN  73           HA       ASN  73  17.455 -11.228  -5.663
  520    HB2  ASN  73           2HB      ASN  73  18.018  -8.279  -5.414
  521    HB3  ASN  73           1HB      ASN  73  19.218  -9.489  -4.974
  522   HD21  ASN  73          1HD2      ASN  73  18.173  -7.541  -7.394
  523   HD22  ASN  73          2HD2      ASN  73  18.834  -8.382  -8.749
  524    H    ASN  74           H        ASN  74  15.849  -8.910  -3.603
  525    HA   ASN  74           HA       ASN  74  15.338  -8.969  -1.383
  526    HB2  ASN  74           2HB      ASN  74  16.776 -11.616  -1.184
  527    HB3  ASN  74           1HB      ASN  74  15.508 -10.991  -0.136
  528   HD21  ASN  74          1HD2      ASN  74  16.224 -12.853  -2.850
  529   HD22  ASN  74          2HD2      ASN  74  14.609 -13.121  -3.402
  530    H    THR  75           H        THR  75  17.780  -7.849  -2.471
  531    HA   THR  75           HA       THR  75  19.964  -8.361  -0.750
  532    HB   THR  75           HB       THR  75  20.952  -6.349  -1.696
  533    HG1  THR  75           1HG      THR  75  19.792  -4.816  -2.583
  534   HG21  THR  75          3HG2      THR  75  21.030  -6.904  -3.961
  535   HG22  THR  75          1HG2      THR  75  19.397  -7.572  -3.945
  536   HG23  THR  75          2HG2      THR  75  20.710  -8.429  -3.136
  537    H    GLY  76           H        GLY  76  17.132  -6.383  -0.479
  538    HA2  GLY  76           2HA      GLY  76  16.456  -5.794   1.798
  539    HA3  GLY  76           1HA      GLY  76  18.136  -5.392   2.116
  540    H    PHE  77           H        PHE  77  16.870  -4.468  -0.946
  541    HA   PHE  77           HA       PHE  77  16.231  -1.773  -0.005
  542    HB2  PHE  77           2HB      PHE  77  18.086  -2.208  -2.347
  543    HB3  PHE  77           1HB      PHE  77  17.699  -0.691  -1.542
  544    HD1  PHE  77           2HD      PHE  77  19.226  -4.017  -0.837
  545    HD2  PHE  77           1HD      PHE  77  19.166   0.152   0.014
  546    HE1  PHE  77           2HE      PHE  77  21.198  -4.288   0.611
  547    HE2  PHE  77           1HE      PHE  77  21.137  -0.111   1.463
  548    HZ   PHE  77           HZ       PHE  77  22.155  -2.333   1.764
  549    H    ILE  78           H        ILE  78  14.503  -0.932  -1.018
  550    HA   ILE  78           HA       ILE  78  13.505  -2.347  -3.406
  551    HB   ILE  78           HB       ILE  78  11.829  -0.521  -1.715
  552   HG12  ILE  78          2HG1      ILE  78  11.501  -3.407  -1.260
  553   HG13  ILE  78          1HG1      ILE  78  12.974  -2.716  -0.581
  554   HG21  ILE  78          1HG2      ILE  78   9.992  -1.644  -2.701
  555   HG22  ILE  78          2HG2      ILE  78  11.033  -2.896  -3.376
  556   HG23  ILE  78          3HG2      ILE  78  11.113  -1.250  -4.000
  557   HD11  ILE  78          3HD1      ILE  78  10.336  -2.624   0.433
  558   HD12  ILE  78          1HD1      ILE  78  10.817  -0.977   0.021
  559   HD13  ILE  78          2HD1      ILE  78  11.806  -1.935   1.125
  560    H    ASP  79           H        ASP  79  12.720  -1.181  -5.156
  561    HA   ASP  79           HA       ASP  79  13.900   1.423  -5.539
  562    HB2  ASP  79           2HB      ASP  79  12.067  -0.238  -7.296
  563    HB3  ASP  79           1HB      ASP  79  12.786   1.294  -7.781
  564    H    TYR  80           H        TYR  80  12.955   2.992  -4.378
  565    HA   TYR  80           HA       TYR  80  10.675   3.302  -3.139
  566    HB2  TYR  80           2HB      TYR  80  12.385   5.093  -3.451
  567    HB3  TYR  80           1HB      TYR  80  11.648   5.472  -5.003
  568    HD1  TYR  80           1HD      TYR  80  11.267   5.656  -1.365
  569    HD2  TYR  80           2HD      TYR  80   9.498   6.595  -5.119
  570    HE1  TYR  80           1HE      TYR  80   9.692   7.171  -0.237
  571    HE2  TYR  80           2HE      TYR  80   7.919   8.113  -4.002
  572    HH   TYR  80           HH       TYR  80   6.946   8.447  -1.777
  573    H    LYS  81           H        LYS  81  10.859   3.580  -6.668
  574    HA   LYS  81           HA       LYS  81   8.192   4.378  -7.069
  575    HB2  LYS  81           2HB      LYS  81  10.204   2.990  -8.824
  576    HB3  LYS  81           1HB      LYS  81   8.572   3.315  -9.389
  577    HG2  LYS  81           2HG      LYS  81   9.061   5.751  -8.690
  578    HG3  LYS  81           1HG      LYS  81  10.751   5.245  -8.714
  579    HD2  LYS  81           2HD      LYS  81  10.820   5.214 -10.953
  580    HD3  LYS  81           1HD      LYS  81   9.260   4.397 -11.075
  581    HE2  LYS  81           2HE      LYS  81   8.125   6.327 -11.342
  582    HE3  LYS  81           1HE      LYS  81   9.146   7.205 -10.204
  583    HZ1  LYS  81           3HZ      LYS  81  10.551   7.857 -11.829
  584    HZ2  LYS  81           1HZ      LYS  81   9.189   7.643 -12.809
  585    HZ3  LYS  81           2HZ      LYS  81  10.373   6.438 -12.732
  586    H    ALA  82           H        ALA  82   9.658   1.135  -7.321
  587    HA   ALA  82           HA       ALA  82   7.370  -0.326  -7.855
  588    HB1  ALA  82           1HB      ALA  82   9.018  -1.790  -6.010
  589    HB2  ALA  82           2HB      ALA  82  10.030  -0.901  -7.150
  590    HB3  ALA  82           3HB      ALA  82   8.806  -2.022  -7.747
  591    H    PHE  83           H        PHE  83   8.395   1.173  -4.907
  592    HA   PHE  83           HA       PHE  83   6.400  -0.233  -3.319
  593    HB2  PHE  83           2HB      PHE  83   8.917   0.939  -2.785
  594    HB3  PHE  83           1HB      PHE  83   7.725   1.874  -1.884
  595    HD1  PHE  83           1HD      PHE  83   7.721  -1.736  -2.720
  596    HD2  PHE  83           2HD      PHE  83   8.041   1.212   0.329
  597    HE1  PHE  83           1HE      PHE  83   7.662  -3.500  -1.017
  598    HE2  PHE  83           2HE      PHE  83   7.982  -0.550   2.045
  599    HZ   PHE  83           HZ       PHE  83   7.792  -2.915   1.373
  600    H    ALA  84           H        ALA  84   6.964   2.873  -4.803
  601    HA   ALA  84           HA       ALA  84   4.803   4.176  -3.394
  602    HB1  ALA  84           1HB      ALA  84   6.336   5.142  -5.804
  603    HB2  ALA  84           2HB      ALA  84   6.828   5.399  -4.130
  604    HB3  ALA  84           3HB      ALA  84   5.329   6.111  -4.728
  605    H    ALA  85           H        ALA  85   5.243   2.435  -6.369
  606    HA   ALA  85           HA       ALA  85   2.887   3.393  -7.641
  607    HB1  ALA  85           1HB      ALA  85   4.446   0.899  -8.228
  608    HB2  ALA  85           2HB      ALA  85   4.800   2.491  -8.900
  609    HB3  ALA  85           3HB      ALA  85   3.285   1.681  -9.301
  610    H    MET  86           H        MET  86   3.403   1.333  -5.156
  611    HA   MET  86           HA       MET  86   1.280  -0.534  -5.587
  612    HB2  MET  86           2HB      MET  86   3.369  -0.804  -4.088
  613    HB3  MET  86           1HB      MET  86   2.455   0.107  -2.896
  614    HG2  MET  86           2HG      MET  86   2.105  -2.142  -2.364
  615    HG3  MET  86           1HG      MET  86   0.628  -1.619  -3.173
  616    HE1  MET  86           3HE      MET  86   3.921  -4.120  -5.215
  617    HE2  MET  86           1HE      MET  86   4.097  -3.256  -3.687
  618    HE3  MET  86           2HE      MET  86   3.987  -2.358  -5.200
  619    H    LEU  87           H        LEU  87   1.658   2.499  -3.844
  620    HA   LEU  87           HA       LEU  87  -1.049   2.381  -2.848
  621    HB2  LEU  87           2HB      LEU  87   1.112   4.429  -2.576
  622    HB3  LEU  87           1HB      LEU  87  -0.474   4.606  -1.850
  623    HG   LEU  87           HG       LEU  87   0.819   2.088  -1.129
  624   HD11  LEU  87          1HD1      LEU  87   2.363   3.284   0.504
  625   HD12  LEU  87          2HD1      LEU  87   2.189   4.692  -0.544
  626   HD13  LEU  87          3HD1      LEU  87   2.879   3.201  -1.180
  627   HD21  LEU  87          3HD2      LEU  87   0.003   2.620   1.026
  628   HD22  LEU  87          1HD2      LEU  87  -1.228   3.163  -0.114
  629   HD23  LEU  87          2HD2      LEU  87  -0.138   4.332   0.630
  630    H    TYR  88           H        TYR  88   0.388   3.235  -5.555
  631    HA   TYR  88           HA       TYR  88  -1.770   5.068  -6.344
  632    HB2  TYR  88           2HB      TYR  88   1.132   5.183  -7.187
  633    HB3  TYR  88           1HB      TYR  88  -0.150   6.154  -7.905
  634    HD1  TYR  88           2HD      TYR  88   1.148   5.343  -4.488
  635    HD2  TYR  88           1HD      TYR  88  -0.341   8.316  -7.142
  636    HE1  TYR  88           2HE      TYR  88   1.478   7.051  -2.750
  637    HE2  TYR  88           1HE      TYR  88  -0.016  10.032  -5.412
  638    HH   TYR  88           HH       TYR  88   1.767   9.448  -2.554
  639    H    SER  89           H        SER  89  -1.328   2.098  -6.601
  640    HA   SER  89           HA       SER  89  -0.851   1.532  -9.346
  641    HB2  SER  89           2HB      SER  89  -2.526  -0.350  -7.783
  642    HB3  SER  89           1HB      SER  89  -1.091  -0.659  -8.756
  643    HG   SER  89           HG       SER  89  -1.286  -0.325  -6.103
  644    H    VAL  90           H        VAL  90  -2.356   3.397  -9.976
  645    HA   VAL  90           HA       VAL  90  -4.257   4.108 -11.006
  646    HB   VAL  90           HB       VAL  90  -5.043   1.203 -11.202
  647   HG11  VAL  90          1HG1      VAL  90  -5.520   2.948 -13.480
  648   HG12  VAL  90          2HG1      VAL  90  -6.341   3.494 -12.018
  649   HG13  VAL  90          3HG1      VAL  90  -6.623   1.864 -12.632
  650   HG21  VAL  90          3HG2      VAL  90  -2.841   2.679 -12.506
  651   HG22  VAL  90          1HG2      VAL  90  -3.835   1.668 -13.555
  652   HG23  VAL  90          2HG2      VAL  90  -3.011   0.956 -12.168
  653    H    ASP  91           H        ASP  91  -4.262   3.759  -8.104
  654    HA   ASP  91           HA       ASP  91  -5.692   3.914  -6.343
  655    HB2  ASP  91           2HB      ASP  91  -7.608   4.544  -8.593
  656    HB3  ASP  91           1HB      ASP  91  -8.047   4.660  -6.891
  657    H    GLU  92           H        GLU  92  -5.232   1.320  -7.567
  658    HA   GLU  92           HA       GLU  92  -5.931  -0.833  -7.358
  659    HB2  GLU  92           2HB      GLU  92  -7.473   0.598  -5.257
  660    HB3  GLU  92           1HB      GLU  92  -7.992  -1.032  -5.666
  661    HG2  GLU  92           2HG      GLU  92  -5.109  -0.759  -5.256
  662    HG3  GLU  92           1HG      GLU  92  -6.086  -0.404  -3.833
  663    H    SER  93           H        SER  93  -7.582  -2.327  -8.021
  664    HA   SER  93           HA       SER  93  -9.238  -3.038  -9.407
  665    HB2  SER  93           2HB      SER  93 -10.419  -0.681  -8.038
  666    HB3  SER  93           1HB      SER  93 -11.256  -1.259  -9.479
  667    HG   SER  93           HG       SER  93 -11.318  -2.274  -7.030
  Start of MODEL   15
    1    H1   MET   1           1HT      MET   1 -11.393  36.879  -4.934
    2    H2   MET   1           2HT      MET   1 -10.941  35.914  -6.279
    3    H3   MET   1           3HT      MET   1  -9.735  36.613  -5.278
    4    HA   MET   1           HA       MET   1 -10.121  34.230  -4.928
    5    HB2  MET   1           2HB      MET   1 -10.378  36.352  -2.828
    6    HB3  MET   1           1HB      MET   1 -10.431  34.660  -2.358
    7    HG2  MET   1           2HG      MET   1  -8.239  34.323  -2.789
    8    HG3  MET   1           1HG      MET   1  -8.210  35.475  -4.123
    9    HE1  MET   1           2HE      MET   1  -6.418  34.647  -1.649
   10    HE2  MET   1           3HE      MET   1  -6.023  35.981  -0.564
   11    HE3  MET   1           1HE      MET   1  -5.498  36.028  -2.247
   12    H    GLY   2           H        GLY   2 -11.436  32.796  -3.431
   13    HA2  GLY   2           2HA      GLY   2 -14.180  33.442  -2.964
   14    HA3  GLY   2           1HA      GLY   2 -13.992  32.432  -4.390
   15    H    SER   3           H        SER   3 -14.865  30.555  -3.678
   16    HA   SER   3           HA       SER   3 -14.580  29.470  -1.112
   17    HB2  SER   3           2HB      SER   3 -15.104  28.041  -3.730
   18    HB3  SER   3           1HB      SER   3 -15.357  27.354  -2.127
   19    HG   SER   3           HG       SER   3 -16.606  29.750  -2.968
   20    H    SER   4           H        SER   4 -13.163  28.041  -0.204
   21    HA   SER   4           HA       SER   4 -10.687  27.555  -1.718
   22    HB2  SER   4           2HB      SER   4  -9.514  27.494   0.378
   23    HB3  SER   4           1HB      SER   4 -10.541  28.928   0.390
   24    HG   SER   4           HG       SER   4 -10.831  26.515   1.801
   25    H    HIS   5           H        HIS   5 -13.033  26.055   0.460
   26    HA   HIS   5           HA       HIS   5 -11.847  23.506   0.566
   27    HB2  HIS   5           2HB      HIS   5 -14.691  24.436   0.946
   28    HB3  HIS   5           1HB      HIS   5 -14.212  22.754   1.153
   29    HD1  HIS   5           1HD      HIS   5 -15.355  24.293   3.526
   30    HD2  HIS   5           2HD      HIS   5 -11.294  24.047   2.681
   31    HE1  HIS   5           1HE      HIS   5 -14.188  24.733   5.709
   32    HE2  HIS   5           2HE      HIS   5 -11.733  24.493   5.190
   33    H    HIS   6           H        HIS   6 -14.920  24.178  -1.089
   34    HA   HIS   6           HA       HIS   6 -15.817  23.379  -3.020
   35    HB2  HIS   6           2HB      HIS   6 -12.931  23.692  -3.662
   36    HB3  HIS   6           1HB      HIS   6 -13.905  22.749  -4.787
   37    HD1  HIS   6           1HD      HIS   6 -16.510  24.511  -4.521
   38    HD2  HIS   6           2HD      HIS   6 -12.673  25.936  -5.237
   39    HE1  HIS   6           1HE      HIS   6 -16.820  26.743  -5.638
   40    HE2  HIS   6           2HE      HIS   6 -14.484  27.625  -5.981
   41    H    HIS   7           H        HIS   7 -15.628  21.422  -4.639
   42    HA   HIS   7           HA       HIS   7 -15.799  19.171  -4.915
   43    HB2  HIS   7           2HB      HIS   7 -13.348  19.261  -4.676
   44    HB3  HIS   7           1HB      HIS   7 -13.515  19.090  -2.932
   45    HD1  HIS   7           1HD      HIS   7 -11.848  16.982  -3.969
   46    HD2  HIS   7           2HD      HIS   7 -15.987  16.673  -4.194
   47    HE1  HIS   7           1HE      HIS   7 -12.327  14.527  -4.230
   48    HE2  HIS   7           2HE      HIS   7 -14.840  14.357  -4.278
   49    H    HIS   8           H        HIS   8 -17.688  18.452  -4.151
   50    HA   HIS   8           HA       HIS   8 -17.848  17.012  -1.748
   51    HB2  HIS   8           2HB      HIS   8 -17.956  19.637  -1.148
   52    HB3  HIS   8           1HB      HIS   8 -19.661  19.342  -1.468
   53    HD1  HIS   8           1HD      HIS   8 -19.190  20.074   1.311
   54    HD2  HIS   8           2HD      HIS   8 -18.693  16.153   0.030
   55    HE1  HIS   8           1HE      HIS   8 -19.386  18.661   3.381
   56    HE2  HIS   8           2HE      HIS   8 -18.996  16.300   2.594
   57    H    HIS   9           H        HIS   9 -19.055  15.424  -2.552
   58    HA   HIS   9           HA       HIS   9 -21.021  15.793  -4.569
   59    HB2  HIS   9           2HB      HIS   9 -21.583  13.392  -4.082
   60    HB3  HIS   9           1HB      HIS   9 -19.887  13.685  -4.455
   61    HD1  HIS   9           1HD      HIS   9 -19.870  11.231  -3.139
   62    HD2  HIS   9           2HD      HIS   9 -20.410  14.671  -0.873
   63    HE1  HIS   9           1HE      HIS   9 -19.299  10.578  -0.778
   64    HE2  HIS   9           2HE      HIS   9 -19.715  12.654   0.589
   65    H    HIS  10           H        HIS  10 -22.409  17.394  -3.662
   66    HA   HIS  10           HA       HIS  10 -24.485  16.230  -1.970
   67    HB2  HIS  10           2HB      HIS  10 -22.770  18.553  -1.263
   68    HB3  HIS  10           1HB      HIS  10 -24.484  18.677  -0.881
   69    HD1  HIS  10           1HD      HIS  10 -25.233  16.067   0.249
   70    HD2  HIS  10           2HD      HIS  10 -21.502  17.749   0.973
   71    HE1  HIS  10           1HE      HIS  10 -24.402  14.977   2.356
   72    HE2  HIS  10           2HE      HIS  10 -22.182  16.072   2.822
   73    H    SER  11           H        SER  11 -23.495  19.160  -3.736
   74    HA   SER  11           HA       SER  11 -26.167  19.215  -4.960
   75    HB2  SER  11           2HB      SER  11 -25.824  21.807  -4.904
   76    HB3  SER  11           1HB      SER  11 -26.409  20.982  -3.460
   77    HG   SER  11           HG       SER  11 -24.391  21.119  -2.568
   78    H    SER  12           H        SER  12 -22.960  20.769  -5.150
   79    HA   SER  12           HA       SER  12 -22.841  20.088  -7.986
   80    HB2  SER  12           2HB      SER  12 -23.809  22.451  -7.626
   81    HB3  SER  12           1HB      SER  12 -22.180  22.895  -7.118
   82    HG   SER  12           HG       SER  12 -23.099  22.740  -9.572
   83    H    GLY  13           H        GLY  13 -21.152  18.690  -7.635
   84    HA2  GLY  13           2HA      GLY  13 -18.553  19.872  -7.398
   85    HA3  GLY  13           1HA      GLY  13 -18.987  18.945  -5.970
   86    H    LEU  14           H        LEU  14 -17.933  17.077  -6.033
   87    HA   LEU  14           HA       LEU  14 -17.110  15.826  -8.455
   88    HB2  LEU  14           2HB      LEU  14 -15.823  15.586  -6.406
   89    HB3  LEU  14           1HB      LEU  14 -17.175  14.796  -5.619
   90    HG   LEU  14           HG       LEU  14 -16.888  13.095  -7.643
   91   HD11  LEU  14          1HD1      LEU  14 -14.102  14.172  -7.235
   92   HD12  LEU  14          2HD1      LEU  14 -15.079  14.384  -8.689
   93   HD13  LEU  14          3HD1      LEU  14 -14.552  12.771  -8.208
   94   HD21  LEU  14          3HD2      LEU  14 -14.841  12.726  -5.547
   95   HD22  LEU  14          1HD2      LEU  14 -16.132  11.648  -6.080
   96   HD23  LEU  14          2HD2      LEU  14 -16.494  12.989  -4.992
   97    H    VAL  15           H        VAL  15 -18.949  15.427  -9.689
   98    HA   VAL  15           HA       VAL  15 -21.150  13.905  -8.639
   99    HB   VAL  15           HB       VAL  15 -20.590  14.431 -11.554
  100   HG11  VAL  15          1HG1      VAL  15 -22.481  12.870 -10.474
  101   HG12  VAL  15          2HG1      VAL  15 -22.721  13.792 -11.959
  102   HG13  VAL  15          3HG1      VAL  15 -23.318  14.421 -10.423
  103   HG21  VAL  15          3HG2      VAL  15 -22.203  16.405 -11.120
  104   HG22  VAL  15          1HG2      VAL  15 -20.500  16.592 -10.701
  105   HG23  VAL  15          2HG2      VAL  15 -21.686  16.251  -9.441
  106    HA   PRO  16           HA       PRO  16 -19.026  10.626 -11.743
  107    HB2  PRO  16           2HB      PRO  16 -16.268  11.324 -10.837
  108    HB3  PRO  16           1HB      PRO  16 -16.819  10.726 -12.407
  109    HG2  PRO  16           2HG      PRO  16 -16.190  13.289 -12.083
  110    HG3  PRO  16           1HG      PRO  16 -17.572  12.811 -13.086
  111    HD2  PRO  16           2HD      PRO  16 -17.532  13.987 -10.347
  112    HD3  PRO  16           1HD      PRO  16 -18.702  14.218 -11.659
  113    H    ARG  17           H        ARG  17 -17.631   8.672 -11.023
  114    HA   ARG  17           HA       ARG  17 -18.048   8.301  -8.133
  115    HB2  ARG  17           2HB      ARG  17 -19.348   6.873  -9.804
  116    HB3  ARG  17           1HB      ARG  17 -17.814   6.099 -10.178
  117    HG2  ARG  17           2HG      ARG  17 -17.714   5.761  -7.577
  118    HG3  ARG  17           1HG      ARG  17 -19.464   5.948  -7.708
  119    HD2  ARG  17           2HD      ARG  17 -18.451   4.174  -9.749
  120    HD3  ARG  17           1HD      ARG  17 -17.976   3.628  -8.141
  121    HE   ARG  17           HE       ARG  17 -20.166   3.119  -7.700
  122   HH11  ARG  17          1HH1      ARG  17 -20.018   5.119 -10.556
  123   HH12  ARG  17          2HH1      ARG  17 -21.692   4.905 -10.944
  124   HH21  ARG  17          1HH2      ARG  17 -22.367   2.836  -8.210
  125   HH22  ARG  17          2HH2      ARG  17 -23.025   3.610  -9.613
  126    H    GLY  18           H        GLY  18 -16.400   7.644  -6.850
  127    HA2  GLY  18           2HA      GLY  18 -14.193   6.182  -7.320
  128    HA3  GLY  18           1HA      GLY  18 -13.732   7.744  -7.982
  129    H    SER  19           H        SER  19 -15.478   6.685  -5.057
  130    HA   SER  19           HA       SER  19 -13.390   7.741  -3.362
  131    HB2  SER  19           2HB      SER  19 -16.053   9.095  -3.664
  132    HB3  SER  19           1HB      SER  19 -15.210   9.140  -2.116
  133    HG   SER  19           HG       SER  19 -14.740  10.919  -3.573
  134    H    HIS  20           H        HIS  20 -14.532   5.155  -3.791
  135    HA   HIS  20           HA       HIS  20 -16.013   4.684  -1.298
  136    HB2  HIS  20           2HB      HIS  20 -16.909   3.856  -3.541
  137    HB3  HIS  20           1HB      HIS  20 -15.587   2.693  -3.524
  138    HD1  HIS  20           1HD      HIS  20 -18.604   3.660  -1.437
  139    HD2  HIS  20           2HD      HIS  20 -16.116   0.407  -2.142
  140    HE1  HIS  20           1HE      HIS  20 -19.636   1.741  -0.182
  141    HE2  HIS  20           2HE      HIS  20 -18.067  -0.194  -0.551
  142    H    MET  21           H        MET  21 -13.609   2.885  -3.226
  143    HA   MET  21           HA       MET  21 -12.401   1.964  -0.716
  144    HB2  MET  21           2HB      MET  21 -13.190   0.322  -2.500
  145    HB3  MET  21           1HB      MET  21 -11.841   0.886  -3.476
  146    HG2  MET  21           2HG      MET  21 -10.260   0.106  -1.868
  147    HG3  MET  21           1HG      MET  21 -11.540  -0.270  -0.717
  148    HE1  MET  21           3HE      MET  21 -10.408  -0.772  -4.288
  149    HE2  MET  21           1HE      MET  21 -12.048  -1.309  -4.654
  150    HE3  MET  21           2HE      MET  21 -10.720  -2.469  -4.652
  151    H    SER  22           H        SER  22 -11.945   4.624  -1.801
  152    HA   SER  22           HA       SER  22  -9.150   4.462  -2.639
  153    HB2  SER  22           2HB      SER  22 -10.950   5.878  -3.879
  154    HB3  SER  22           1HB      SER  22 -10.706   7.024  -2.559
  155    HG   SER  22           HG       SER  22  -9.187   7.663  -3.916
  156    H    ASP  23           H        ASP  23 -10.660   4.487   0.134
  157    HA   ASP  23           HA       ASP  23  -9.063   6.517   1.457
  158    HB2  ASP  23           2HB      ASP  23 -11.176   4.688   2.563
  159    HB3  ASP  23           1HB      ASP  23 -10.395   5.992   3.456
  160    H    GLU  24           H        GLU  24  -8.976   3.304   0.769
  161    HA   GLU  24           HA       GLU  24  -7.639   2.268   3.011
  162    HB2  GLU  24           2HB      GLU  24  -7.605   1.324   0.156
  163    HB3  GLU  24           1HB      GLU  24  -6.967   0.403   1.511
  164    HG2  GLU  24           2HG      GLU  24  -9.273   0.497   2.513
  165    HG3  GLU  24           1HG      GLU  24  -9.826   1.148   0.970
  166    H    LYS  25           H        LYS  25  -6.671   4.299   0.603
  167    HA   LYS  25           HA       LYS  25  -3.829   3.718   0.842
  168    HB2  LYS  25           2HB      LYS  25  -4.720   4.205  -1.387
  169    HB3  LYS  25           1HB      LYS  25  -5.286   5.773  -0.831
  170    HG2  LYS  25           2HG      LYS  25  -2.480   5.466  -0.283
  171    HG3  LYS  25           1HG      LYS  25  -2.821   5.162  -1.987
  172    HD2  LYS  25           2HD      LYS  25  -4.112   7.312  -2.016
  173    HD3  LYS  25           1HD      LYS  25  -3.506   7.624  -0.388
  174    HE2  LYS  25           2HE      LYS  25  -1.339   7.931  -1.108
  175    HE3  LYS  25           1HE      LYS  25  -1.574   6.965  -2.563
  176    HZ1  LYS  25           3HZ      LYS  25  -3.115   9.434  -2.329
  177    HZ2  LYS  25           1HZ      LYS  25  -2.433   8.710  -3.698
  178    HZ3  LYS  25           2HZ      LYS  25  -1.457   9.586  -2.628
  179    H    THR  26           H        THR  26  -6.210   5.970   1.972
  180    HA   THR  26           HA       THR  26  -4.454   8.042   2.749
  181    HB   THR  26           HB       THR  26  -6.651   8.149   4.477
  182    HG1  THR  26           1HG      THR  26  -7.823   6.644   3.437
  183   HG21  THR  26          3HG2      THR  26  -7.319   9.555   2.136
  184   HG22  THR  26          1HG2      THR  26  -5.564   9.656   2.315
  185   HG23  THR  26          2HG2      THR  26  -6.621  10.184   3.629
  186    H    GLN  27           H        GLN  27  -5.405   5.042   4.226
  187    HA   GLN  27           HA       GLN  27  -4.666   5.587   6.880
  188    HB2  GLN  27           2HB      GLN  27  -5.724   3.437   5.637
  189    HB3  GLN  27           1HB      GLN  27  -4.064   2.887   5.809
  190    HG2  GLN  27           2HG      GLN  27  -4.210   2.695   8.054
  191    HG3  GLN  27           1HG      GLN  27  -5.319   4.057   8.210
  192   HE21  GLN  27          1HE2      GLN  27  -5.589   1.154   6.219
  193   HE22  GLN  27          2HE2      GLN  27  -7.041   0.570   6.950
  194    H    LEU  28           H        LEU  28  -2.834   5.087   4.012
  195    HA   LEU  28           HA       LEU  28  -0.348   4.592   5.394
  196    HB2  LEU  28           2HB      LEU  28  -0.978   3.506   3.221
  197    HB3  LEU  28           1HB      LEU  28  -0.817   5.085   2.475
  198    HG   LEU  28           HG       LEU  28   1.552   4.244   3.993
  199   HD11  LEU  28          1HD1      LEU  28   0.360   2.472   1.970
  200   HD12  LEU  28          2HD1      LEU  28   1.513   2.119   3.257
  201   HD13  LEU  28          3HD1      LEU  28   2.071   2.841   1.746
  202   HD21  LEU  28          3HD2      LEU  28   1.866   6.139   2.711
  203   HD22  LEU  28          1HD2      LEU  28   0.914   5.514   1.364
  204   HD23  LEU  28          2HD2      LEU  28   2.530   4.880   1.671
  205    H    ILE  29           H        ILE  29  -2.137   7.181   4.509
  206    HA   ILE  29           HA       ILE  29  -0.211   9.068   3.763
  207    HB   ILE  29           HB       ILE  29  -2.890   9.455   5.025
  208   HG12  ILE  29          2HG1      ILE  29  -2.690   8.341   2.747
  209   HG13  ILE  29          1HG1      ILE  29  -3.765   9.730   2.865
  210   HG21  ILE  29          1HG2      ILE  29  -0.949  11.464   3.931
  211   HG22  ILE  29          2HG2      ILE  29  -1.825  11.486   5.461
  212   HG23  ILE  29          3HG2      ILE  29  -2.683  11.787   3.950
  213   HD11  ILE  29          3HD1      ILE  29  -1.684   9.307   1.060
  214   HD12  ILE  29          1HD1      ILE  29  -1.149  10.599   2.134
  215   HD13  ILE  29          2HD1      ILE  29  -2.677  10.750   1.260
  216    H    GLU  30           H        GLU  30  -0.850   7.672   6.600
  217    HA   GLU  30           HA       GLU  30  -0.005   9.756   8.351
  218    HB2  GLU  30           2HB      GLU  30  -1.593   8.037   9.122
  219    HB3  GLU  30           1HB      GLU  30  -0.338   6.819   8.937
  220    HG2  GLU  30           2HG      GLU  30   0.927   7.709  10.716
  221    HG3  GLU  30           1HG      GLU  30  -0.035   9.186  10.756
  222    H    ALA  31           H        ALA  31   1.640   8.128   6.222
  223    HA   ALA  31           HA       ALA  31   4.023   7.608   7.821
  224    HB1  ALA  31           1HB      ALA  31   4.810   6.315   6.097
  225    HB2  ALA  31           2HB      ALA  31   3.977   7.259   4.862
  226    HB3  ALA  31           3HB      ALA  31   3.070   6.133   5.872
  227    H    PHE  32           H        PHE  32   2.776   9.862   5.464
  228    HA   PHE  32           HA       PHE  32   5.146  11.079   4.635
  229    HB2  PHE  32           2HB      PHE  32   2.327  12.101   4.909
  230    HB3  PHE  32           1HB      PHE  32   3.626  13.129   4.310
  231    HD1  PHE  32           2HD      PHE  32   5.019  12.133   2.337
  232    HD2  PHE  32           1HD      PHE  32   1.111  10.841   3.417
  233    HE1  PHE  32           2HE      PHE  32   4.703  11.218   0.075
  234    HE2  PHE  32           1HE      PHE  32   0.788   9.921   1.158
  235    HZ   PHE  32           HZ       PHE  32   2.584  10.110  -0.517
  236    H    TYR  33           H        TYR  33   3.428  11.301   7.637
  237    HA   TYR  33           HA       TYR  33   4.970  13.640   8.472
  238    HB2  TYR  33           2HB      TYR  33   2.900  12.165  10.096
  239    HB3  TYR  33           1HB      TYR  33   3.490  13.806  10.330
  240    HD1  TYR  33           2HD      TYR  33   1.400  11.651   8.181
  241    HD2  TYR  33           1HD      TYR  33   2.544  15.637   9.133
  242    HE1  TYR  33           2HE      TYR  33  -0.455  12.503   6.813
  243    HE2  TYR  33           1HE      TYR  33   0.690  16.501   7.768
  244    HH   TYR  33           HH       TYR  33  -1.837  14.555   6.655
  245    H    ASN  34           H        ASN  34   6.439  11.279   8.020
  246    HA   ASN  34           HA       ASN  34   7.964  11.123  10.360
  247    HB2  ASN  34           2HB      ASN  34   7.486   8.679  10.900
  248    HB3  ASN  34           1HB      ASN  34   6.264   9.843  11.404
  249   HD21  ASN  34          1HD2      ASN  34   6.609   6.895  10.178
  250   HD22  ASN  34          2HD2      ASN  34   5.175   6.771   9.224
  251    H    PHE  35           H        PHE  35   8.380  11.459   7.589
  252    HA   PHE  35           HA       PHE  35  10.391   9.417   7.169
  253    HB2  PHE  35           2HB      PHE  35   8.031   8.833   6.061
  254    HB3  PHE  35           1HB      PHE  35   8.650   9.897   4.802
  255    HD1  PHE  35           2HD      PHE  35  10.892   9.349   3.766
  256    HD2  PHE  35           1HD      PHE  35   8.740   6.616   6.216
  257    HE1  PHE  35           2HE      PHE  35  12.207   7.487   2.839
  258    HE2  PHE  35           1HE      PHE  35  10.050   4.749   5.294
  259    HZ   PHE  35           HZ       PHE  35  11.787   5.184   3.602
  260    H    ASP  36           H        ASP  36  11.061  11.861   7.793
  261    HA   ASP  36           HA       ASP  36  12.277  13.678   7.167
  262    HB2  ASP  36           2HB      ASP  36  13.205  11.663   5.634
  263    HB3  ASP  36           1HB      ASP  36  12.630  12.751   4.374
  264    H    GLY  37           H        GLY  37   9.384  13.634   6.738
  265    HA2  GLY  37           2HA      GLY  37   7.762  14.982   5.836
  266    HA3  GLY  37           1HA      GLY  37   9.063  16.106   5.469
  267    H    ASP  38           H        ASP  38   8.267  12.856   4.250
  268    HA   ASP  38           HA       ASP  38   7.981  12.056   2.140
  269    HB2  ASP  38           2HB      ASP  38   6.117  13.800   2.254
  270    HB3  ASP  38           1HB      ASP  38   7.185  14.849   1.328
  271    H    TYR  39           H        TYR  39  10.569  12.962   2.877
  272    HA   TYR  39           HA       TYR  39  11.604  13.880   0.274
  273    HB2  TYR  39           2HB      TYR  39  11.907  15.362   2.388
  274    HB3  TYR  39           1HB      TYR  39  13.131  14.181   2.843
  275    HD1  TYR  39           1HD      TYR  39  12.183  16.642   0.246
  276    HD2  TYR  39           2HD      TYR  39  15.279  14.206   1.852
  277    HE1  TYR  39           1HE      TYR  39  13.824  17.811  -1.163
  278    HE2  TYR  39           2HE      TYR  39  16.930  15.369   0.448
  279    HH   TYR  39           HH       TYR  39  16.810  18.017  -0.724
  280    H    ASP  40           H        ASP  40  11.856  11.820  -0.590
  281    HA   ASP  40           HA       ASP  40  14.297  10.530  -0.074
  282    HB2  ASP  40           2HB      ASP  40  12.550   9.810   1.849
  283    HB3  ASP  40           1HB      ASP  40  12.146   8.610   0.624
  284    H    GLY  41           H        GLY  41  14.885   9.627  -1.934
  285    HA2  GLY  41           2HA      GLY  41  12.766   8.959  -3.869
  286    HA3  GLY  41           1HA      GLY  41  14.411   9.409  -4.287
  287    H    PHE  42           H        PHE  42  15.280   7.569  -1.977
  288    HA   PHE  42           HA       PHE  42  14.635   4.949  -3.046
  289    HB2  PHE  42           2HB      PHE  42  17.346   6.217  -3.289
  290    HB3  PHE  42           1HB      PHE  42  17.192   4.471  -3.132
  291    HD1  PHE  42           1HD      PHE  42  15.157   3.569  -4.751
  292    HD2  PHE  42           2HD      PHE  42  17.665   6.938  -5.431
  293    HE1  PHE  42           1HE      PHE  42  14.738   3.388  -7.169
  294    HE2  PHE  42           2HE      PHE  42  17.253   6.764  -7.850
  295    HZ   PHE  42           HZ       PHE  42  15.786   4.987  -8.722
  296    H    VAL  43           H        VAL  43  14.377   3.603  -1.400
  297    HA   VAL  43           HA       VAL  43  15.980   4.010   1.033
  298    HB   VAL  43           HB       VAL  43  13.729   4.882   1.448
  299   HG11  VAL  43          1HG1      VAL  43  12.630   3.368  -0.246
  300   HG12  VAL  43          2HG1      VAL  43  11.764   3.574   1.276
  301   HG13  VAL  43          3HG1      VAL  43  12.684   2.101   0.979
  302   HG21  VAL  43          3HG2      VAL  43  15.122   3.476   3.141
  303   HG22  VAL  43          1HG2      VAL  43  13.835   2.289   2.932
  304   HG23  VAL  43          2HG2      VAL  43  13.456   3.906   3.524
  305    H    SER  44           H        SER  44  16.513   2.147   2.193
  306    HA   SER  44           HA       SER  44  16.405  -0.300   0.612
  307    HB2  SER  44           2HB      SER  44  18.046  -1.129   2.351
  308    HB3  SER  44           1HB      SER  44  18.596   0.245   1.392
  309    HG   SER  44           HG       SER  44  18.909   1.164   3.251
  310    H    VAL  45           H        VAL  45  15.955  -2.363   1.675
  311    HA   VAL  45           HA       VAL  45  13.472  -2.371   2.982
  312    HB   VAL  45           HB       VAL  45  15.502  -4.608   2.914
  313   HG11  VAL  45          1HG1      VAL  45  14.022  -5.763   4.084
  314   HG12  VAL  45          2HG1      VAL  45  12.859  -5.567   2.777
  315   HG13  VAL  45          3HG1      VAL  45  12.910  -4.396   4.095
  316   HG21  VAL  45          3HG2      VAL  45  14.788  -5.224   0.826
  317   HG22  VAL  45          1HG2      VAL  45  14.669  -3.470   0.699
  318   HG23  VAL  45          2HG2      VAL  45  13.223  -4.430   1.006
  319    H    GLU  46           H        GLU  46  16.756  -2.457   4.178
  320    HA   GLU  46           HA       GLU  46  16.178  -3.251   6.830
  321    HB2  GLU  46           2HB      GLU  46  18.491  -1.481   6.080
  322    HB3  GLU  46           1HB      GLU  46  18.415  -2.717   7.328
  323    HG2  GLU  46           2HG      GLU  46  18.142  -4.389   5.429
  324    HG3  GLU  46           1HG      GLU  46  18.634  -3.077   4.359
  325    H    GLU  47           H        GLU  47  16.957  -0.021   5.522
  326    HA   GLU  47           HA       GLU  47  16.400   1.407   7.862
  327    HB2  GLU  47           2HB      GLU  47  17.539   2.154   5.640
  328    HB3  GLU  47           1HB      GLU  47  15.906   2.576   5.142
  329    HG2  GLU  47           2HG      GLU  47  15.834   4.385   6.456
  330    HG3  GLU  47           1HG      GLU  47  16.667   3.581   7.785
  331    H    PHE  48           H        PHE  48  14.311   0.202   5.342
  332    HA   PHE  48           HA       PHE  48  12.027   1.756   5.892
  333    HB2  PHE  48           2HB      PHE  48  12.725  -0.293   4.108
  334    HB3  PHE  48           1HB      PHE  48  11.355  -0.921   5.016
  335    HD1  PHE  48           2HD      PHE  48   9.714   1.419   5.474
  336    HD2  PHE  48           1HD      PHE  48  11.955   0.311   2.030
  337    HE1  PHE  48           2HE      PHE  48   8.182   2.729   4.062
  338    HE2  PHE  48           1HE      PHE  48  10.427   1.619   0.611
  339    HZ   PHE  48           HZ       PHE  48   8.538   2.829   1.627
  340    H    ARG  49           H        ARG  49  13.162  -1.331   7.189
  341    HA   ARG  49           HA       ARG  49  10.897  -2.026   8.668
  342    HB2  ARG  49           2HB      ARG  49  13.712  -2.576   9.584
  343    HB3  ARG  49           1HB      ARG  49  12.276  -3.557   9.836
  344    HG2  ARG  49           2HG      ARG  49  12.426  -3.471   7.114
  345    HG3  ARG  49           1HG      ARG  49  14.128  -3.474   7.579
  346    HD2  ARG  49           2HD      ARG  49  12.056  -5.453   8.526
  347    HD3  ARG  49           1HD      ARG  49  13.229  -5.745   7.242
  348    HE   ARG  49           HE       ARG  49  14.776  -5.043   9.349
  349   HH11  ARG  49          1HH1      ARG  49  12.251  -7.413   8.922
  350   HH12  ARG  49          2HH1      ARG  49  12.910  -8.510  10.090
  351   HH21  ARG  49          1HH2      ARG  49  15.645  -6.482  10.883
  352   HH22  ARG  49          2HH2      ARG  49  14.837  -7.981  11.204
  353    H    GLY  50           H        GLY  50  13.800  -0.238   9.715
  354    HA2  GLY  50           2HA      GLY  50  13.042   0.240  12.348
  355    HA3  GLY  50           1HA      GLY  50  14.103   1.279  11.411
  356    H    ILE  51           H        ILE  51  11.894   1.719   9.424
  357    HA   ILE  51           HA       ILE  51  10.716   3.984  10.780
  358    HB   ILE  51           HB       ILE  51  10.257   3.053   7.943
  359   HG12  ILE  51          2HG1      ILE  51  12.083   5.312   8.664
  360   HG13  ILE  51          1HG1      ILE  51  12.682   3.660   8.792
  361   HG21  ILE  51          1HG2      ILE  51   8.590   4.575   8.252
  362   HG22  ILE  51          2HG2      ILE  51   9.897   5.675   7.819
  363   HG23  ILE  51          3HG2      ILE  51   9.464   5.444   9.512
  364   HD11  ILE  51          3HD1      ILE  51  12.204   5.302   6.442
  365   HD12  ILE  51          1HD1      ILE  51  11.530   3.677   6.313
  366   HD13  ILE  51          2HD1      ILE  51  13.247   3.896   6.654
  367    H    ILE  52           H        ILE  52   9.564   1.024   9.189
  368    HA   ILE  52           HA       ILE  52   6.815   1.495   9.699
  369    HB   ILE  52           HB       ILE  52   8.212  -1.132   9.180
  370   HG12  ILE  52          2HG1      ILE  52   8.543   0.605   7.417
  371   HG13  ILE  52          1HG1      ILE  52   7.652  -0.804   6.854
  372   HG21  ILE  52          1HG2      ILE  52   6.104  -1.674  10.037
  373   HG22  ILE  52          2HG2      ILE  52   5.889  -1.724   8.288
  374   HG23  ILE  52          3HG2      ILE  52   5.319  -0.331   9.207
  375   HD11  ILE  52          3HD1      ILE  52   6.149   0.615   6.061
  376   HD12  ILE  52          1HD1      ILE  52   6.870   1.971   6.928
  377   HD13  ILE  52          2HD1      ILE  52   5.688   0.938   7.733
  378    H    ARG  53           H        ARG  53   9.395   0.071  11.560
  379    HA   ARG  53           HA       ARG  53   8.057  -1.506  13.372
  380    HB2  ARG  53           2HB      ARG  53  10.591  -0.869  13.149
  381    HB3  ARG  53           1HB      ARG  53  10.191   0.352  14.351
  382    HG2  ARG  53           2HG      ARG  53   9.243  -2.348  14.988
  383    HG3  ARG  53           1HG      ARG  53  10.998  -2.168  14.920
  384    HD2  ARG  53           2HD      ARG  53  10.543  -1.660  17.127
  385    HD3  ARG  53           1HD      ARG  53  10.582  -0.065  16.378
  386    HE   ARG  53           HE       ARG  53   7.949  -1.034  16.326
  387   HH11  ARG  53          1HH1      ARG  53  10.336   0.100  18.606
  388   HH12  ARG  53          2HH1      ARG  53   9.161   0.685  19.735
  389   HH21  ARG  53          1HH2      ARG  53   6.403  -0.263  17.810
  390   HH22  ARG  53          2HH2      ARG  53   6.928   0.481  19.284
  391    H    ASP  54           H        ASP  54   8.820   1.947  13.857
  392    HA   ASP  54           HA       ASP  54   6.546   2.089  15.721
  393    HB2  ASP  54           2HB      ASP  54   9.001   2.613  16.459
  394    HB3  ASP  54           1HB      ASP  54   8.721   4.150  15.646
  395    H    GLY  55           H        GLY  55   6.858   2.540  12.648
  396    HA2  GLY  55           2HA      GLY  55   5.898   5.307  12.513
  397    HA3  GLY  55           1HA      GLY  55   6.408   4.326  11.148
  398    H    LEU  56           H        LEU  56   4.972   2.732  10.320
  399    HA   LEU  56           HA       LEU  56   2.159   3.350  10.911
  400    HB2  LEU  56           2HB      LEU  56   3.227   1.950   8.466
  401    HB3  LEU  56           1HB      LEU  56   1.630   2.642   8.694
  402    HG   LEU  56           HG       LEU  56   4.045   4.410   8.795
  403   HD11  LEU  56          1HD1      LEU  56   4.391   4.426   6.576
  404   HD12  LEU  56          2HD1      LEU  56   2.682   4.199   6.202
  405   HD13  LEU  56          3HD1      LEU  56   3.682   2.812   6.640
  406   HD21  LEU  56          3HD2      LEU  56   2.233   5.906   7.672
  407   HD22  LEU  56          1HD2      LEU  56   2.170   5.607   9.409
  408   HD23  LEU  56          2HD2      LEU  56   1.111   4.710   8.320
  409    HA   PRO  57           HA       PRO  57   1.644  -0.756  12.491
  410    HB2  PRO  57           2HB      PRO  57  -1.036  -0.961  12.404
  411    HB3  PRO  57           1HB      PRO  57  -0.221   0.128  13.534
  412    HG2  PRO  57           2HG      PRO  57  -1.534   0.750  10.916
  413    HG3  PRO  57           1HG      PRO  57  -1.611   1.643  12.446
  414    HD2  PRO  57           2HD      PRO  57   0.020   2.341  10.363
  415    HD3  PRO  57           1HD      PRO  57   0.379   2.715  12.060
  416    H    MET  58           H        MET  58   2.262  -2.446  11.326
  417    HA   MET  58           HA       MET  58   0.479  -3.527   9.321
  418    HB2  MET  58           2HB      MET  58   2.708  -1.952   8.539
  419    HB3  MET  58           1HB      MET  58   3.098  -3.623   8.162
  420    HG2  MET  58           2HG      MET  58   1.212  -3.845   6.757
  421    HG3  MET  58           1HG      MET  58   0.520  -2.328   7.331
  422    HE1  MET  58           3HE      MET  58   3.480  -3.968   5.358
  423    HE2  MET  58           1HE      MET  58   3.433  -2.942   3.925
  424    HE3  MET  58           2HE      MET  58   2.016  -3.889   4.377
  425    H    THR  59           H        THR  59   0.603  -5.710   9.196
  426    HA   THR  59           HA       THR  59   2.139  -7.079  11.196
  427    HB   THR  59           HB       THR  59   1.089  -9.066   9.631
  428    HG1  THR  59           1HG      THR  59  -0.981  -8.309   9.023
  429   HG21  THR  59          3HG2      THR  59   0.158  -9.475  11.588
  430   HG22  THR  59          1HG2      THR  59  -1.057  -8.249  11.228
  431   HG23  THR  59          2HG2      THR  59   0.408  -7.807  12.105
  432    H    GLU  60           H        GLU  60   3.779  -8.598  10.885
  433    HA   GLU  60           HA       GLU  60   5.867  -8.093   9.256
  434    HB2  GLU  60           2HB      GLU  60   6.348 -10.618   9.364
  435    HB3  GLU  60           1HB      GLU  60   6.225  -9.744  10.883
  436    HG2  GLU  60           2HG      GLU  60   3.776 -10.504  10.888
  437    HG3  GLU  60           1HG      GLU  60   4.274 -11.647   9.641
  438    H    ALA  61           H        ALA  61   3.297 -10.386   8.491
  439    HA   ALA  61           HA       ALA  61   4.060 -11.276   6.030
  440    HB1  ALA  61           1HB      ALA  61   1.252 -10.563   6.854
  441    HB2  ALA  61           2HB      ALA  61   2.084 -12.071   7.234
  442    HB3  ALA  61           3HB      ALA  61   1.709 -11.668   5.558
  443    H    GLU  62           H        GLU  62   2.070  -8.375   6.643
  444    HA   GLU  62           HA       GLU  62   1.852  -7.524   3.998
  445    HB2  GLU  62           2HB      GLU  62   2.216  -5.372   5.998
  446    HB3  GLU  62           1HB      GLU  62   0.947  -5.595   4.806
  447    HG2  GLU  62           2HG      GLU  62   1.192  -6.883   7.502
  448    HG3  GLU  62           1HG      GLU  62  -0.035  -5.745   6.953
  449    H    ILE  63           H        ILE  63   4.120  -6.283   6.440
  450    HA   ILE  63           HA       ILE  63   5.733  -4.819   4.670
  451    HB   ILE  63           HB       ILE  63   6.854  -6.134   7.131
  452   HG12  ILE  63          2HG1      ILE  63   5.931  -3.677   7.977
  453   HG13  ILE  63          1HG1      ILE  63   4.614  -4.257   6.961
  454   HG21  ILE  63          1HG2      ILE  63   8.092  -4.582   5.391
  455   HG22  ILE  63          2HG2      ILE  63   8.409  -4.460   7.123
  456   HG23  ILE  63          3HG2      ILE  63   7.329  -3.307   6.340
  457   HD11  ILE  63          3HD1      ILE  63   5.504  -5.166   9.580
  458   HD12  ILE  63          1HD1      ILE  63   5.218  -6.468   8.425
  459   HD13  ILE  63          2HD1      ILE  63   3.937  -5.316   8.789
  460    H    THR  64           H        THR  64   6.515  -7.937   6.191
  461    HA   THR  64           HA       THR  64   8.808  -8.541   4.789
  462    HB   THR  64           HB       THR  64   6.658 -10.386   5.808
  463    HG1  THR  64           1HG      THR  64   7.597  -9.197   7.446
  464   HG21  THR  64          3HG2      THR  64   9.471 -11.040   4.990
  465   HG22  THR  64          1HG2      THR  64   7.977 -11.669   4.295
  466   HG23  THR  64          2HG2      THR  64   8.431 -12.099   5.944
  467    H    GLU  65           H        GLU  65   5.475  -9.516   3.958
  468    HA   GLU  65           HA       GLU  65   6.214 -10.768   1.542
  469    HB2  GLU  65           2HB      GLU  65   4.036 -11.093   2.801
  470    HB3  GLU  65           1HB      GLU  65   3.523  -9.561   2.103
  471    HG2  GLU  65           2HG      GLU  65   2.692 -10.795   0.450
  472    HG3  GLU  65           1HG      GLU  65   4.362 -10.941  -0.098
  473    H    PHE  66           H        PHE  66   6.006  -7.616   2.434
  474    HA   PHE  66           HA       PHE  66   5.663  -6.626  -0.273
  475    HB2  PHE  66           2HB      PHE  66   5.546  -5.351   2.428
  476    HB3  PHE  66           1HB      PHE  66   5.921  -4.349   1.032
  477    HD1  PHE  66           1HD      PHE  66   3.670  -7.244   0.829
  478    HD2  PHE  66           2HD      PHE  66   3.946  -3.014   1.194
  479    HE1  PHE  66           1HE      PHE  66   1.272  -7.048   0.319
  480    HE2  PHE  66           2HE      PHE  66   1.548  -2.810   0.687
  481    HZ   PHE  66           HZ       PHE  66   0.207  -4.829   0.249
  482    H    PHE  67           H        PHE  67   8.066  -7.147   2.160
  483    HA   PHE  67           HA       PHE  67  10.048  -5.399   1.044
  484    HB2  PHE  67           2HB      PHE  67   9.972  -7.476   3.185
  485    HB3  PHE  67           1HB      PHE  67  11.540  -7.020   2.532
  486    HD1  PHE  67           1HD      PHE  67  10.659  -4.043   2.042
  487    HD2  PHE  67           2HD      PHE  67  10.458  -6.684   5.380
  488    HE1  PHE  67           1HE      PHE  67  10.713  -2.118   3.572
  489    HE2  PHE  67           2HE      PHE  67  10.511  -4.758   6.910
  490    HZ   PHE  67           HZ       PHE  67  10.639  -2.474   6.005
  491    H    GLU  68           H        GLU  68   9.092  -8.718   0.581
  492    HA   GLU  68           HA       GLU  68  11.445  -9.281  -1.049
  493    HB2  GLU  68           2HB      GLU  68   9.119 -11.126  -0.520
  494    HB3  GLU  68           1HB      GLU  68  10.739 -11.557  -1.054
  495    HG2  GLU  68           2HG      GLU  68  10.260 -10.253   1.599
  496    HG3  GLU  68           1HG      GLU  68  10.112 -11.997   1.382
  497    H    ALA  69           H        ALA  69   8.057  -8.550  -1.365
  498    HA   ALA  69           HA       ALA  69   7.888  -9.335  -4.114
  499    HB1  ALA  69           1HB      ALA  69   5.938  -9.404  -2.615
  500    HB2  ALA  69           2HB      ALA  69   5.649  -8.425  -4.053
  501    HB3  ALA  69           3HB      ALA  69   6.001  -7.645  -2.510
  502    H    ALA  70           H        ALA  70   9.134  -6.760  -2.538
  503    HA   ALA  70           HA       ALA  70   8.658  -4.808  -4.646
  504    HB1  ALA  70           1HB      ALA  70  10.239  -3.444  -3.032
  505    HB2  ALA  70           2HB      ALA  70   9.742  -4.684  -1.881
  506    HB3  ALA  70           3HB      ALA  70   8.530  -3.675  -2.668
  507    H    ASP  71           H        ASP  71  11.227  -6.805  -3.350
  508    HA   ASP  71           HA       ASP  71  12.981  -5.869  -5.525
  509    HB2  ASP  71           2HB      ASP  71  13.603  -5.455  -2.999
  510    HB3  ASP  71           1HB      ASP  71  14.099  -7.145  -3.059
  511    HA   PRO  72           HA       PRO  72  12.403 -10.131  -6.850
  512    HB2  PRO  72           2HB      PRO  72  14.055  -9.970  -9.020
  513    HB3  PRO  72           1HB      PRO  72  12.385  -9.391  -9.019
  514    HG2  PRO  72           2HG      PRO  72  14.927  -7.850  -8.664
  515    HG3  PRO  72           1HG      PRO  72  13.489  -7.434  -9.615
  516    HD2  PRO  72           2HD      PRO  72  13.957  -6.358  -7.190
  517    HD3  PRO  72           1HD      PRO  72  12.313  -6.716  -7.758
  518    H    ASN  73           H        ASN  73  15.477  -8.518  -6.339
  519    HA   ASN  73           HA       ASN  73  16.972 -10.992  -6.287
  520    HB2  ASN  73           2HB      ASN  73  17.893  -8.243  -5.433
  521    HB3  ASN  73           1HB      ASN  73  18.904  -9.621  -5.859
  522   HD21  ASN  73          1HD2      ASN  73  18.093  -6.754  -6.932
  523   HD22  ASN  73          2HD2      ASN  73  18.069  -7.018  -8.640
  524    H    ASN  74           H        ASN  74  15.520  -8.773  -4.017
  525    HA   ASN  74           HA       ASN  74  15.034  -8.979  -1.804
  526    HB2  ASN  74           2HB      ASN  74  16.315 -11.711  -1.839
  527    HB3  ASN  74           1HB      ASN  74  15.111 -11.094  -0.711
  528   HD21  ASN  74          1HD2      ASN  74  15.557 -13.064  -3.279
  529   HD22  ASN  74          2HD2      ASN  74  13.953 -13.085  -3.921
  530    H    THR  75           H        THR  75  17.342  -7.723  -2.686
  531    HA   THR  75           HA       THR  75  19.478  -8.520  -0.890
  532    HB   THR  75           HB       THR  75  20.277  -7.893  -3.017
  533    HG1  THR  75           1HG      THR  75  21.534  -6.946  -1.427
  534   HG21  THR  75          3HG2      THR  75  18.417  -5.565  -2.819
  535   HG22  THR  75          1HG2      THR  75  18.571  -6.768  -4.101
  536   HG23  THR  75          2HG2      THR  75  19.816  -5.535  -3.893
  537    H    GLY  76           H        GLY  76  17.126  -7.716   0.407
  538    HA2  GLY  76           2HA      GLY  76  16.294  -6.247   1.966
  539    HA3  GLY  76           1HA      GLY  76  17.987  -6.064   2.407
  540    H    PHE  77           H        PHE  77  16.781  -5.138  -0.722
  541    HA   PHE  77           HA       PHE  77  16.861  -2.311   0.061
  542    HB2  PHE  77           2HB      PHE  77  18.885  -2.295  -0.991
  543    HB3  PHE  77           1HB      PHE  77  18.523  -3.727  -1.942
  544    HD1  PHE  77           1HD      PHE  77  17.702  -0.110  -1.684
  545    HD2  PHE  77           2HD      PHE  77  18.058  -3.528  -4.193
  546    HE1  PHE  77           1HE      PHE  77  17.322   1.307  -3.657
  547    HE2  PHE  77           2HE      PHE  77  17.677  -2.116  -6.174
  548    HZ   PHE  77           HZ       PHE  77  17.309   0.304  -5.908
  549    H    ILE  78           H        ILE  78  15.161  -1.174  -0.635
  550    HA   ILE  78           HA       ILE  78  13.318  -2.468  -2.522
  551    HB   ILE  78           HB       ILE  78  12.842  -0.205  -0.575
  552   HG12  ILE  78          2HG1      ILE  78  11.815  -3.043  -0.604
  553   HG13  ILE  78          1HG1      ILE  78  13.026  -2.397   0.507
  554   HG21  ILE  78          1HG2      ILE  78  10.848  -1.583  -2.368
  555   HG22  ILE  78          2HG2      ILE  78  11.497   0.038  -2.630
  556   HG23  ILE  78          3HG2      ILE  78  10.510  -0.299  -1.209
  557   HD11  ILE  78          3HD1      ILE  78  11.456  -1.597   1.852
  558   HD12  ILE  78          1HD1      ILE  78  10.283  -2.494   0.886
  559   HD13  ILE  78          2HD1      ILE  78  10.623  -0.800   0.514
  560    H    ASP  79           H        ASP  79  12.423  -1.351  -4.236
  561    HA   ASP  79           HA       ASP  79  13.995   0.934  -5.184
  562    HB2  ASP  79           2HB      ASP  79  13.158  -1.323  -6.515
  563    HB3  ASP  79           1HB      ASP  79  11.903  -0.167  -6.950
  564    H    TYR  80           H        TYR  80  13.134   2.625  -4.056
  565    HA   TYR  80           HA       TYR  80  10.819   3.218  -2.997
  566    HB2  TYR  80           2HB      TYR  80  12.655   4.849  -3.233
  567    HB3  TYR  80           1HB      TYR  80  12.180   5.134  -4.905
  568    HD1  TYR  80           2HD      TYR  80  10.075   6.309  -5.414
  569    HD2  TYR  80           1HD      TYR  80  11.435   5.824  -1.411
  570    HE1  TYR  80           2HE      TYR  80   8.516   8.063  -4.678
  571    HE2  TYR  80           1HE      TYR  80   9.879   7.577  -0.665
  572    HH   TYR  80           HH       TYR  80   7.370   8.519  -2.043
  573    H    LYS  81           H        LYS  81  11.268   3.305  -6.518
  574    HA   LYS  81           HA       LYS  81   8.686   4.253  -7.135
  575    HB2  LYS  81           2HB      LYS  81  10.758   2.725  -8.688
  576    HB3  LYS  81           1HB      LYS  81   9.178   3.059  -9.386
  577    HG2  LYS  81           2HG      LYS  81  10.983   5.202  -8.299
  578    HG3  LYS  81           1HG      LYS  81  10.996   4.678  -9.984
  579    HD2  LYS  81           2HD      LYS  81   8.491   5.608  -8.601
  580    HD3  LYS  81           1HD      LYS  81   9.584   6.721  -9.424
  581    HE2  LYS  81           2HE      LYS  81   8.523   4.292 -10.820
  582    HE3  LYS  81           1HE      LYS  81   7.561   5.765 -10.718
  583    HZ1  LYS  81           3HZ      LYS  81   8.869   5.645 -12.764
  584    HZ2  LYS  81           1HZ      LYS  81  10.298   5.599 -11.858
  585    HZ3  LYS  81           2HZ      LYS  81   9.315   6.974 -11.818
  586    H    ALA  82           H        ALA  82   9.986   0.927  -7.229
  587    HA   ALA  82           HA       ALA  82   7.644  -0.419  -7.838
  588    HB1  ALA  82           1HB      ALA  82   9.293  -1.795  -5.845
  589    HB2  ALA  82           2HB      ALA  82  10.201  -1.167  -7.222
  590    HB3  ALA  82           3HB      ALA  82   8.856  -2.276  -7.486
  591    H    PHE  83           H        PHE  83   8.710   0.984  -4.838
  592    HA   PHE  83           HA       PHE  83   6.600  -0.243  -3.282
  593    HB2  PHE  83           2HB      PHE  83   9.104   0.954  -2.723
  594    HB3  PHE  83           1HB      PHE  83   7.881   1.933  -1.916
  595    HD1  PHE  83           2HD      PHE  83   8.551  -1.687  -2.496
  596    HD2  PHE  83           1HD      PHE  83   7.463   1.360   0.265
  597    HE1  PHE  83           2HE      PHE  83   8.424  -3.362  -0.706
  598    HE2  PHE  83           1HE      PHE  83   7.335  -0.312   2.067
  599    HZ   PHE  83           HZ       PHE  83   7.814  -2.679   1.583
  600    H    ALA  84           H        ALA  84   7.299   2.807  -4.847
  601    HA   ALA  84           HA       ALA  84   5.097   4.209  -3.636
  602    HB1  ALA  84           1HB      ALA  84   5.718   6.054  -5.016
  603    HB2  ALA  84           2HB      ALA  84   6.676   5.015  -6.070
  604    HB3  ALA  84           3HB      ALA  84   7.199   5.312  -4.412
  605    H    ALA  85           H        ALA  85   5.561   2.200  -6.410
  606    HA   ALA  85           HA       ALA  85   3.336   3.137  -7.900
  607    HB1  ALA  85           1HB      ALA  85   5.235   1.956  -8.932
  608    HB2  ALA  85           2HB      ALA  85   3.683   1.216  -9.323
  609    HB3  ALA  85           3HB      ALA  85   4.726   0.487  -8.101
  610    H    MET  86           H        MET  86   3.575   1.363  -5.164
  611    HA   MET  86           HA       MET  86   1.318  -0.371  -5.498
  612    HB2  MET  86           2HB      MET  86   3.407  -0.442  -3.813
  613    HB3  MET  86           1HB      MET  86   2.239   0.360  -2.770
  614    HG2  MET  86           2HG      MET  86   2.161  -1.995  -2.366
  615    HG3  MET  86           1HG      MET  86   0.666  -1.501  -3.161
  616    HE1  MET  86           3HE      MET  86   4.142  -3.780  -5.104
  617    HE2  MET  86           1HE      MET  86   3.702  -4.084  -3.424
  618    HE3  MET  86           2HE      MET  86   4.263  -2.485  -3.914
  619    H    LEU  87           H        LEU  87   1.892   2.834  -4.241
  620    HA   LEU  87           HA       LEU  87  -0.836   3.048  -3.281
  621    HB2  LEU  87           2HB      LEU  87   1.531   4.862  -3.126
  622    HB3  LEU  87           1HB      LEU  87  -0.061   5.358  -2.585
  623    HG   LEU  87           HG       LEU  87   0.970   2.836  -1.428
  624   HD11  LEU  87          1HD1      LEU  87   2.541   3.776   0.003
  625   HD12  LEU  87          2HD1      LEU  87   2.008   5.423  -0.334
  626   HD13  LEU  87          3HD1      LEU  87   2.910   4.522  -1.552
  627   HD21  LEU  87          3HD2      LEU  87  -0.496   5.254  -0.389
  628   HD22  LEU  87          1HD2      LEU  87  -0.014   3.887   0.615
  629   HD23  LEU  87          2HD2      LEU  87  -1.155   3.648  -0.707
  630    H    TYR  88           H        TYR  88   0.758   3.438  -6.007
  631    HA   TYR  88           HA       TYR  88  -1.197   5.344  -7.093
  632    HB2  TYR  88           2HB      TYR  88   1.692   5.084  -7.948
  633    HB3  TYR  88           1HB      TYR  88   0.507   6.186  -8.639
  634    HD1  TYR  88           2HD      TYR  88  -0.818   7.206  -6.201
  635    HD2  TYR  88           1HD      TYR  88   3.298   6.482  -6.998
  636    HE1  TYR  88           2HE      TYR  88  -0.202   8.912  -4.539
  637    HE2  TYR  88           1HE      TYR  88   3.925   8.185  -5.338
  638    HH   TYR  88           HH       TYR  88   1.666  10.365  -3.997
  639    H    SER  89           H        SER  89  -1.011   2.332  -6.990
  640    HA   SER  89           HA       SER  89  -0.860   1.705  -9.845
  641    HB2  SER  89           2HB      SER  89  -1.400  -0.682  -8.717
  642    HB3  SER  89           1HB      SER  89   0.234  -0.037  -8.857
  643    HG   SER  89           HG       SER  89   0.128   0.645  -6.743
  644    H    VAL  90           H        VAL  90  -3.039   3.304  -8.782
  645    HA   VAL  90           HA       VAL  90  -5.323   1.475  -9.022
  646    HB   VAL  90           HB       VAL  90  -6.668   3.491  -8.308
  647   HG11  VAL  90          1HG1      VAL  90  -4.557   2.377  -6.470
  648   HG12  VAL  90          2HG1      VAL  90  -6.193   1.768  -6.721
  649   HG13  VAL  90          3HG1      VAL  90  -5.943   3.322  -5.926
  650   HG21  VAL  90          3HG2      VAL  90  -5.549   5.367  -7.323
  651   HG22  VAL  90          1HG2      VAL  90  -4.923   5.152  -8.958
  652   HG23  VAL  90          2HG2      VAL  90  -3.972   4.619  -7.571
  653    H    ASP  91           H        ASP  91  -3.637   2.382 -11.286
  654    HA   ASP  91           HA       ASP  91  -3.861   3.114 -13.429
  655    HB2  ASP  91           2HB      ASP  91  -6.590   2.221 -12.658
  656    HB3  ASP  91           1HB      ASP  91  -6.440   3.150 -14.145
  657    H    GLU  92           H        GLU  92  -3.874   5.088 -11.275
  658    HA   GLU  92           HA       GLU  92  -4.840   7.338 -12.836
  659    HB2  GLU  92           2HB      GLU  92  -5.808   6.766 -10.035
  660    HB3  GLU  92           1HB      GLU  92  -5.957   8.337 -10.812
  661    HG2  GLU  92           2HG      GLU  92  -7.131   5.793 -11.906
  662    HG3  GLU  92           1HG      GLU  92  -8.009   6.945 -10.901
  663    H    SER  93           H        SER  93  -3.434   6.390  -9.705
  664    HA   SER  93           HA       SER  93  -1.640   7.163  -8.544
  665    HB2  SER  93           2HB      SER  93  -0.301   6.604 -10.450
  666    HB3  SER  93           1HB      SER  93  -0.831   8.043 -11.321
  667    HG   SER  93           HG       SER  93   0.573   8.179  -8.868
  Start of MODEL   16
    1    H1   MET   1           1HT      MET   1 -20.401 -11.119  -7.570
    2    H2   MET   1           2HT      MET   1 -21.759 -11.743  -8.413
    3    H3   MET   1           3HT      MET   1 -20.202 -11.783  -9.138
    4    HA   MET   1           HA       MET   1 -21.065 -13.905  -8.197
    5    HB2  MET   1           2HB      MET   1 -18.794 -14.399  -7.215
    6    HB3  MET   1           1HB      MET   1 -18.772 -13.673  -8.816
    7    HG2  MET   1           2HG      MET   1 -18.596 -11.871  -6.467
    8    HG3  MET   1           1HG      MET   1 -17.186 -12.844  -6.881
    9    HE1  MET   1           2HE      MET   1 -15.497 -10.933  -9.524
   10    HE2  MET   1           3HE      MET   1 -15.740 -12.576  -8.928
   11    HE3  MET   1           1HE      MET   1 -15.392 -11.269  -7.796
   12    H    GLY   2           H        GLY   2 -22.482 -12.026  -6.572
   13    HA2  GLY   2           2HA      GLY   2 -21.722 -12.853  -3.847
   14    HA3  GLY   2           1HA      GLY   2 -22.716 -11.458  -4.239
   15    H    SER   3           H        SER   3 -24.644 -11.816  -3.345
   16    HA   SER   3           HA       SER   3 -25.788 -14.490  -3.346
   17    HB2  SER   3           2HB      SER   3 -25.979 -13.230  -1.284
   18    HB3  SER   3           1HB      SER   3 -26.747 -11.888  -2.132
   19    HG   SER   3           HG       SER   3 -28.580 -12.885  -1.963
   20    H    SER   4           H        SER   4 -27.280 -11.322  -3.992
   21    HA   SER   4           HA       SER   4 -28.778 -10.637  -5.561
   22    HB2  SER   4           2HB      SER   4 -26.748 -11.730  -6.971
   23    HB3  SER   4           1HB      SER   4 -28.076 -12.762  -7.503
   24    HG   SER   4           HG       SER   4 -28.042  -9.923  -7.589
   25    H    HIS   5           H        HIS   5 -29.654 -12.517  -3.629
   26    HA   HIS   5           HA       HIS   5 -31.453 -13.815  -3.131
   27    HB2  HIS   5           2HB      HIS   5 -32.372 -12.845  -5.844
   28    HB3  HIS   5           1HB      HIS   5 -33.390 -13.726  -4.709
   29    HD1  HIS   5           1HD      HIS   5 -33.685 -12.460  -2.299
   30    HD2  HIS   5           2HD      HIS   5 -32.432 -10.152  -5.521
   31    HE1  HIS   5           1HE      HIS   5 -34.135 -10.076  -1.635
   32    HE2  HIS   5           2HE      HIS   5 -33.449  -8.705  -3.633
   33    H    HIS   6           H        HIS   6 -30.019 -15.658  -3.228
   34    HA   HIS   6           HA       HIS   6 -30.890 -17.566  -5.262
   35    HB2  HIS   6           2HB      HIS   6 -28.655 -16.463  -5.899
   36    HB3  HIS   6           1HB      HIS   6 -27.969 -17.368  -4.556
   37    HD1  HIS   6           1HD      HIS   6 -26.581 -19.028  -5.834
   38    HD2  HIS   6           2HD      HIS   6 -30.522 -18.890  -7.142
   39    HE1  HIS   6           1HE      HIS   6 -26.823 -20.948  -7.439
   40    HE2  HIS   6           2HE      HIS   6 -29.239 -20.896  -8.152
   41    H    HIS   7           H        HIS   7 -28.944 -17.082  -2.328
   42    HA   HIS   7           HA       HIS   7 -30.353 -19.071  -0.881
   43    HB2  HIS   7           2HB      HIS   7 -28.558 -20.715  -0.612
   44    HB3  HIS   7           1HB      HIS   7 -29.035 -20.583  -2.302
   45    HD1  HIS   7           1HD      HIS   7 -27.099 -17.706  -1.878
   46    HD2  HIS   7           2HD      HIS   7 -26.170 -21.749  -2.109
   47    HE1  HIS   7           1HE      HIS   7 -24.671 -17.801  -2.524
   48    HE2  HIS   7           2HE      HIS   7 -24.109 -20.257  -2.572
   49    H    HIS   8           H        HIS   8 -28.933 -19.668   1.186
   50    HA   HIS   8           HA       HIS   8 -27.202 -17.501   2.023
   51    HB2  HIS   8           2HB      HIS   8 -29.495 -16.642   2.457
   52    HB3  HIS   8           1HB      HIS   8 -29.791 -18.030   3.498
   53    HD1  HIS   8           1HD      HIS   8 -27.090 -15.342   3.304
   54    HD2  HIS   8           2HD      HIS   8 -29.442 -17.352   6.079
   55    HE1  HIS   8           1HE      HIS   8 -26.461 -14.378   5.540
   56    HE2  HIS   8           2HE      HIS   8 -27.835 -15.670   7.211
   57    H    HIS   9           H        HIS   9 -25.545 -18.703   2.710
   58    HA   HIS   9           HA       HIS   9 -26.049 -20.627   4.856
   59    HB2  HIS   9           2HB      HIS   9 -25.244 -21.329   2.189
   60    HB3  HIS   9           1HB      HIS   9 -23.943 -21.719   3.309
   61    HD1  HIS   9           1HD      HIS   9 -27.660 -22.379   2.892
   62    HD2  HIS   9           2HD      HIS   9 -24.286 -24.065   4.633
   63    HE1  HIS   9           1HE      HIS   9 -28.400 -24.621   3.761
   64    HE2  HIS   9           2HE      HIS   9 -26.363 -25.585   4.886
   65    H    HIS  10           H        HIS  10 -24.986 -17.914   4.780
   66    HA   HIS  10           HA       HIS  10 -23.316 -16.689   5.716
   67    HB2  HIS  10           2HB      HIS  10 -23.662 -18.512   7.489
   68    HB3  HIS  10           1HB      HIS  10 -22.201 -19.251   6.841
   69    HD1  HIS  10           1HD      HIS  10 -23.382 -16.180   8.667
   70    HD2  HIS  10           2HD      HIS  10 -19.829 -18.055   7.606
   71    HE1  HIS  10           1HE      HIS  10 -21.577 -14.969   9.935
   72    HE2  HIS  10           2HE      HIS  10 -19.428 -16.066   9.212
   73    H    SER  11           H        SER  11 -22.333 -16.123   3.768
   74    HA   SER  11           HA       SER  11 -19.927 -17.680   3.078
   75    HB2  SER  11           2HB      SER  11 -21.575 -15.909   1.255
   76    HB3  SER  11           1HB      SER  11 -20.154 -16.844   0.788
   77    HG   SER  11           HG       SER  11 -21.284 -18.681   0.947
   78    H    SER  12           H        SER  12 -21.107 -14.374   2.450
   79    HA   SER  12           HA       SER  12 -19.044 -13.159   4.005
   80    HB2  SER  12           2HB      SER  12 -18.060 -13.982   1.656
   81    HB3  SER  12           1HB      SER  12 -18.747 -12.444   1.130
   82    HG   SER  12           HG       SER  12 -16.446 -12.724   2.191
   83    H    GLY  13           H        GLY  13 -21.071 -12.275   4.800
   84    HA2  GLY  13           2HA      GLY  13 -22.173 -10.173   3.041
   85    HA3  GLY  13           1HA      GLY  13 -23.077 -10.962   4.326
   86    H    LEU  14           H        LEU  14 -20.738 -10.832   6.152
   87    HA   LEU  14           HA       LEU  14 -21.371  -8.447   7.471
   88    HB2  LEU  14           2HB      LEU  14 -19.197 -10.474   7.722
   89    HB3  LEU  14           1HB      LEU  14 -19.039  -8.962   8.597
   90    HG   LEU  14           HG       LEU  14 -20.007 -10.790   9.960
   91   HD11  LEU  14          1HD1      LEU  14 -20.470  -8.466  10.517
   92   HD12  LEU  14          2HD1      LEU  14 -21.865  -9.487  10.871
   93   HD13  LEU  14          3HD1      LEU  14 -21.859  -8.470   9.429
   94   HD21  LEU  14          3HD2      LEU  14 -22.387 -11.399   9.504
   95   HD22  LEU  14          1HD2      LEU  14 -21.235 -12.015   8.318
   96   HD23  LEU  14          2HD2      LEU  14 -22.230 -10.609   7.934
   97    H    VAL  15           H        VAL  15 -18.147  -9.209   6.163
   98    HA   VAL  15           HA       VAL  15 -18.001  -6.498   5.050
   99    HB   VAL  15           HB       VAL  15 -15.686  -6.250   5.901
  100   HG11  VAL  15          1HG1      VAL  15 -17.628  -5.228   7.046
  101   HG12  VAL  15          2HG1      VAL  15 -16.293  -5.593   8.139
  102   HG13  VAL  15          3HG1      VAL  15 -17.712  -6.640   8.101
  103   HG21  VAL  15          3HG2      VAL  15 -16.360  -8.838   7.253
  104   HG22  VAL  15          1HG2      VAL  15 -15.175  -7.732   7.948
  105   HG23  VAL  15          2HG2      VAL  15 -14.916  -8.403   6.338
  106    HA   PRO  16           HA       PRO  16 -16.307  -8.314   1.414
  107    HB2  PRO  16           2HB      PRO  16 -14.204  -6.209   1.579
  108    HB3  PRO  16           1HB      PRO  16 -15.270  -6.631   0.236
  109    HG2  PRO  16           2HG      PRO  16 -15.726  -4.449   1.688
  110    HG3  PRO  16           1HG      PRO  16 -17.066  -5.456   1.116
  111    HD2  PRO  16           2HD      PRO  16 -15.880  -5.250   3.845
  112    HD3  PRO  16           1HD      PRO  16 -17.570  -5.504   3.364
  113    H    ARG  17           H        ARG  17 -13.586  -7.014   3.329
  114    HA   ARG  17           HA       ARG  17 -12.543  -9.599   3.930
  115    HB2  ARG  17           2HB      ARG  17 -11.953  -9.317   1.493
  116    HB3  ARG  17           1HB      ARG  17 -10.935  -7.964   1.966
  117    HG2  ARG  17           2HG      ARG  17  -9.862  -9.705   3.583
  118    HG3  ARG  17           1HG      ARG  17 -10.571 -10.879   2.471
  119    HD2  ARG  17           2HD      ARG  17  -8.764  -8.611   1.643
  120    HD3  ARG  17           1HD      ARG  17  -8.224 -10.266   1.926
  121    HE   ARG  17           HE       ARG  17 -10.291 -10.408   0.090
  122   HH11  ARG  17          1HH1      ARG  17  -7.107  -8.989   0.268
  123   HH12  ARG  17          2HH1      ARG  17  -6.824  -9.107  -1.437
  124   HH21  ARG  17          1HH2      ARG  17  -9.920 -10.565  -2.151
  125   HH22  ARG  17          2HH2      ARG  17  -8.419 -10.001  -2.810
  126    H    GLY  18           H        GLY  18 -11.776  -6.161   3.509
  127    HA2  GLY  18           2HA      GLY  18 -11.106  -5.817   6.241
  128    HA3  GLY  18           1HA      GLY  18  -9.640  -5.971   5.285
  129    H    SER  19           H        SER  19  -9.268  -4.421   3.578
  130    HA   SER  19           HA       SER  19  -9.723  -1.777   4.378
  131    HB2  SER  19           2HB      SER  19  -8.994  -2.727   1.597
  132    HB3  SER  19           1HB      SER  19  -8.696  -1.128   2.278
  133    HG   SER  19           HG       SER  19  -7.064  -3.125   2.336
  134    H    HIS  20           H        HIS  20 -10.944  -0.098   3.367
  135    HA   HIS  20           HA       HIS  20 -13.578  -0.975   2.583
  136    HB2  HIS  20           2HB      HIS  20 -12.377   1.759   3.031
  137    HB3  HIS  20           1HB      HIS  20 -14.045   1.512   2.525
  138    HD1  HIS  20           1HD      HIS  20 -13.033   2.777   5.289
  139    HD2  HIS  20           2HD      HIS  20 -14.503  -1.064   4.695
  140    HE1  HIS  20           1HE      HIS  20 -13.882   2.026   7.535
  141    HE2  HIS  20           2HE      HIS  20 -14.847  -0.265   7.132
  142    H    MET  21           H        MET  21 -11.742   1.698   1.146
  143    HA   MET  21           HA       MET  21 -11.710   0.448  -1.454
  144    HB2  MET  21           2HB      MET  21 -13.503   2.802  -0.866
  145    HB3  MET  21           1HB      MET  21 -12.971   2.396  -2.491
  146    HG2  MET  21           2HG      MET  21 -14.601   0.651  -0.660
  147    HG3  MET  21           1HG      MET  21 -15.187   1.526  -2.074
  148    HE1  MET  21           3HE      MET  21 -15.131   1.066  -4.122
  149    HE2  MET  21           1HE      MET  21 -15.434  -0.626  -4.516
  150    HE3  MET  21           2HE      MET  21 -13.920   0.136  -5.003
  151    H    SER  22           H        SER  22 -11.845   3.889  -0.603
  152    HA   SER  22           HA       SER  22  -9.133   4.167  -1.658
  153    HB2  SER  22           2HB      SER  22  -9.631   6.405  -2.211
  154    HB3  SER  22           1HB      SER  22 -11.109   5.523  -2.594
  155    HG   SER  22           HG       SER  22 -10.740   7.529  -0.843
  156    H    ASP  23           H        ASP  23 -10.387   3.631   1.190
  157    HA   ASP  23           HA       ASP  23  -8.976   5.650   2.703
  158    HB2  ASP  23           2HB      ASP  23 -10.593   3.294   3.636
  159    HB3  ASP  23           1HB      ASP  23  -9.949   4.555   4.683
  160    H    GLU  24           H        GLU  24  -8.403   2.663   1.452
  161    HA   GLU  24           HA       GLU  24  -6.646   1.567   3.347
  162    HB2  GLU  24           2HB      GLU  24  -7.744   0.375   1.375
  163    HB3  GLU  24           1HB      GLU  24  -6.463   1.076   0.396
  164    HG2  GLU  24           2HG      GLU  24  -5.551  -0.341   2.797
  165    HG3  GLU  24           1HG      GLU  24  -6.343  -1.348   1.587
  166    H    LYS  25           H        LYS  25  -6.346   4.103   1.266
  167    HA   LYS  25           HA       LYS  25  -3.439   4.059   1.151
  168    HB2  LYS  25           2HB      LYS  25  -4.910   4.741  -0.813
  169    HB3  LYS  25           1HB      LYS  25  -5.256   6.213   0.082
  170    HG2  LYS  25           2HG      LYS  25  -2.574   6.240   0.183
  171    HG3  LYS  25           1HG      LYS  25  -2.816   5.390  -1.345
  172    HD2  LYS  25           2HD      LYS  25  -2.932   7.476  -2.194
  173    HD3  LYS  25           1HD      LYS  25  -4.597   7.408  -1.610
  174    HE2  LYS  25           2HE      LYS  25  -4.162   8.762   0.193
  175    HE3  LYS  25           1HE      LYS  25  -2.458   8.312   0.256
  176    HZ1  LYS  25           3HZ      LYS  25  -1.953   9.730  -1.517
  177    HZ2  LYS  25           1HZ      LYS  25  -3.006  10.633  -0.548
  178    HZ3  LYS  25           2HZ      LYS  25  -3.573   9.913  -1.969
  179    H    THR  26           H        THR  26  -6.006   5.513   2.940
  180    HA   THR  26           HA       THR  26  -4.558   7.761   3.900
  181    HB   THR  26           HB       THR  26  -6.562   7.116   5.774
  182    HG1  THR  26           1HG      THR  26  -7.496   6.824   3.118
  183   HG21  THR  26          3HG2      THR  26  -7.704   8.883   3.980
  184   HG22  THR  26          1HG2      THR  26  -5.970   9.197   3.857
  185   HG23  THR  26          2HG2      THR  26  -6.779   9.292   5.425
  186    H    GLN  27           H        GLN  27  -4.815   4.436   4.880
  187    HA   GLN  27           HA       GLN  27  -3.891   4.678   7.523
  188    HB2  GLN  27           2HB      GLN  27  -4.755   2.597   6.114
  189    HB3  GLN  27           1HB      GLN  27  -3.033   2.352   5.856
  190    HG2  GLN  27           2HG      GLN  27  -3.472   1.056   7.712
  191    HG3  GLN  27           1HG      GLN  27  -2.843   2.546   8.414
  192   HE21  GLN  27          1HE2      GLN  27  -5.266   0.296   8.560
  193   HE22  GLN  27          2HE2      GLN  27  -6.434   1.200   9.459
  194    H    LEU  28           H        LEU  28  -2.336   4.987   4.471
  195    HA   LEU  28           HA       LEU  28   0.337   4.747   5.534
  196    HB2  LEU  28           2HB      LEU  28  -0.400   3.947   3.243
  197    HB3  LEU  28           1HB      LEU  28  -0.478   5.640   2.795
  198    HG   LEU  28           HG       LEU  28   2.090   4.818   3.973
  199   HD11  LEU  28          1HD1      LEU  28   1.815   3.993   1.156
  200   HD12  LEU  28          2HD1      LEU  28   1.079   2.929   2.354
  201   HD13  LEU  28          3HD1      LEU  28   2.798   3.311   2.452
  202   HD21  LEU  28          3HD2      LEU  28   2.298   6.886   3.092
  203   HD22  LEU  28          1HD2      LEU  28   1.037   6.622   1.888
  204   HD23  LEU  28          2HD2      LEU  28   2.657   5.978   1.622
  205    H    ILE  29           H        ILE  29  -1.949   7.067   5.271
  206    HA   ILE  29           HA       ILE  29  -0.489   9.374   4.691
  207    HB   ILE  29           HB       ILE  29  -2.995   9.023   6.275
  208   HG12  ILE  29          2HG1      ILE  29  -2.922   8.433   3.808
  209   HG13  ILE  29          1HG1      ILE  29  -4.177   9.558   4.315
  210   HG21  ILE  29          1HG2      ILE  29  -1.578  11.539   5.462
  211   HG22  ILE  29          2HG2      ILE  29  -2.225  11.092   7.039
  212   HG23  ILE  29          3HG2      ILE  29  -3.322  11.514   5.724
  213   HD11  ILE  29          3HD1      ILE  29  -2.652  11.402   3.556
  214   HD12  ILE  29          1HD1      ILE  29  -3.319  10.364   2.297
  215   HD13  ILE  29          2HD1      ILE  29  -1.648  10.148   2.827
  216    H    GLU  30           H        GLU  30  -0.489   7.454   7.290
  217    HA   GLU  30           HA       GLU  30   0.291   9.368   9.262
  218    HB2  GLU  30           2HB      GLU  30  -0.128   6.437   9.233
  219    HB3  GLU  30           1HB      GLU  30   0.969   7.067  10.453
  220    HG2  GLU  30           2HG      GLU  30  -1.549   8.534  10.249
  221    HG3  GLU  30           1HG      GLU  30  -1.730   6.844  10.717
  222    H    ALA  31           H        ALA  31   1.822   8.334   6.716
  223    HA   ALA  31           HA       ALA  31   4.452   7.948   7.920
  224    HB1  ALA  31           1HB      ALA  31   5.134   7.651   5.474
  225    HB2  ALA  31           2HB      ALA  31   3.406   7.655   5.122
  226    HB3  ALA  31           3HB      ALA  31   4.086   6.421   6.181
  227    H    PHE  32           H        PHE  32   2.601  10.323   6.166
  228    HA   PHE  32           HA       PHE  32   4.624  11.986   5.225
  229    HB2  PHE  32           2HB      PHE  32   1.765  12.353   5.956
  230    HB3  PHE  32           1HB      PHE  32   2.741  13.807   5.779
  231    HD1  PHE  32           1HD      PHE  32   1.546  10.780   4.036
  232    HD2  PHE  32           2HD      PHE  32   3.368  14.608   3.652
  233    HE1  PHE  32           1HE      PHE  32   1.259  10.667   1.595
  234    HE2  PHE  32           2HE      PHE  32   3.083  14.503   1.210
  235    HZ   PHE  32           HZ       PHE  32   2.027  12.530   0.180
  236    H    TYR  33           H        TYR  33   3.516  11.450   8.457
  237    HA   TYR  33           HA       TYR  33   4.906  13.828   9.443
  238    HB2  TYR  33           2HB      TYR  33   3.226  11.807  10.942
  239    HB3  TYR  33           1HB      TYR  33   3.876  13.303  11.604
  240    HD1  TYR  33           1HD      TYR  33   1.657  12.063   8.873
  241    HD2  TYR  33           2HD      TYR  33   2.570  15.222  11.572
  242    HE1  TYR  33           1HE      TYR  33  -0.372  13.253   8.158
  243    HE2  TYR  33           2HE      TYR  33   0.543  16.421  10.865
  244    HH   TYR  33           HH       TYR  33  -1.242  15.549   8.113
  245    H    ASN  34           H        ASN  34   6.434  11.678   8.309
  246    HA   ASN  34           HA       ASN  34   8.450  11.427  10.238
  247    HB2  ASN  34           2HB      ASN  34   8.345   8.991  10.671
  248    HB3  ASN  34           1HB      ASN  34   6.960   9.848  11.341
  249   HD21  ASN  34          1HD2      ASN  34   8.040   7.898   8.620
  250   HD22  ASN  34          2HD2      ASN  34   6.489   7.240   8.239
  251    H    PHE  35           H        PHE  35   8.200  12.134   7.510
  252    HA   PHE  35           HA       PHE  35  10.414  10.803   6.413
  253    HB2  PHE  35           2HB      PHE  35   8.520   9.057   6.179
  254    HB3  PHE  35           1HB      PHE  35   7.901  10.111   4.911
  255    HD1  PHE  35           1HD      PHE  35  11.226   8.732   5.913
  256    HD2  PHE  35           2HD      PHE  35   8.430   9.455   2.788
  257    HE1  PHE  35           1HE      PHE  35  12.762   7.686   4.302
  258    HE2  PHE  35           2HE      PHE  35   9.961   8.410   1.170
  259    HZ   PHE  35           HZ       PHE  35  12.131   7.522   1.927
  260    H    ASP  36           H        ASP  36   9.515  13.461   6.809
  261    HA   ASP  36           HA       ASP  36   9.095  14.422   4.062
  262    HB2  ASP  36           2HB      ASP  36   8.428  16.565   5.118
  263    HB3  ASP  36           1HB      ASP  36   7.418  15.215   5.629
  264    H    GLY  37           H        GLY  37  11.650  13.494   4.834
  265    HA2  GLY  37           2HA      GLY  37  13.388  15.519   5.723
  266    HA3  GLY  37           1HA      GLY  37  13.859  14.117   4.775
  267    H    ASP  38           H        ASP  38  13.065  14.326   2.377
  268    HA   ASP  38           HA       ASP  38  12.805  16.853   1.191
  269    HB2  ASP  38           2HB      ASP  38  15.085  17.060   0.186
  270    HB3  ASP  38           1HB      ASP  38  15.056  17.307   1.930
  271    H    TYR  39           H        TYR  39  11.483  14.566   0.743
  272    HA   TYR  39           HA       TYR  39  10.757  13.163  -0.892
  273    HB2  TYR  39           2HB      TYR  39  12.425  15.083  -2.501
  274    HB3  TYR  39           1HB      TYR  39  11.596  13.729  -3.262
  275    HD1  TYR  39           2HD      TYR  39   9.015  13.579  -2.152
  276    HD2  TYR  39           1HD      TYR  39  11.334  17.074  -2.866
  277    HE1  TYR  39           2HE      TYR  39   6.954  14.912  -2.283
  278    HE2  TYR  39           1HE      TYR  39   9.278  18.417  -2.997
  279    HH   TYR  39           HH       TYR  39   6.161  16.996  -3.181
  280    H    ASP  40           H        ASP  40  11.529  11.187  -0.385
  281    HA   ASP  40           HA       ASP  40  14.302  10.498  -0.822
  282    HB2  ASP  40           2HB      ASP  40  11.945   9.207   0.447
  283    HB3  ASP  40           1HB      ASP  40  13.193   8.139  -0.188
  284    H    GLY  41           H        GLY  41  15.138   9.377  -2.488
  285    HA2  GLY  41           2HA      GLY  41  13.307   8.703  -4.683
  286    HA3  GLY  41           1HA      GLY  41  15.036   8.972  -4.836
  287    H    PHE  42           H        PHE  42  15.446   7.238  -2.385
  288    HA   PHE  42           HA       PHE  42  14.621   4.614  -3.279
  289    HB2  PHE  42           2HB      PHE  42  16.666   5.158  -4.632
  290    HB3  PHE  42           1HB      PHE  42  17.571   5.251  -3.125
  291    HD1  PHE  42           1HD      PHE  42  17.394   3.134  -1.590
  292    HD2  PHE  42           2HD      PHE  42  16.590   3.163  -5.769
  293    HE1  PHE  42           1HE      PHE  42  17.790   0.709  -1.677
  294    HE2  PHE  42           2HE      PHE  42  16.983   0.735  -5.865
  295    HZ   PHE  42           HZ       PHE  42  17.584  -0.494  -3.817
  296    H    VAL  43           H        VAL  43  14.159   3.452  -1.539
  297    HA   VAL  43           HA       VAL  43  15.630   4.002   0.955
  298    HB   VAL  43           HB       VAL  43  13.350   4.895   1.108
  299   HG11  VAL  43          1HG1      VAL  43  12.392   3.219  -0.522
  300   HG12  VAL  43          2HG1      VAL  43  11.406   3.567   0.897
  301   HG13  VAL  43          3HG1      VAL  43  12.344   2.075   0.818
  302   HG21  VAL  43          3HG2      VAL  43  14.437   4.012   3.116
  303   HG22  VAL  43          1HG2      VAL  43  13.747   2.421   2.791
  304   HG23  VAL  43          2HG2      VAL  43  12.690   3.781   3.174
  305    H    SER  44           H        SER  44  16.466   2.282   1.981
  306    HA   SER  44           HA       SER  44  16.195  -0.319   0.728
  307    HB2  SER  44           2HB      SER  44  17.863  -0.792   2.791
  308    HB3  SER  44           1HB      SER  44  18.405  -0.112   1.257
  309    HG   SER  44           HG       SER  44  18.976   0.999   3.345
  310    H    VAL  45           H        VAL  45  15.491  -2.195   1.758
  311    HA   VAL  45           HA       VAL  45  13.236  -2.030   3.354
  312    HB   VAL  45           HB       VAL  45  15.160  -4.350   3.126
  313   HG11  VAL  45          1HG1      VAL  45  13.375  -5.762   3.862
  314   HG12  VAL  45          2HG1      VAL  45  12.264  -4.398   3.949
  315   HG13  VAL  45          3HG1      VAL  45  13.623  -4.502   5.068
  316   HG21  VAL  45          3HG2      VAL  45  13.464  -5.174   1.471
  317   HG22  VAL  45          1HG2      VAL  45  14.384  -3.762   0.956
  318   HG23  VAL  45          2HG2      VAL  45  12.729  -3.572   1.531
  319    H    GLU  46           H        GLU  46  16.515  -2.993   4.382
  320    HA   GLU  46           HA       GLU  46  16.102  -3.356   7.061
  321    HB2  GLU  46           2HB      GLU  46  18.515  -1.928   5.948
  322    HB3  GLU  46           1HB      GLU  46  18.434  -2.923   7.394
  323    HG2  GLU  46           2HG      GLU  46  17.812  -4.840   5.841
  324    HG3  GLU  46           1HG      GLU  46  18.338  -3.786   4.527
  325    H    GLU  47           H        GLU  47  16.274  -0.342   5.307
  326    HA   GLU  47           HA       GLU  47  16.250   1.247   7.742
  327    HB2  GLU  47           2HB      GLU  47  15.918   2.269   4.926
  328    HB3  GLU  47           1HB      GLU  47  16.481   3.150   6.340
  329    HG2  GLU  47           2HG      GLU  47  17.988   0.835   5.162
  330    HG3  GLU  47           1HG      GLU  47  18.228   2.502   4.638
  331    H    PHE  48           H        PHE  48  14.081   0.092   5.283
  332    HA   PHE  48           HA       PHE  48  11.913   1.842   5.822
  333    HB2  PHE  48           2HB      PHE  48  12.487  -0.102   3.930
  334    HB3  PHE  48           1HB      PHE  48  11.156  -0.803   4.842
  335    HD1  PHE  48           1HD      PHE  48   9.645   1.672   5.520
  336    HD2  PHE  48           2HD      PHE  48  11.500   0.429   1.899
  337    HE1  PHE  48           1HE      PHE  48   8.054   3.045   4.239
  338    HE2  PHE  48           2HE      PHE  48   9.915   1.799   0.611
  339    HZ   PHE  48           HZ       PHE  48   8.188   3.110   1.780
  340    H    ARG  49           H        ARG  49  12.882  -1.310   7.064
  341    HA   ARG  49           HA       ARG  49  10.566  -1.968   8.476
  342    HB2  ARG  49           2HB      ARG  49  13.459  -2.616   9.051
  343    HB3  ARG  49           1HB      ARG  49  12.110  -3.334   9.918
  344    HG2  ARG  49           2HG      ARG  49  11.558  -4.697   8.211
  345    HG3  ARG  49           1HG      ARG  49  12.001  -3.515   6.979
  346    HD2  ARG  49           2HD      ARG  49  14.200  -4.158   6.954
  347    HD3  ARG  49           1HD      ARG  49  14.165  -4.720   8.625
  348    HE   ARG  49           HE       ARG  49  12.509  -6.387   7.122
  349   HH11  ARG  49          1HH1      ARG  49  15.895  -5.581   7.371
  350   HH12  ARG  49          2HH1      ARG  49  16.433  -7.138   6.836
  351   HH21  ARG  49          1HH2      ARG  49  13.214  -8.435   6.417
  352   HH22  ARG  49          2HH2      ARG  49  14.911  -8.758   6.294
  353    H    GLY  50           H        GLY  50  13.482  -0.263   9.617
  354    HA2  GLY  50           2HA      GLY  50  12.671   0.191  12.241
  355    HA3  GLY  50           1HA      GLY  50  13.780   1.218  11.347
  356    H    ILE  51           H        ILE  51  11.638   1.743   9.313
  357    HA   ILE  51           HA       ILE  51  10.479   4.017  10.669
  358    HB   ILE  51           HB       ILE  51  10.067   3.130   7.811
  359   HG12  ILE  51          2HG1      ILE  51  11.962   5.290   8.692
  360   HG13  ILE  51          1HG1      ILE  51  12.483   3.610   8.639
  361   HG21  ILE  51          1HG2      ILE  51   9.554   5.559   7.488
  362   HG22  ILE  51          2HG2      ILE  51   9.563   5.730   9.243
  363   HG23  ILE  51          3HG2      ILE  51   8.379   4.680   8.467
  364   HD11  ILE  51          3HD1      ILE  51  13.084   4.130   6.549
  365   HD12  ILE  51          1HD1      ILE  51  11.981   5.504   6.460
  366   HD13  ILE  51          2HD1      ILE  51  11.378   3.868   6.191
  367    H    ILE  52           H        ILE  52   9.312   1.077   9.058
  368    HA   ILE  52           HA       ILE  52   6.557   1.603   9.463
  369    HB   ILE  52           HB       ILE  52   7.940  -1.047   9.031
  370   HG12  ILE  52          2HG1      ILE  52   8.320   0.643   7.244
  371   HG13  ILE  52          1HG1      ILE  52   7.408  -0.757   6.688
  372   HG21  ILE  52          1HG2      ILE  52   5.791  -1.513   9.890
  373   HG22  ILE  52          2HG2      ILE  52   5.665  -1.701   8.141
  374   HG23  ILE  52          3HG2      ILE  52   5.044  -0.245   8.918
  375   HD11  ILE  52          3HD1      ILE  52   6.691   2.023   6.668
  376   HD12  ILE  52          1HD1      ILE  52   5.487   1.072   7.538
  377   HD13  ILE  52          2HD1      ILE  52   5.911   0.654   5.876
  378    H    ARG  53           H        ARG  53   9.045   0.216  11.461
  379    HA   ARG  53           HA       ARG  53   7.591  -1.300  13.255
  380    HB2  ARG  53           2HB      ARG  53  10.182  -0.591  13.070
  381    HB3  ARG  53           1HB      ARG  53   9.696   0.438  14.412
  382    HG2  ARG  53           2HG      ARG  53   8.659  -1.800  15.321
  383    HG3  ARG  53           1HG      ARG  53   9.858  -2.526  14.250
  384    HD2  ARG  53           2HD      ARG  53  10.566  -0.394  16.248
  385    HD3  ARG  53           1HD      ARG  53  10.558  -2.108  16.663
  386    HE   ARG  53           HE       ARG  53  12.112  -1.516  14.326
  387   HH11  ARG  53          1HH1      ARG  53  12.151  -1.629  17.815
  388   HH12  ARG  53          2HH1      ARG  53  13.868  -1.834  17.912
  389   HH21  ARG  53          1HH2      ARG  53  14.370  -1.785  14.453
  390   HH22  ARG  53          2HH2      ARG  53  15.128  -1.922  16.005
  391    H    ASP  54           H        ASP  54   8.466   2.136  13.667
  392    HA   ASP  54           HA       ASP  54   6.157   2.407  15.476
  393    HB2  ASP  54           2HB      ASP  54   8.493   2.843  16.388
  394    HB3  ASP  54           1HB      ASP  54   8.530   4.267  15.350
  395    H    GLY  55           H        GLY  55   6.551   2.757  12.397
  396    HA2  GLY  55           2HA      GLY  55   5.659   5.543  12.171
  397    HA3  GLY  55           1HA      GLY  55   6.202   4.527  10.846
  398    H    LEU  56           H        LEU  56   4.771   2.950   9.988
  399    HA   LEU  56           HA       LEU  56   1.952   3.638  10.440
  400    HB2  LEU  56           2HB      LEU  56   2.944   2.000   8.136
  401    HB3  LEU  56           1HB      LEU  56   1.498   2.984   8.243
  402    HG   LEU  56           HG       LEU  56   4.218   4.251   8.301
  403   HD11  LEU  56          1HD1      LEU  56   4.528   4.106   6.077
  404   HD12  LEU  56          2HD1      LEU  56   2.801   4.168   5.724
  405   HD13  LEU  56          3HD1      LEU  56   3.542   2.653   6.238
  406   HD21  LEU  56          3HD2      LEU  56   3.116   6.197   8.067
  407   HD22  LEU  56          1HD2      LEU  56   1.753   5.285   8.713
  408   HD23  LEU  56          2HD2      LEU  56   1.917   5.509   6.972
  409    HA   PRO  57           HA       PRO  57   1.270  -0.355  12.233
  410    HB2  PRO  57           2HB      PRO  57  -1.410  -0.510  12.025
  411    HB3  PRO  57           1HB      PRO  57  -0.623   0.613  13.141
  412    HG2  PRO  57           2HG      PRO  57  -1.790   1.139  10.434
  413    HG3  PRO  57           1HG      PRO  57  -1.921   2.103  11.916
  414    HD2  PRO  57           2HD      PRO  57  -0.178   2.678   9.894
  415    HD3  PRO  57           1HD      PRO  57   0.118   3.103  11.591
  416    H    MET  58           H        MET  58   2.382  -1.483  10.507
  417    HA   MET  58           HA       MET  58   0.514  -2.854   8.688
  418    HB2  MET  58           2HB      MET  58   2.383  -1.181   7.783
  419    HB3  MET  58           1HB      MET  58   3.389  -2.611   7.950
  420    HG2  MET  58           2HG      MET  58   2.131  -3.816   6.383
  421    HG3  MET  58           1HG      MET  58   0.796  -2.668   6.447
  422    HE1  MET  58           3HE      MET  58   3.385  -3.830   3.976
  423    HE2  MET  58           1HE      MET  58   2.679  -2.683   2.838
  424    HE3  MET  58           2HE      MET  58   1.631  -3.682   3.844
  425    H    THR  59           H        THR  59   0.696  -5.048   8.513
  426    HA   THR  59           HA       THR  59   2.298  -6.377  10.550
  427    HB   THR  59           HB       THR  59   1.007  -8.416   9.417
  428    HG1  THR  59           1HG      THR  59  -0.780  -6.278   8.941
  429   HG21  THR  59          3HG2      THR  59  -1.028  -7.061  10.870
  430   HG22  THR  59          1HG2      THR  59   0.525  -6.787  11.658
  431   HG23  THR  59          2HG2      THR  59  -0.033  -8.433  11.360
  432    H    GLU  60           H        GLU  60   3.874  -7.890  10.147
  433    HA   GLU  60           HA       GLU  60   5.661  -7.558   8.139
  434    HB2  GLU  60           2HB      GLU  60   6.745  -9.258   9.139
  435    HB3  GLU  60           1HB      GLU  60   5.391  -9.279  10.254
  436    HG2  GLU  60           2HG      GLU  60   4.345 -11.060   9.068
  437    HG3  GLU  60           1HG      GLU  60   5.541 -10.969   7.775
  438    H    ALA  61           H        ALA  61   3.092  -9.981   8.131
  439    HA   ALA  61           HA       ALA  61   3.454 -11.200   5.734
  440    HB1  ALA  61           1HB      ALA  61   0.936 -11.405   5.647
  441    HB2  ALA  61           2HB      ALA  61   0.907 -10.408   7.101
  442    HB3  ALA  61           3HB      ALA  61   1.722 -11.971   7.119
  443    H    GLU  62           H        GLU  62   2.326  -7.933   6.235
  444    HA   GLU  62           HA       GLU  62   1.564  -7.655   3.439
  445    HB2  GLU  62           2HB      GLU  62   1.700  -5.214   5.079
  446    HB3  GLU  62           1HB      GLU  62   0.413  -5.800   4.037
  447    HG2  GLU  62           2HG      GLU  62   0.988  -6.623   6.864
  448    HG3  GLU  62           1HG      GLU  62  -0.393  -5.703   6.276
  449    H    ILE  63           H        ILE  63   3.891  -6.189   5.698
  450    HA   ILE  63           HA       ILE  63   5.283  -4.784   3.613
  451    HB   ILE  63           HB       ILE  63   6.573  -5.383   6.244
  452   HG12  ILE  63          2HG1      ILE  63   5.245  -3.031   6.713
  453   HG13  ILE  63          1HG1      ILE  63   4.039  -3.959   5.827
  454   HG21  ILE  63          1HG2      ILE  63   7.571  -4.044   4.268
  455   HG22  ILE  63          2HG2      ILE  63   7.718  -3.397   5.902
  456   HG23  ILE  63          3HG2      ILE  63   6.492  -2.759   4.808
  457   HD11  ILE  63          3HD1      ILE  63   5.100  -4.337   8.527
  458   HD12  ILE  63          1HD1      ILE  63   4.910  -5.814   7.578
  459   HD13  ILE  63          2HD1      ILE  63   3.529  -4.751   7.844
  460    H    THR  64           H        THR  64   5.937  -7.719   5.488
  461    HA   THR  64           HA       THR  64   8.462  -8.278   4.366
  462    HB   THR  64           HB       THR  64   6.367 -10.089   5.554
  463    HG1  THR  64           1HG      THR  64   7.255  -8.649   7.030
  464   HG21  THR  64          3HG2      THR  64   9.223 -10.739   4.902
  465   HG22  THR  64          1HG2      THR  64   7.779 -11.467   4.196
  466   HG23  THR  64          2HG2      THR  64   8.155 -11.726   5.900
  467    H    GLU  65           H        GLU  65   5.208  -9.424   3.551
  468    HA   GLU  65           HA       GLU  65   6.037 -10.953   1.329
  469    HB2  GLU  65           2HB      GLU  65   3.838 -11.177   2.577
  470    HB3  GLU  65           1HB      GLU  65   3.309  -9.752   1.695
  471    HG2  GLU  65           2HG      GLU  65   4.390 -12.015   0.118
  472    HG3  GLU  65           1HG      GLU  65   2.803 -12.217   0.863
  473    H    PHE  66           H        PHE  66   5.713  -7.722   1.848
  474    HA   PHE  66           HA       PHE  66   5.454  -7.054  -0.969
  475    HB2  PHE  66           2HB      PHE  66   5.149  -5.499   1.563
  476    HB3  PHE  66           1HB      PHE  66   5.593  -4.635   0.098
  477    HD1  PHE  66           2HD      PHE  66   3.386  -7.592   0.200
  478    HD2  PHE  66           1HD      PHE  66   3.625  -3.358  -0.158
  479    HE1  PHE  66           2HE      PHE  66   1.023  -7.519  -0.480
  480    HE2  PHE  66           1HE      PHE  66   1.263  -3.277  -0.837
  481    HZ   PHE  66           HZ       PHE  66  -0.042  -5.360  -1.001
  482    H    PHE  67           H        PHE  67   7.764  -7.282   1.573
  483    HA   PHE  67           HA       PHE  67   9.737  -5.554   0.425
  484    HB2  PHE  67           2HB      PHE  67   9.645  -7.513   2.676
  485    HB3  PHE  67           1HB      PHE  67  11.220  -7.030   2.059
  486    HD1  PHE  67           2HD      PHE  67  10.483  -4.147   1.384
  487    HD2  PHE  67           1HD      PHE  67   9.767  -6.566   4.815
  488    HE1  PHE  67           2HE      PHE  67  10.392  -2.128   2.788
  489    HE2  PHE  67           1HE      PHE  67   9.678  -4.550   6.222
  490    HZ   PHE  67           HZ       PHE  67   9.990  -2.330   5.209
  491    H    GLU  68           H        GLU  68   9.013  -8.989   0.278
  492    HA   GLU  68           HA       GLU  68  11.412  -9.676  -1.135
  493    HB2  GLU  68           2HB      GLU  68   8.861 -11.283  -0.977
  494    HB3  GLU  68           1HB      GLU  68  10.482 -11.879  -1.311
  495    HG2  GLU  68           2HG      GLU  68   9.829 -10.539   1.283
  496    HG3  GLU  68           1HG      GLU  68   9.494 -12.250   1.022
  497    H    ALA  69           H        ALA  69   8.176  -8.698  -1.993
  498    HA   ALA  69           HA       ALA  69   8.422  -9.439  -4.747
  499    HB1  ALA  69           1HB      ALA  69   6.268  -8.378  -5.043
  500    HB2  ALA  69           2HB      ALA  69   6.406  -7.643  -3.445
  501    HB3  ALA  69           3HB      ALA  69   6.246  -9.393  -3.600
  502    H    ALA  70           H        ALA  70   9.548  -6.974  -2.928
  503    HA   ALA  70           HA       ALA  70   9.609  -5.004  -5.084
  504    HB1  ALA  70           1HB      ALA  70   9.324  -4.740  -2.352
  505    HB2  ALA  70           2HB      ALA  70   9.672  -3.441  -3.493
  506    HB3  ALA  70           3HB      ALA  70  10.991  -4.244  -2.642
  507    H    ASP  71           H        ASP  71  11.685  -7.176  -3.313
  508    HA   ASP  71           HA       ASP  71  13.912  -6.404  -5.074
  509    HB2  ASP  71           2HB      ASP  71  14.108  -5.695  -2.598
  510    HB3  ASP  71           1HB      ASP  71  14.354  -7.408  -2.272
  511    HA   PRO  72           HA       PRO  72  13.261 -10.803  -5.986
  512    HB2  PRO  72           2HB      PRO  72  14.931 -10.847  -8.144
  513    HB3  PRO  72           1HB      PRO  72  13.254 -10.297  -8.221
  514    HG2  PRO  72           2HG      PRO  72  15.768  -8.688  -8.013
  515    HG3  PRO  72           1HG      PRO  72  14.335  -8.400  -9.017
  516    HD2  PRO  72           2HD      PRO  72  14.766  -7.063  -6.715
  517    HD3  PRO  72           1HD      PRO  72  13.133  -7.495  -7.262
  518    H    ASN  73           H        ASN  73  16.321  -9.089  -5.687
  519    HA   ASN  73           HA       ASN  73  17.897 -11.468  -5.394
  520    HB2  ASN  73           2HB      ASN  73  18.607  -8.619  -4.667
  521    HB3  ASN  73           1HB      ASN  73  19.732  -9.958  -4.877
  522   HD21  ASN  73          1HD2      ASN  73  18.550  -7.286  -6.308
  523   HD22  ASN  73          2HD2      ASN  73  18.806  -7.692  -7.967
  524    H    ASN  74           H        ASN  74  16.135  -9.354  -3.280
  525    HA   ASN  74           HA       ASN  74  15.563  -9.550  -1.086
  526    HB2  ASN  74           2HB      ASN  74  17.217 -12.067  -0.916
  527    HB3  ASN  74           1HB      ASN  74  15.858 -11.587   0.096
  528   HD21  ASN  74          1HD2      ASN  74  16.852 -13.092  -2.819
  529   HD22  ASN  74          2HD2      ASN  74  15.285 -13.564  -3.373
  530    H    THR  75           H        THR  75  17.790  -8.082  -1.978
  531    HA   THR  75           HA       THR  75  19.909  -8.482  -0.051
  532    HB   THR  75           HB       THR  75  20.713  -7.773  -2.138
  533    HG1  THR  75           1HG      THR  75  21.661  -6.567  -0.480
  534   HG21  THR  75          3HG2      THR  75  18.491  -5.771  -2.128
  535   HG22  THR  75          1HG2      THR  75  18.879  -6.996  -3.337
  536   HG23  THR  75          2HG2      THR  75  19.913  -5.578  -3.153
  537    H    GLY  76           H        GLY  76  16.984  -7.512   0.506
  538    HA2  GLY  76           2HA      GLY  76  16.034  -6.265   2.175
  539    HA3  GLY  76           1HA      GLY  76  17.656  -5.902   2.744
  540    H    PHE  77           H        PHE  77  16.723  -5.191  -0.524
  541    HA   PHE  77           HA       PHE  77  16.660  -2.329   0.167
  542    HB2  PHE  77           2HB      PHE  77  17.981  -3.802  -2.070
  543    HB3  PHE  77           1HB      PHE  77  17.372  -2.180  -2.386
  544    HD1  PHE  77           2HD      PHE  77  19.107  -3.739   0.529
  545    HD2  PHE  77           1HD      PHE  77  19.103  -0.679  -2.428
  546    HE1  PHE  77           2HE      PHE  77  21.149  -2.787   1.517
  547    HE2  PHE  77           1HE      PHE  77  21.145   0.278  -1.445
  548    HZ   PHE  77           HZ       PHE  77  22.170  -0.774   0.531
  549    H    ILE  78           H        ILE  78  15.647  -1.090  -1.859
  550    HA   ILE  78           HA       ILE  78  13.390  -2.510  -3.009
  551    HB   ILE  78           HB       ILE  78  12.972  -0.185  -1.126
  552   HG12  ILE  78          2HG1      ILE  78  11.968  -3.032  -1.010
  553   HG13  ILE  78          1HG1      ILE  78  13.208  -2.334   0.033
  554   HG21  ILE  78          1HG2      ILE  78  11.015  -1.600  -2.929
  555   HG22  ILE  78          2HG2      ILE  78  11.531   0.084  -3.035
  556   HG23  ILE  78          3HG2      ILE  78  10.570  -0.458  -1.659
  557   HD11  ILE  78          3HD1      ILE  78  10.466  -2.419   0.489
  558   HD12  ILE  78          1HD1      ILE  78  10.810  -0.740   0.071
  559   HD13  ILE  78          2HD1      ILE  78  11.670  -1.515   1.406
  560    H    ASP  79           H        ASP  79  12.323  -1.359  -4.644
  561    HA   ASP  79           HA       ASP  79  13.889   0.856  -5.764
  562    HB2  ASP  79           2HB      ASP  79  13.545  -1.069  -7.266
  563    HB3  ASP  79           1HB      ASP  79  11.803  -0.929  -7.055
  564    H    TYR  80           H        TYR  80  13.110   2.584  -4.644
  565    HA   TYR  80           HA       TYR  80  10.865   3.244  -3.482
  566    HB2  TYR  80           2HB      TYR  80  12.781   4.798  -3.982
  567    HB3  TYR  80           1HB      TYR  80  12.020   5.137  -5.533
  568    HD1  TYR  80           2HD      TYR  80  11.691   5.517  -1.882
  569    HD2  TYR  80           1HD      TYR  80  10.112   6.574  -5.690
  570    HE1  TYR  80           2HE      TYR  80  10.323   7.264  -0.824
  571    HE2  TYR  80           1HE      TYR  80   8.741   8.325  -4.642
  572    HH   TYR  80           HH       TYR  80   7.769   8.783  -2.357
  573    H    LYS  81           H        LYS  81  11.114   3.191  -7.021
  574    HA   LYS  81           HA       LYS  81   8.502   4.160  -7.504
  575    HB2  LYS  81           2HB      LYS  81  10.600   2.798  -9.111
  576    HB3  LYS  81           1HB      LYS  81   8.957   2.754  -9.735
  577    HG2  LYS  81           2HG      LYS  81   8.929   4.965 -10.210
  578    HG3  LYS  81           1HG      LYS  81   9.968   5.384  -8.847
  579    HD2  LYS  81           2HD      LYS  81  10.930   3.986 -11.339
  580    HD3  LYS  81           1HD      LYS  81  11.018   5.730 -11.088
  581    HE2  LYS  81           2HE      LYS  81  12.745   5.564  -9.647
  582    HE3  LYS  81           1HE      LYS  81  12.121   4.090  -8.908
  583    HZ1  LYS  81           3HZ      LYS  81  13.332   4.110 -11.610
  584    HZ2  LYS  81           1HZ      LYS  81  13.042   2.780 -10.603
  585    HZ3  LYS  81           2HZ      LYS  81  14.257   3.890 -10.210
  586    H    ALA  82           H        ALA  82   9.794   0.836  -7.670
  587    HA   ALA  82           HA       ALA  82   7.421  -0.509  -8.132
  588    HB1  ALA  82           1HB      ALA  82   8.614  -2.393  -7.793
  589    HB2  ALA  82           2HB      ALA  82   9.248  -1.839  -6.243
  590    HB3  ALA  82           3HB      ALA  82   9.981  -1.282  -7.748
  591    H    PHE  83           H        PHE  83   8.602   0.971  -5.228
  592    HA   PHE  83           HA       PHE  83   6.588  -0.290  -3.556
  593    HB2  PHE  83           2HB      PHE  83   9.131   0.867  -3.112
  594    HB3  PHE  83           1HB      PHE  83   7.965   1.850  -2.232
  595    HD1  PHE  83           1HD      PHE  83   8.490  -1.783  -2.897
  596    HD2  PHE  83           2HD      PHE  83   7.710   1.264  -0.032
  597    HE1  PHE  83           1HE      PHE  83   8.419  -3.479  -1.122
  598    HE2  PHE  83           2HE      PHE  83   7.638  -0.428   1.754
  599    HZ   PHE  83           HZ       PHE  83   7.993  -2.805   1.210
  600    H    ALA  84           H        ALA  84   7.240   2.756  -5.137
  601    HA   ALA  84           HA       ALA  84   5.155   4.199  -3.786
  602    HB1  ALA  84           1HB      ALA  84   6.619   4.933  -6.316
  603    HB2  ALA  84           2HB      ALA  84   7.180   5.299  -4.683
  604    HB3  ALA  84           3HB      ALA  84   5.682   6.013  -5.281
  605    H    ALA  85           H        ALA  85   5.297   2.051  -6.451
  606    HA   ALA  85           HA       ALA  85   3.083   3.055  -7.903
  607    HB1  ALA  85           1HB      ALA  85   3.164   0.985  -9.148
  608    HB2  ALA  85           2HB      ALA  85   4.203   0.272  -7.912
  609    HB3  ALA  85           3HB      ALA  85   4.800   1.603  -8.906
  610    H    MET  86           H        MET  86   3.300   1.516  -5.025
  611    HA   MET  86           HA       MET  86   0.889  -0.021  -5.086
  612    HB2  MET  86           2HB      MET  86   2.900   0.725  -3.027
  613    HB3  MET  86           1HB      MET  86   1.299   0.275  -2.455
  614    HG2  MET  86           2HG      MET  86   2.684  -1.663  -2.434
  615    HG3  MET  86           1HG      MET  86   1.496  -1.843  -3.724
  616    HE1  MET  86           3HE      MET  86   5.231  -1.888  -2.788
  617    HE2  MET  86           1HE      MET  86   5.673  -2.850  -4.198
  618    HE3  MET  86           2HE      MET  86   4.347  -3.369  -3.157
  619    H    LEU  87           H        LEU  87   1.782   3.231  -4.121
  620    HA   LEU  87           HA       LEU  87  -0.889   3.769  -3.146
  621    HB2  LEU  87           2HB      LEU  87   1.568   5.469  -3.262
  622    HB3  LEU  87           1HB      LEU  87   0.044   6.010  -2.584
  623    HG   LEU  87           HG       LEU  87   1.140   3.516  -1.435
  624   HD11  LEU  87          1HD1      LEU  87   2.986   4.344  -0.428
  625   HD12  LEU  87          2HD1      LEU  87   2.343   5.985  -0.347
  626   HD13  LEU  87          3HD1      LEU  87   3.016   5.374  -1.860
  627   HD21  LEU  87          3HD2      LEU  87  -0.912   5.099  -0.798
  628   HD22  LEU  87          1HD2      LEU  87   0.343   5.866   0.176
  629   HD23  LEU  87          2HD2      LEU  87  -0.027   4.156   0.400
  630    H    TYR  88           H        TYR  88   0.654   3.791  -5.929
  631    HA   TYR  88           HA       TYR  88  -1.178   5.745  -7.142
  632    HB2  TYR  88           2HB      TYR  88   1.625   5.174  -8.119
  633    HB3  TYR  88           1HB      TYR  88   0.518   6.398  -8.732
  634    HD1  TYR  88           2HD      TYR  88  -0.452   7.832  -6.499
  635    HD2  TYR  88           1HD      TYR  88   3.412   6.133  -7.035
  636    HE1  TYR  88           2HE      TYR  88   0.480   9.468  -4.917
  637    HE2  TYR  88           1HE      TYR  88   4.355   7.766  -5.455
  638    HH   TYR  88           HH       TYR  88   3.082   9.227  -3.339
  639    H    SER  89           H        SER  89  -1.224   2.754  -6.771
  640    HA   SER  89           HA       SER  89  -0.911   1.627  -9.385
  641    HB2  SER  89           2HB      SER  89  -2.351  -0.251  -8.203
  642    HB3  SER  89           1HB      SER  89  -0.658  -0.009  -7.776
  643    HG   SER  89           HG       SER  89  -2.956   0.511  -6.313
  644    H    VAL  90           H        VAL  90  -2.233   3.337 -10.439
  645    HA   VAL  90           HA       VAL  90  -4.898   2.332 -10.900
  646    HB   VAL  90           HB       VAL  90  -5.979   4.562 -10.548
  647   HG11  VAL  90          1HG1      VAL  90  -6.462   4.170  -8.300
  648   HG12  VAL  90          2HG1      VAL  90  -4.839   3.569  -7.958
  649   HG13  VAL  90          3HG1      VAL  90  -5.961   2.590  -8.904
  650   HG21  VAL  90          3HG2      VAL  90  -4.602   5.897  -8.710
  651   HG22  VAL  90          1HG2      VAL  90  -4.408   6.208 -10.435
  652   HG23  VAL  90          2HG2      VAL  90  -3.244   5.191  -9.586
  653    H    ASP  91           H        ASP  91  -3.434   2.043 -12.854
  654    HA   ASP  91           HA       ASP  91  -2.948   2.552 -15.017
  655    HB2  ASP  91           2HB      ASP  91  -4.955   4.783 -14.631
  656    HB3  ASP  91           1HB      ASP  91  -4.393   4.145 -16.172
  657    H    GLU  92           H        GLU  92  -0.810   3.152 -14.269
  658    HA   GLU  92           HA       GLU  92  -0.176   5.884 -15.014
  659    HB2  GLU  92           2HB      GLU  92  -0.602   5.827 -12.504
  660    HB3  GLU  92           1HB      GLU  92   0.837   4.826 -12.380
  661    HG2  GLU  92           2HG      GLU  92   1.772   6.904 -13.846
  662    HG3  GLU  92           1HG      GLU  92   0.574   7.706 -12.833
  663    H    SER  93           H        SER  93   1.098   2.819 -13.750
  664    HA   SER  93           HA       SER  93   3.262   3.005 -15.733
  665    HB2  SER  93           2HB      SER  93   4.272   3.530 -13.602
  666    HB3  SER  93           1HB      SER  93   3.509   2.132 -12.846
  667    HG   SER  93           HG       SER  93   4.781   0.798 -14.167
  Start of MODEL   17
    1    H1   MET   1           1HT      MET   1 -25.277 -18.636 -20.281
    2    H2   MET   1           2HT      MET   1 -24.987 -19.088 -21.911
    3    H3   MET   1           3HT      MET   1 -25.302 -17.449 -21.516
    4    HA   MET   1           HA       MET   1 -23.059 -18.814 -20.267
    5    HB2  MET   1           2HB      MET   1 -21.687 -17.978 -22.245
    6    HB3  MET   1           1HB      MET   1 -22.664 -19.412 -22.519
    7    HG2  MET   1           2HG      MET   1 -23.357 -18.360 -24.352
    8    HG3  MET   1           1HG      MET   1 -24.372 -17.421 -23.260
    9    HE1  MET   1           2HE      MET   1 -24.678 -15.314 -24.469
   10    HE2  MET   1           3HE      MET   1 -23.924 -15.969 -25.921
   11    HE3  MET   1           1HE      MET   1 -23.431 -14.391 -25.308
   12    H    GLY   2           H        GLY   2 -24.220 -15.909 -21.994
   13    HA2  GLY   2           2HA      GLY   2 -23.617 -14.239 -19.737
   14    HA3  GLY   2           1HA      GLY   2 -22.473 -14.030 -21.054
   15    H    SER   3           H        SER   3 -25.957 -14.652 -21.216
   16    HA   SER   3           HA       SER   3 -26.353 -11.951 -22.293
   17    HB2  SER   3           2HB      SER   3 -28.019 -13.186 -23.926
   18    HB3  SER   3           1HB      SER   3 -26.307 -13.051 -24.328
   19    HG   SER   3           HG       SER   3 -27.578 -15.231 -24.306
   20    H    SER   4           H        SER   4 -26.964 -13.112 -19.708
   21    HA   SER   4           HA       SER   4 -29.815 -12.510 -19.668
   22    HB2  SER   4           2HB      SER   4 -30.350 -14.461 -18.286
   23    HB3  SER   4           1HB      SER   4 -29.695 -14.969 -19.841
   24    HG   SER   4           HG       SER   4 -27.942 -15.709 -18.882
   25    H    HIS   5           H        HIS   5 -30.307 -11.197 -18.032
   26    HA   HIS   5           HA       HIS   5 -28.351 -10.170 -16.307
   27    HB2  HIS   5           2HB      HIS   5 -30.852  -9.392 -17.042
   28    HB3  HIS   5           1HB      HIS   5 -31.149  -9.940 -15.395
   29    HD1  HIS   5           1HD      HIS   5 -27.973  -8.862 -14.858
   30    HD2  HIS   5           2HD      HIS   5 -31.419  -6.783 -15.892
   31    HE1  HIS   5           1HE      HIS   5 -27.567  -6.486 -14.138
   32    HE2  HIS   5           2HE      HIS   5 -29.631  -5.230 -14.851
   33    H    HIS   6           H        HIS   6 -29.370 -10.023 -13.790
   34    HA   HIS   6           HA       HIS   6 -29.950 -12.669 -12.785
   35    HB2  HIS   6           2HB      HIS   6 -27.288 -11.335 -12.311
   36    HB3  HIS   6           1HB      HIS   6 -27.932 -12.555 -11.216
   37    HD1  HIS   6           1HD      HIS   6 -27.959 -14.995 -12.042
   38    HD2  HIS   6           2HD      HIS   6 -26.400 -12.300 -14.793
   39    HE1  HIS   6           1HE      HIS   6 -26.853 -16.402 -13.809
   40    HE2  HIS   6           2HE      HIS   6 -25.844 -14.747 -15.418
   41    H    HIS   7           H        HIS   7 -31.229 -10.078 -12.747
   42    HA   HIS   7           HA       HIS   7 -30.905  -8.954 -10.126
   43    HB2  HIS   7           2HB      HIS   7 -32.984  -7.660 -10.760
   44    HB3  HIS   7           1HB      HIS   7 -31.610  -7.457 -11.841
   45    HD1  HIS   7           1HD      HIS   7 -33.480  -6.693 -13.598
   46    HD2  HIS   7           2HD      HIS   7 -33.538 -10.699 -12.500
   47    HE1  HIS   7           1HE      HIS   7 -34.875  -7.847 -15.343
   48    HE2  HIS   7           2HE      HIS   7 -34.823 -10.284 -14.706
   49    H    HIS   8           H        HIS   8 -31.198 -10.926  -8.894
   50    HA   HIS   8           HA       HIS   8 -34.020 -11.734  -8.649
   51    HB2  HIS   8           2HB      HIS   8 -31.469 -13.233  -8.055
   52    HB3  HIS   8           1HB      HIS   8 -33.046 -13.782  -7.496
   53    HD1  HIS   8           1HD      HIS   8 -31.324 -15.449  -9.464
   54    HD2  HIS   8           2HD      HIS   8 -34.348 -12.835 -10.597
   55    HE1  HIS   8           1HE      HIS   8 -32.072 -16.231 -11.734
   56    HE2  HIS   8           2HE      HIS   8 -33.843 -14.581 -12.437
   57    H    HIS   9           H        HIS   9 -31.106 -11.586  -6.589
   58    HA   HIS   9           HA       HIS   9 -32.631 -10.107  -4.587
   59    HB2  HIS   9           2HB      HIS   9 -31.947 -11.613  -2.779
   60    HB3  HIS   9           1HB      HIS   9 -32.921 -12.466  -3.970
   61    HD1  HIS   9           1HD      HIS   9 -31.729 -14.262  -5.411
   62    HD2  HIS   9           2HD      HIS   9 -29.301 -12.476  -2.551
   63    HE1  HIS   9           1HE      HIS   9 -29.672 -15.703  -5.280
   64    HE2  HIS   9           2HE      HIS   9 -28.180 -14.554  -3.606
   65    H    HIS  10           H        HIS  10 -30.932  -9.900  -2.566
   66    HA   HIS  10           HA       HIS  10 -29.078  -8.808  -1.829
   67    HB2  HIS  10           2HB      HIS  10 -28.136 -10.946  -3.171
   68    HB3  HIS  10           1HB      HIS  10 -27.410  -9.661  -4.130
   69    HD1  HIS  10           1HD      HIS  10 -25.237 -10.999  -2.990
   70    HD2  HIS  10           2HD      HIS  10 -27.466  -8.444  -0.587
   71    HE1  HIS  10           1HE      HIS  10 -23.752 -10.448  -1.037
   72    HE2  HIS  10           2HE      HIS  10 -25.091  -8.832   0.358
   73    H    SER  11           H        SER  11 -27.329  -7.183  -2.521
   74    HA   SER  11           HA       SER  11 -28.608  -5.277  -4.316
   75    HB2  SER  11           2HB      SER  11 -27.704  -4.729  -1.954
   76    HB3  SER  11           1HB      SER  11 -26.115  -4.743  -2.717
   77    HG   SER  11           HG       SER  11 -27.079  -3.195  -4.250
   78    H    SER  12           H        SER  12 -28.079  -6.470  -6.256
   79    HA   SER  12           HA       SER  12 -25.243  -6.318  -7.018
   80    HB2  SER  12           2HB      SER  12 -26.119  -7.818  -8.967
   81    HB3  SER  12           1HB      SER  12 -25.895  -8.531  -7.369
   82    HG   SER  12           HG       SER  12 -27.909  -9.087  -7.590
   83    H    GLY  13           H        GLY  13 -27.029  -4.025  -6.993
   84    HA2  GLY  13           2HA      GLY  13 -26.338  -2.853  -9.439
   85    HA3  GLY  13           1HA      GLY  13 -27.998  -3.414  -9.569
   86    H    LEU  14           H        LEU  14 -27.989  -0.911  -9.924
   87    HA   LEU  14           HA       LEU  14 -28.779   1.100  -9.217
   88    HB2  LEU  14           2HB      LEU  14 -30.265  -0.695  -7.895
   89    HB3  LEU  14           1HB      LEU  14 -29.491   0.076  -6.524
   90    HG   LEU  14           HG       LEU  14 -30.311   2.282  -7.760
   91   HD11  LEU  14          1HD1      LEU  14 -31.432   1.668  -9.625
   92   HD12  LEU  14          2HD1      LEU  14 -32.764   1.503  -8.482
   93   HD13  LEU  14          3HD1      LEU  14 -31.854   0.079  -8.986
   94   HD21  LEU  14          3HD2      LEU  14 -31.810   0.439  -5.934
   95   HD22  LEU  14          1HD2      LEU  14 -32.492   1.988  -6.430
   96   HD23  LEU  14          2HD2      LEU  14 -30.964   1.938  -5.552
   97    H    VAL  15           H        VAL  15 -26.022   0.313  -8.685
   98    HA   VAL  15           HA       VAL  15 -25.377   2.430  -6.813
   99    HB   VAL  15           HB       VAL  15 -24.260  -0.338  -6.342
  100   HG11  VAL  15          1HG1      VAL  15 -24.090   1.762  -4.284
  101   HG12  VAL  15          2HG1      VAL  15 -23.118   2.029  -5.731
  102   HG13  VAL  15          3HG1      VAL  15 -22.901   0.558  -4.783
  103   HG21  VAL  15          3HG2      VAL  15 -26.394   1.168  -4.832
  104   HG22  VAL  15          1HG2      VAL  15 -25.596  -0.294  -4.251
  105   HG23  VAL  15          2HG2      VAL  15 -26.585  -0.349  -5.712
  106    HA   PRO  16           HA       PRO  16 -22.705   2.371 -10.608
  107    HB2  PRO  16           2HB      PRO  16 -22.385   5.145  -9.564
  108    HB3  PRO  16           1HB      PRO  16 -22.638   4.590 -11.222
  109    HG2  PRO  16           2HG      PRO  16 -24.628   5.698  -9.847
  110    HG3  PRO  16           1HG      PRO  16 -24.922   4.321 -10.924
  111    HD2  PRO  16           2HD      PRO  16 -24.770   4.402  -7.945
  112    HD3  PRO  16           1HD      PRO  16 -25.802   3.411  -8.998
  113    H    ARG  17           H        ARG  17 -20.561   1.985 -10.652
  114    HA   ARG  17           HA       ARG  17 -18.421   1.663  -9.959
  115    HB2  ARG  17           2HB      ARG  17 -19.197   4.193  -8.604
  116    HB3  ARG  17           1HB      ARG  17 -17.738   3.395  -8.037
  117    HG2  ARG  17           2HG      ARG  17 -17.061   4.962  -9.662
  118    HG3  ARG  17           1HG      ARG  17 -16.948   3.374 -10.423
  119    HD2  ARG  17           2HD      ARG  17 -19.260   3.806 -11.355
  120    HD3  ARG  17           1HD      ARG  17 -19.072   5.471 -10.808
  121    HE   ARG  17           HE       ARG  17 -17.900   4.285 -13.118
  122   HH11  ARG  17          1HH1      ARG  17 -17.374   6.688 -10.641
  123   HH12  ARG  17          2HH1      ARG  17 -16.317   7.647 -11.622
  124   HH21  ARG  17          1HH2      ARG  17 -16.511   5.547 -14.408
  125   HH22  ARG  17          2HH2      ARG  17 -15.827   7.001 -13.762
  126    H    GLY  18           H        GLY  18 -17.877  -0.085  -8.846
  127    HA2  GLY  18           2HA      GLY  18 -19.320  -1.113  -6.682
  128    HA3  GLY  18           1HA      GLY  18 -17.706  -1.623  -7.152
  129    H    SER  19           H        SER  19 -17.558  -1.905  -4.762
  130    HA   SER  19           HA       SER  19 -17.575   0.261  -2.982
  131    HB2  SER  19           2HB      SER  19 -15.712  -1.468  -1.910
  132    HB3  SER  19           1HB      SER  19 -17.457  -1.577  -1.679
  133    HG   SER  19           HG       SER  19 -16.058  -2.818  -3.812
  134    H    HIS  20           H        HIS  20 -14.607  -1.460  -3.912
  135    HA   HIS  20           HA       HIS  20 -12.506  -0.738  -4.394
  136    HB2  HIS  20           2HB      HIS  20 -14.232   1.404  -5.447
  137    HB3  HIS  20           1HB      HIS  20 -12.577   1.900  -5.103
  138    HD1  HIS  20           1HD      HIS  20 -13.032   2.089  -7.922
  139    HD2  HIS  20           2HD      HIS  20 -12.191  -1.603  -6.211
  140    HE1  HIS  20           1HE      HIS  20 -12.199   0.649  -9.806
  141    HE2  HIS  20           2HE      HIS  20 -11.613  -1.553  -8.731
  142    H    MET  21           H        MET  21 -13.834   2.341  -3.219
  143    HA   MET  21           HA       MET  21 -13.304   3.652  -1.437
  144    HB2  MET  21           2HB      MET  21 -13.730   1.220  -0.362
  145    HB3  MET  21           1HB      MET  21 -12.049   1.450   0.098
  146    HG2  MET  21           2HG      MET  21 -13.400   2.219   1.887
  147    HG3  MET  21           1HG      MET  21 -12.700   3.634   1.104
  148    HE1  MET  21           3HE      MET  21 -14.712   5.846   1.065
  149    HE2  MET  21           1HE      MET  21 -15.356   5.480  -0.535
  150    HE3  MET  21           2HE      MET  21 -13.653   5.187  -0.181
  151    H    SER  22           H        SER  22 -11.696   5.063  -1.502
  152    HA   SER  22           HA       SER  22  -8.994   4.096  -2.044
  153    HB2  SER  22           2HB      SER  22 -10.296   5.987  -3.388
  154    HB3  SER  22           1HB      SER  22  -9.627   7.004  -2.112
  155    HG   SER  22           HG       SER  22  -8.192   6.894  -3.853
  156    H    ASP  23           H        ASP  23 -10.684   4.639   0.566
  157    HA   ASP  23           HA       ASP  23  -9.060   6.402   2.073
  158    HB2  ASP  23           2HB      ASP  23 -10.956   4.280   3.037
  159    HB3  ASP  23           1HB      ASP  23 -10.307   5.591   4.020
  160    H    GLU  24           H        GLU  24  -8.680   3.288   1.088
  161    HA   GLU  24           HA       GLU  24  -7.208   2.188   3.212
  162    HB2  GLU  24           2HB      GLU  24  -8.243   0.905   1.301
  163    HB3  GLU  24           1HB      GLU  24  -6.897   1.461   0.315
  164    HG2  GLU  24           2HG      GLU  24  -6.248   0.110   2.869
  165    HG3  GLU  24           1HG      GLU  24  -6.891  -0.882   1.560
  166    H    LYS  25           H        LYS  25  -6.486   4.508   0.985
  167    HA   LYS  25           HA       LYS  25  -3.599   4.183   1.136
  168    HB2  LYS  25           2HB      LYS  25  -4.604   4.779  -1.028
  169    HB3  LYS  25           1HB      LYS  25  -5.260   6.249  -0.319
  170    HG2  LYS  25           2HG      LYS  25  -2.578   6.426   0.263
  171    HG3  LYS  25           1HG      LYS  25  -2.598   5.695  -1.343
  172    HD2  LYS  25           2HD      LYS  25  -3.676   7.517  -2.299
  173    HD3  LYS  25           1HD      LYS  25  -4.301   8.082  -0.748
  174    HE2  LYS  25           2HE      LYS  25  -2.577   9.583  -1.377
  175    HE3  LYS  25           1HE      LYS  25  -1.926   8.573  -0.088
  176    HZ1  LYS  25           3HZ      LYS  25  -1.500   7.732  -2.863
  177    HZ2  LYS  25           1HZ      LYS  25  -0.513   7.513  -1.505
  178    HZ3  LYS  25           2HZ      LYS  25  -0.578   9.019  -2.270
  179    H    THR  26           H        THR  26  -6.157   6.084   2.500
  180    HA   THR  26           HA       THR  26  -4.588   8.244   3.429
  181    HB   THR  26           HB       THR  26  -6.737   8.002   5.194
  182    HG1  THR  26           1HG      THR  26  -7.884   6.547   4.130
  183   HG21  THR  26          3HG2      THR  26  -7.616   9.503   2.993
  184   HG22  THR  26          1HG2      THR  26  -5.870   9.754   3.111
  185   HG23  THR  26          2HG2      THR  26  -6.911  10.089   4.499
  186    H    GLN  27           H        GLN  27  -5.195   5.048   4.648
  187    HA   GLN  27           HA       GLN  27  -4.431   5.457   7.327
  188    HB2  GLN  27           2HB      GLN  27  -3.950   2.963   5.688
  189    HB3  GLN  27           1HB      GLN  27  -4.086   3.069   7.437
  190    HG2  GLN  27           2HG      GLN  27  -6.284   3.575   5.444
  191    HG3  GLN  27           1HG      GLN  27  -6.106   2.155   6.474
  192   HE21  GLN  27          1HE2      GLN  27  -7.952   4.696   6.142
  193   HE22  GLN  27          2HE2      GLN  27  -8.282   5.109   7.787
  194    H    LEU  28           H        LEU  28  -2.669   5.305   4.374
  195    HA   LEU  28           HA       LEU  28  -0.103   4.932   5.642
  196    HB2  LEU  28           2HB      LEU  28  -0.720   3.934   3.425
  197    HB3  LEU  28           1HB      LEU  28  -0.715   5.564   2.777
  198    HG   LEU  28           HG       LEU  28   1.772   4.896   4.158
  199   HD11  LEU  28          1HD1      LEU  28   1.248   2.661   3.319
  200   HD12  LEU  28          2HD1      LEU  28   2.619   3.367   2.464
  201   HD13  LEU  28          3HD1      LEU  28   1.032   3.319   1.698
  202   HD21  LEU  28          3HD2      LEU  28   0.876   6.162   1.618
  203   HD22  LEU  28          1HD2      LEU  28   2.538   5.585   1.734
  204   HD23  LEU  28          2HD2      LEU  28   1.940   6.785   2.880
  205    H    ILE  29           H        ILE  29  -2.123   7.418   4.985
  206    HA   ILE  29           HA       ILE  29  -0.432   9.502   4.259
  207    HB   ILE  29           HB       ILE  29  -3.009   9.542   5.763
  208   HG12  ILE  29          2HG1      ILE  29  -2.895   8.752   3.349
  209   HG13  ILE  29          1HG1      ILE  29  -4.059  10.020   3.717
  210   HG21  ILE  29          1HG2      ILE  29  -1.998  11.577   6.391
  211   HG22  ILE  29          2HG2      ILE  29  -3.095  11.989   5.073
  212   HG23  ILE  29          3HG2      ILE  29  -1.363  11.854   4.770
  213   HD11  ILE  29          3HD1      ILE  29  -2.357  11.661   2.887
  214   HD12  ILE  29          1HD1      ILE  29  -3.049  10.578   1.679
  215   HD13  ILE  29          2HD1      ILE  29  -1.426  10.276   2.311
  216    H    GLU  30           H        GLU  30  -0.690   7.880   7.045
  217    HA   GLU  30           HA       GLU  30   0.216   9.904   8.836
  218    HB2  GLU  30           2HB      GLU  30  -0.150   6.941   9.151
  219    HB3  GLU  30           1HB      GLU  30   0.547   7.929  10.428
  220    HG2  GLU  30           2HG      GLU  30  -2.079   8.701   9.249
  221    HG3  GLU  30           1HG      GLU  30  -2.000   7.377  10.411
  222    H    ALA  31           H        ALA  31   1.715   8.486   6.458
  223    HA   ALA  31           HA       ALA  31   4.279   8.039   7.776
  224    HB1  ALA  31           1HB      ALA  31   3.906   6.353   6.223
  225    HB2  ALA  31           2HB      ALA  31   4.962   7.463   5.350
  226    HB3  ALA  31           3HB      ALA  31   3.227   7.463   5.031
  227    H    PHE  32           H        PHE  32   2.640  10.344   5.751
  228    HA   PHE  32           HA       PHE  32   4.805  11.734   4.678
  229    HB2  PHE  32           2HB      PHE  32   1.967  12.397   5.285
  230    HB3  PHE  32           1HB      PHE  32   3.060  13.732   4.934
  231    HD1  PHE  32           1HD      PHE  32   2.386  10.326   3.554
  232    HD2  PHE  32           2HD      PHE  32   3.026  14.460   2.770
  233    HE1  PHE  32           1HE      PHE  32   2.117   9.906   1.145
  234    HE2  PHE  32           2HE      PHE  32   2.757  14.047   0.359
  235    HZ   PHE  32           HZ       PHE  32   2.303  11.768  -0.456
  236    H    TYR  33           H        TYR  33   3.684  11.577   7.925
  237    HA   TYR  33           HA       TYR  33   5.058  14.032   8.690
  238    HB2  TYR  33           2HB      TYR  33   3.484  12.064  10.364
  239    HB3  TYR  33           1HB      TYR  33   4.136  13.597  10.932
  240    HD1  TYR  33           1HD      TYR  33   1.831  12.190   8.358
  241    HD2  TYR  33           2HD      TYR  33   2.814  15.507  10.835
  242    HE1  TYR  33           1HE      TYR  33  -0.238  13.318   7.657
  243    HE2  TYR  33           2HE      TYR  33   0.747  16.645  10.142
  244    HH   TYR  33           HH       TYR  33  -1.179  15.528   7.534
  245    H    ASN  34           H        ASN  34   6.462  11.557   7.725
  246    HA   ASN  34           HA       ASN  34   8.664  11.663   9.474
  247    HB2  ASN  34           2HB      ASN  34   6.769  10.118  10.598
  248    HB3  ASN  34           1HB      ASN  34   7.565   8.909   9.595
  249   HD21  ASN  34          1HD2      ASN  34  10.143   9.496   9.687
  250   HD22  ASN  34          2HD2      ASN  34  10.748   9.451  11.304
  251    H    PHE  35           H        PHE  35   8.051  11.791   6.658
  252    HA   PHE  35           HA       PHE  35  10.228  10.426   5.589
  253    HB2  PHE  35           2HB      PHE  35   8.294   8.588   6.058
  254    HB3  PHE  35           1HB      PHE  35   7.855   9.089   4.430
  255    HD1  PHE  35           1HD      PHE  35  11.149   8.589   6.104
  256    HD2  PHE  35           2HD      PHE  35   8.530   7.479   2.940
  257    HE1  PHE  35           1HE      PHE  35  12.891   7.114   5.186
  258    HE2  PHE  35           2HE      PHE  35  10.265   6.001   2.016
  259    HZ   PHE  35           HZ       PHE  35  12.450   5.816   3.139
  260    H    ASP  36           H        ASP  36   9.076  12.985   5.434
  261    HA   ASP  36           HA       ASP  36   8.675  13.175   2.535
  262    HB2  ASP  36           2HB      ASP  36   6.543  13.430   4.147
  263    HB3  ASP  36           1HB      ASP  36   7.141  15.085   4.217
  264    H    GLY  37           H        GLY  37  11.098  13.587   3.299
  265    HA2  GLY  37           2HA      GLY  37  11.970  15.979   2.491
  266    HA3  GLY  37           1HA      GLY  37  11.530  16.333   4.155
  267    H    ASP  38           H        ASP  38  13.424  13.998   2.248
  268    HA   ASP  38           HA       ASP  38  15.662  14.361   4.056
  269    HB2  ASP  38           2HB      ASP  38  13.983  12.350   4.699
  270    HB3  ASP  38           1HB      ASP  38  15.029  11.510   3.558
  271    H    TYR  39           H        TYR  39  14.923  14.760   1.172
  272    HA   TYR  39           HA       TYR  39  15.836  14.518  -0.902
  273    HB2  TYR  39           2HB      TYR  39  18.227  14.102   0.884
  274    HB3  TYR  39           1HB      TYR  39  18.368  14.138  -0.871
  275    HD1  TYR  39           2HD      TYR  39  16.937  16.262  -1.890
  276    HD2  TYR  39           1HD      TYR  39  18.813  16.065   1.924
  277    HE1  TYR  39           2HE      TYR  39  17.064  18.716  -1.832
  278    HE2  TYR  39           1HE      TYR  39  18.944  18.519   1.992
  279    HH   TYR  39           HH       TYR  39  17.198  20.507   0.157
  280    H    ASP  40           H        ASP  40  17.466  12.955  -2.206
  281    HA   ASP  40           HA       ASP  40  17.712  10.907  -3.161
  282    HB2  ASP  40           2HB      ASP  40  17.663  10.285  -0.241
  283    HB3  ASP  40           1HB      ASP  40  17.567   8.945  -1.382
  284    H    GLY  41           H        GLY  41  16.573   8.907  -3.745
  285    HA2  GLY  41           2HA      GLY  41  13.718   8.940  -3.018
  286    HA3  GLY  41           1HA      GLY  41  14.196   8.920  -4.709
  287    H    PHE  42           H        PHE  42  15.842   7.175  -2.142
  288    HA   PHE  42           HA       PHE  42  14.643   4.659  -3.021
  289    HB2  PHE  42           2HB      PHE  42  17.490   5.452  -3.376
  290    HB3  PHE  42           1HB      PHE  42  17.165   3.795  -2.881
  291    HD1  PHE  42           1HD      PHE  42  15.875   2.296  -4.341
  292    HD2  PHE  42           2HD      PHE  42  16.995   6.212  -5.577
  293    HE1  PHE  42           1HE      PHE  42  15.407   1.689  -6.680
  294    HE2  PHE  42           2HE      PHE  42  16.528   5.612  -7.916
  295    HZ   PHE  42           HZ       PHE  42  15.732   3.348  -8.470
  296    H    VAL  43           H        VAL  43  14.094   3.486  -1.315
  297    HA   VAL  43           HA       VAL  43  15.558   3.909   1.209
  298    HB   VAL  43           HB       VAL  43  13.259   4.758   1.336
  299   HG11  VAL  43          1HG1      VAL  43  12.322   3.196  -0.367
  300   HG12  VAL  43          2HG1      VAL  43  11.346   3.341   1.094
  301   HG13  VAL  43          3HG1      VAL  43  12.363   1.922   0.852
  302   HG21  VAL  43          3HG2      VAL  43  14.197   3.942   3.376
  303   HG22  VAL  43          1HG2      VAL  43  13.823   2.273   2.947
  304   HG23  VAL  43          2HG2      VAL  43  12.518   3.406   3.305
  305    H    SER  44           H        SER  44  16.610   2.200   1.964
  306    HA   SER  44           HA       SER  44  16.448  -0.338   0.677
  307    HB2  SER  44           2HB      SER  44  17.779   0.022   3.337
  308    HB3  SER  44           1HB      SER  44  18.291  -0.944   1.953
  309    HG   SER  44           HG       SER  44  18.534   1.824   2.380
  310    H    VAL  45           H        VAL  45  15.929  -2.364   1.684
  311    HA   VAL  45           HA       VAL  45  13.436  -2.406   2.953
  312    HB   VAL  45           HB       VAL  45  15.511  -4.602   2.897
  313   HG11  VAL  45          1HG1      VAL  45  14.087  -5.808   4.074
  314   HG12  VAL  45          2HG1      VAL  45  12.877  -5.613   2.809
  315   HG13  VAL  45          3HG1      VAL  45  12.954  -4.460   4.142
  316   HG21  VAL  45          3HG2      VAL  45  14.702  -5.293   0.841
  317   HG22  VAL  45          1HG2      VAL  45  14.690  -3.537   0.685
  318   HG23  VAL  45          2HG2      VAL  45  13.192  -4.401   1.021
  319    H    GLU  46           H        GLU  46  16.693  -2.437   4.223
  320    HA   GLU  46           HA       GLU  46  16.094  -3.256   6.855
  321    HB2  GLU  46           2HB      GLU  46  18.344  -1.386   6.159
  322    HB3  GLU  46           1HB      GLU  46  18.293  -2.621   7.408
  323    HG2  GLU  46           2HG      GLU  46  17.893  -3.884   4.896
  324    HG3  GLU  46           1HG      GLU  46  19.288  -2.815   4.767
  325    H    GLU  47           H        GLU  47  16.862   0.024   5.668
  326    HA   GLU  47           HA       GLU  47  16.147   1.381   7.996
  327    HB2  GLU  47           2HB      GLU  47  17.377   2.226   5.881
  328    HB3  GLU  47           1HB      GLU  47  15.768   2.575   5.264
  329    HG2  GLU  47           2HG      GLU  47  15.347   4.034   7.172
  330    HG3  GLU  47           1HG      GLU  47  16.954   3.676   7.803
  331    H    PHE  48           H        PHE  48  14.190   0.179   5.372
  332    HA   PHE  48           HA       PHE  48  11.859   1.675   5.826
  333    HB2  PHE  48           2HB      PHE  48  12.650  -0.306   4.053
  334    HB3  PHE  48           1HB      PHE  48  11.345  -1.062   4.959
  335    HD1  PHE  48           2HD      PHE  48   9.577   1.230   5.467
  336    HD2  PHE  48           1HD      PHE  48  11.752   0.145   1.973
  337    HE1  PHE  48           2HE      PHE  48   7.932   2.422   4.080
  338    HE2  PHE  48           1HE      PHE  48  10.110   1.337   0.578
  339    HZ   PHE  48           HZ       PHE  48   8.198   2.475   1.631
  340    H    ARG  49           H        ARG  49  12.993  -1.373   7.210
  341    HA   ARG  49           HA       ARG  49  10.682  -2.083   8.609
  342    HB2  ARG  49           2HB      ARG  49  13.591  -2.599   9.235
  343    HB3  ARG  49           1HB      ARG  49  12.260  -3.340  10.115
  344    HG2  ARG  49           2HG      ARG  49  11.709  -4.726   8.396
  345    HG3  ARG  49           1HG      ARG  49  12.292  -3.610   7.160
  346    HD2  ARG  49           2HD      ARG  49  14.614  -4.113   7.884
  347    HD3  ARG  49           1HD      ARG  49  13.968  -5.323   8.991
  348    HE   ARG  49           HE       ARG  49  12.983  -5.890   6.448
  349   HH11  ARG  49          1HH1      ARG  49  16.053  -5.814   8.106
  350   HH12  ARG  49          2HH1      ARG  49  16.759  -7.048   7.119
  351   HH21  ARG  49          1HH2      ARG  49  13.911  -7.515   5.148
  352   HH22  ARG  49          2HH2      ARG  49  15.544  -8.014   5.438
  353    H    GLY  50           H        GLY  50  13.517  -0.241   9.745
  354    HA2  GLY  50           2HA      GLY  50  12.647   0.257  12.341
  355    HA3  GLY  50           1HA      GLY  50  13.735   1.298  11.435
  356    H    ILE  51           H        ILE  51  11.609   1.696   9.354
  357    HA   ILE  51           HA       ILE  51  10.360   3.968  10.625
  358    HB   ILE  51           HB       ILE  51  10.000   2.976   7.796
  359   HG12  ILE  51          2HG1      ILE  51  11.783   5.265   8.517
  360   HG13  ILE  51          1HG1      ILE  51  12.391   3.627   8.719
  361   HG21  ILE  51          1HG2      ILE  51   8.793   4.825   7.370
  362   HG22  ILE  51          2HG2      ILE  51   9.774   5.836   8.428
  363   HG23  ILE  51          3HG2      ILE  51   8.510   4.815   9.111
  364   HD11  ILE  51          3HD1      ILE  51  11.310   3.581   6.195
  365   HD12  ILE  51          1HD1      ILE  51  13.016   3.771   6.594
  366   HD13  ILE  51          2HD1      ILE  51  12.015   5.194   6.308
  367    H    ILE  52           H        ILE  52   9.289   0.962   9.072
  368    HA   ILE  52           HA       ILE  52   6.519   1.420   9.473
  369    HB   ILE  52           HB       ILE  52   7.963  -1.204   9.064
  370   HG12  ILE  52          2HG1      ILE  52   8.322   0.481   7.265
  371   HG13  ILE  52          1HG1      ILE  52   7.440  -0.940   6.715
  372   HG21  ILE  52          1HG2      ILE  52   5.852  -1.778   9.868
  373   HG22  ILE  52          2HG2      ILE  52   5.662  -1.833   8.115
  374   HG23  ILE  52          3HG2      ILE  52   5.062  -0.446   9.024
  375   HD11  ILE  52          3HD1      ILE  52   5.454   0.808   7.510
  376   HD12  ILE  52          1HD1      ILE  52   5.963   0.469   5.856
  377   HD13  ILE  52          2HD1      ILE  52   6.654   1.838   6.727
  378    H    ARG  53           H        ARG  53   9.044   0.077  11.464
  379    HA   ARG  53           HA       ARG  53   7.684  -1.477  13.269
  380    HB2  ARG  53           2HB      ARG  53  10.210  -0.658  13.126
  381    HB3  ARG  53           1HB      ARG  53   9.664   0.460  14.368
  382    HG2  ARG  53           2HG      ARG  53   9.007  -1.362  15.792
  383    HG3  ARG  53           1HG      ARG  53   9.375  -2.532  14.524
  384    HD2  ARG  53           2HD      ARG  53  11.268  -2.646  15.839
  385    HD3  ARG  53           1HD      ARG  53  11.749  -1.477  14.610
  386    HE   ARG  53           HE       ARG  53  10.612  -0.130  16.807
  387   HH11  ARG  53          1HH1      ARG  53  13.489  -1.885  15.906
  388   HH12  ARG  53          2HH1      ARG  53  14.507  -1.041  17.025
  389   HH21  ARG  53          1HH2      ARG  53  11.948   0.983  18.279
  390   HH22  ARG  53          2HH2      ARG  53  13.631   0.588  18.373
  391    H    ASP  54           H        ASP  54   8.320   2.006  13.712
  392    HA   ASP  54           HA       ASP  54   5.938   2.125  15.438
  393    HB2  ASP  54           2HB      ASP  54   8.485   3.739  15.447
  394    HB3  ASP  54           1HB      ASP  54   7.040   4.259  16.308
  395    H    GLY  55           H        GLY  55   6.421   2.521  12.380
  396    HA2  GLY  55           2HA      GLY  55   5.428   5.264  12.115
  397    HA3  GLY  55           1HA      GLY  55   6.005   4.245  10.808
  398    H    LEU  56           H        LEU  56   4.619   2.601   9.981
  399    HA   LEU  56           HA       LEU  56   1.778   3.217  10.421
  400    HB2  LEU  56           2HB      LEU  56   2.936   1.728   8.076
  401    HB3  LEU  56           1HB      LEU  56   1.349   2.462   8.210
  402    HG   LEU  56           HG       LEU  56   2.853   4.662   8.518
  403   HD11  LEU  56          1HD1      LEU  56   4.913   4.598   7.622
  404   HD12  LEU  56          2HD1      LEU  56   4.454   3.432   6.382
  405   HD13  LEU  56          3HD1      LEU  56   4.821   2.882   8.017
  406   HD21  LEU  56          3HD2      LEU  56   2.584   3.850   5.703
  407   HD22  LEU  56          1HD2      LEU  56   1.963   5.272   6.541
  408   HD23  LEU  56          2HD2      LEU  56   1.116   3.730   6.672
  409    HA   PRO  57           HA       PRO  57   1.215  -0.838  12.111
  410    HB2  PRO  57           2HB      PRO  57  -1.454  -1.071  11.898
  411    HB3  PRO  57           1HB      PRO  57  -0.707   0.063  13.028
  412    HG2  PRO  57           2HG      PRO  57  -1.891   0.581  10.329
  413    HG3  PRO  57           1HG      PRO  57  -2.052   1.526  11.821
  414    HD2  PRO  57           2HD      PRO  57  -0.324   2.168   9.798
  415    HD3  PRO  57           1HD      PRO  57  -0.053   2.602  11.498
  416    H    MET  58           H        MET  58   1.965  -2.514  10.987
  417    HA   MET  58           HA       MET  58   0.272  -3.715   8.969
  418    HB2  MET  58           2HB      MET  58   2.496  -2.109   8.221
  419    HB3  MET  58           1HB      MET  58   2.921  -3.782   7.893
  420    HG2  MET  58           2HG      MET  58   1.076  -4.064   6.443
  421    HG3  MET  58           1HG      MET  58   0.354  -2.540   6.955
  422    HE1  MET  58           3HE      MET  58   3.400  -4.192   5.102
  423    HE2  MET  58           1HE      MET  58   3.345  -3.215   3.634
  424    HE3  MET  58           2HE      MET  58   1.943  -4.174   4.107
  425    H    THR  59           H        THR  59   0.470  -5.899   8.901
  426    HA   THR  59           HA       THR  59   1.983  -7.158  10.995
  427    HB   THR  59           HB       THR  59   1.021  -9.214   9.435
  428    HG1  THR  59           1HG      THR  59  -0.947  -7.187   9.351
  429   HG21  THR  59          3HG2      THR  59  -0.545  -7.730  11.532
  430   HG22  THR  59          1HG2      THR  59   0.663  -8.976  11.844
  431   HG23  THR  59          2HG2      THR  59  -0.822  -9.384  10.985
  432    H    GLU  60           H        GLU  60   3.657  -8.663  10.767
  433    HA   GLU  60           HA       GLU  60   5.782  -8.151   9.186
  434    HB2  GLU  60           2HB      GLU  60   6.309 -10.661   9.368
  435    HB3  GLU  60           1HB      GLU  60   6.111  -9.760  10.865
  436    HG2  GLU  60           2HG      GLU  60   3.568 -10.651  10.353
  437    HG3  GLU  60           1HG      GLU  60   4.571 -11.984   9.788
  438    H    ALA  61           H        ALA  61   3.281 -10.511   8.402
  439    HA   ALA  61           HA       ALA  61   4.127 -11.439   5.984
  440    HB1  ALA  61           1HB      ALA  61   1.281 -10.879   5.938
  441    HB2  ALA  61           2HB      ALA  61   1.805 -11.588   7.468
  442    HB3  ALA  61           3HB      ALA  61   2.130 -12.426   5.950
  443    H    GLU  62           H        GLU  62   1.999  -8.608   6.453
  444    HA   GLU  62           HA       GLU  62   1.850  -7.788   3.806
  445    HB2  GLU  62           2HB      GLU  62   2.150  -5.597   5.777
  446    HB3  GLU  62           1HB      GLU  62   0.909  -5.853   4.562
  447    HG2  GLU  62           2HG      GLU  62   1.112  -7.110   7.277
  448    HG3  GLU  62           1HG      GLU  62  -0.108  -5.977   6.702
  449    H    ILE  63           H        ILE  63   4.045  -6.447   6.262
  450    HA   ILE  63           HA       ILE  63   5.676  -5.008   4.490
  451    HB   ILE  63           HB       ILE  63   6.769  -6.236   7.009
  452   HG12  ILE  63          2HG1      ILE  63   5.766  -3.775   7.765
  453   HG13  ILE  63          1HG1      ILE  63   4.482  -4.434   6.752
  454   HG21  ILE  63          1HG2      ILE  63   8.028  -4.717   5.273
  455   HG22  ILE  63          2HG2      ILE  63   8.269  -4.501   7.008
  456   HG23  ILE  63          3HG2      ILE  63   7.189  -3.420   6.126
  457   HD11  ILE  63          3HD1      ILE  63   3.822  -5.426   8.630
  458   HD12  ILE  63          1HD1      ILE  63   5.396  -5.245   9.403
  459   HD13  ILE  63          2HD1      ILE  63   5.111  -6.577   8.279
  460    H    THR  64           H        THR  64   6.510  -8.044   6.140
  461    HA   THR  64           HA       THR  64   8.835  -8.660   4.824
  462    HB   THR  64           HB       THR  64   6.679 -10.520   5.804
  463    HG1  THR  64           1HG      THR  64   7.523  -9.272   7.449
  464   HG21  THR  64          3HG2      THR  64   9.540 -11.135   5.129
  465   HG22  THR  64          1HG2      THR  64   8.094 -11.808   4.376
  466   HG23  THR  64          2HG2      THR  64   8.474 -12.193   6.056
  467    H    GLU  65           H        GLU  65   5.555  -9.731   3.893
  468    HA   GLU  65           HA       GLU  65   6.424 -11.018   1.538
  469    HB2  GLU  65           2HB      GLU  65   3.691  -9.924   2.160
  470    HB3  GLU  65           1HB      GLU  65   4.062 -11.051   0.865
  471    HG2  GLU  65           2HG      GLU  65   4.885 -11.896   3.559
  472    HG3  GLU  65           1HG      GLU  65   3.148 -11.785   3.284
  473    H    PHE  66           H        PHE  66   6.082  -7.855   2.343
  474    HA   PHE  66           HA       PHE  66   5.815  -6.939  -0.397
  475    HB2  PHE  66           2HB      PHE  66   5.555  -5.609   2.266
  476    HB3  PHE  66           1HB      PHE  66   5.960  -4.626   0.865
  477    HD1  PHE  66           2HD      PHE  66   3.790  -7.591   0.682
  478    HD2  PHE  66           1HD      PHE  66   3.955  -3.342   0.869
  479    HE1  PHE  66           2HE      PHE  66   1.410  -7.476   0.070
  480    HE2  PHE  66           1HE      PHE  66   1.575  -3.221   0.258
  481    HZ   PHE  66           HZ       PHE  66   0.299  -5.288  -0.142
  482    H    PHE  67           H        PHE  67   8.148  -7.363   2.113
  483    HA   PHE  67           HA       PHE  67  10.115  -5.569   1.032
  484    HB2  PHE  67           2HB      PHE  67  10.023  -7.598   3.218
  485    HB3  PHE  67           1HB      PHE  67  11.601  -7.122   2.602
  486    HD1  PHE  67           1HD      PHE  67  10.661  -4.175   2.023
  487    HD2  PHE  67           2HD      PHE  67  10.435  -6.753   5.407
  488    HE1  PHE  67           1HE      PHE  67  10.627  -2.219   3.512
  489    HE2  PHE  67           2HE      PHE  67  10.402  -4.798   6.897
  490    HZ   PHE  67           HZ       PHE  67  10.497  -2.529   5.951
  491    H    GLU  68           H        GLU  68   9.286  -8.933   0.634
  492    HA   GLU  68           HA       GLU  68  11.701  -9.449  -0.919
  493    HB2  GLU  68           2HB      GLU  68  10.720 -11.785  -1.060
  494    HB3  GLU  68           1HB      GLU  68  11.171 -11.228   0.546
  495    HG2  GLU  68           2HG      GLU  68   9.071 -11.315   1.304
  496    HG3  GLU  68           1HG      GLU  68   8.399 -10.654  -0.186
  497    H    ALA  69           H        ALA  69   8.313  -8.825  -1.350
  498    HA   ALA  69           HA       ALA  69   8.262  -9.727  -4.076
  499    HB1  ALA  69           1HB      ALA  69   6.226  -8.123  -2.572
  500    HB2  ALA  69           2HB      ALA  69   6.278  -9.886  -2.630
  501    HB3  ALA  69           3HB      ALA  69   5.968  -8.964  -4.102
  502    H    ALA  70           H        ALA  70   9.298  -7.038  -2.543
  503    HA   ALA  70           HA       ALA  70   8.770  -5.198  -4.743
  504    HB1  ALA  70           1HB      ALA  70   8.395  -4.149  -2.692
  505    HB2  ALA  70           2HB      ALA  70   9.979  -3.558  -3.193
  506    HB3  ALA  70           3HB      ALA  70   9.856  -4.826  -1.972
  507    H    ASP  71           H        ASP  71  11.423  -6.910  -3.213
  508    HA   ASP  71           HA       ASP  71  13.258  -5.794  -5.224
  509    HB2  ASP  71           2HB      ASP  71  15.082  -6.504  -3.698
  510    HB3  ASP  71           1HB      ASP  71  13.989  -5.336  -2.959
  511    HA   PRO  72           HA       PRO  72  13.036  -9.874  -7.059
  512    HB2  PRO  72           2HB      PRO  72  14.911  -9.466  -8.984
  513    HB3  PRO  72           1HB      PRO  72  13.259  -8.851  -9.100
  514    HG2  PRO  72           2HG      PRO  72  15.755  -7.426  -8.264
  515    HG3  PRO  72           1HG      PRO  72  14.446  -6.865  -9.321
  516    HD2  PRO  72           2HD      PRO  72  14.633  -6.114  -6.734
  517    HD3  PRO  72           1HD      PRO  72  13.071  -6.329  -7.548
  518    H    ASN  73           H        ASN  73  16.239  -8.376  -6.582
  519    HA   ASN  73           HA       ASN  73  17.629 -10.843  -6.436
  520    HB2  ASN  73           2HB      ASN  73  18.525  -8.204  -5.270
  521    HB3  ASN  73           1HB      ASN  73  19.541  -9.547  -5.786
  522   HD21  ASN  73          1HD2      ASN  73  18.180  -6.624  -6.661
  523   HD22  ASN  73          2HD2      ASN  73  18.488  -6.687  -8.359
  524    H    ASN  74           H        ASN  74  16.003  -8.850  -4.085
  525    HA   ASN  74           HA       ASN  74  15.347  -9.288  -1.946
  526    HB2  ASN  74           2HB      ASN  74  16.794 -11.933  -2.073
  527    HB3  ASN  74           1HB      ASN  74  15.444 -11.479  -1.038
  528   HD21  ASN  74          1HD2      ASN  74  13.374 -11.124  -2.057
  529   HD22  ASN  74          2HD2      ASN  74  12.972 -11.994  -3.493
  530    H    THR  75           H        THR  75  18.012  -8.231  -2.854
  531    HA   THR  75           HA       THR  75  19.972  -8.960  -0.966
  532    HB   THR  75           HB       THR  75  20.769  -7.893  -2.899
  533    HG1  THR  75           1HG      THR  75  21.774  -7.120  -0.978
  534   HG21  THR  75          3HG2      THR  75  18.707  -5.786  -2.385
  535   HG22  THR  75          1HG2      THR  75  18.953  -6.768  -3.829
  536   HG23  THR  75          2HG2      THR  75  20.105  -5.495  -3.420
  537    H    GLY  76           H        GLY  76  17.143  -7.105  -0.673
  538    HA2  GLY  76           2HA      GLY  76  16.338  -6.471   1.488
  539    HA3  GLY  76           1HA      GLY  76  18.003  -6.218   1.994
  540    H    PHE  77           H        PHE  77  17.031  -5.055  -1.104
  541    HA   PHE  77           HA       PHE  77  16.813  -2.330  -0.017
  542    HB2  PHE  77           2HB      PHE  77  18.437  -3.340  -2.334
  543    HB3  PHE  77           1HB      PHE  77  17.873  -1.673  -2.306
  544    HD1  PHE  77           2HD      PHE  77  20.108  -4.121  -0.770
  545    HD2  PHE  77           1HD      PHE  77  18.758  -0.084  -0.717
  546    HE1  PHE  77           2HE      PHE  77  22.030  -3.501   0.635
  547    HE2  PHE  77           1HE      PHE  77  20.680   0.543   0.687
  548    HZ   PHE  77           HZ       PHE  77  22.317  -1.165   1.365
  549    H    ILE  78           H        ILE  78  15.063  -1.231  -0.642
  550    HA   ILE  78           HA       ILE  78  13.310  -2.464  -2.642
  551    HB   ILE  78           HB       ILE  78  12.734  -0.285  -0.628
  552   HG12  ILE  78          2HG1      ILE  78  11.849  -3.170  -0.711
  553   HG13  ILE  78          1HG1      ILE  78  13.039  -2.492   0.403
  554   HG21  ILE  78          1HG2      ILE  78  10.779  -1.740  -2.399
  555   HG22  ILE  78          2HG2      ILE  78  11.386  -0.113  -2.712
  556   HG23  ILE  78          3HG2      ILE  78  10.430  -0.433  -1.269
  557   HD11  ILE  78          3HD1      ILE  78  11.439  -1.844   1.787
  558   HD12  ILE  78          1HD1      ILE  78  10.281  -2.697   0.764
  559   HD13  ILE  78          2HD1      ILE  78  10.601  -0.981   0.493
  560    H    ASP  79           H        ASP  79  12.440  -1.340  -4.343
  561    HA   ASP  79           HA       ASP  79  13.934   1.022  -5.196
  562    HB2  ASP  79           2HB      ASP  79  12.062  -0.882  -6.616
  563    HB3  ASP  79           1HB      ASP  79  12.558   0.645  -7.339
  564    H    TYR  80           H        TYR  80  13.085   2.656  -3.985
  565    HA   TYR  80           HA       TYR  80  10.797   3.188  -2.846
  566    HB2  TYR  80           2HB      TYR  80  12.663   4.824  -3.137
  567    HB3  TYR  80           1HB      TYR  80  12.011   5.226  -4.722
  568    HD1  TYR  80           2HD      TYR  80  11.361   5.368  -1.090
  569    HD2  TYR  80           1HD      TYR  80  10.135   6.677  -4.948
  570    HE1  TYR  80           2HE      TYR  80   9.880   7.033  -0.048
  571    HE2  TYR  80           1HE      TYR  80   8.651   8.346  -3.917
  572    HH   TYR  80           HH       TYR  80   8.415   9.553  -1.817
  573    H    LYS  81           H        LYS  81  11.140   3.382  -6.373
  574    HA   LYS  81           HA       LYS  81   8.532   4.344  -6.873
  575    HB2  LYS  81           2HB      LYS  81  10.581   2.917  -8.544
  576    HB3  LYS  81           1HB      LYS  81   8.974   3.233  -9.183
  577    HG2  LYS  81           2HG      LYS  81  10.333   5.543  -7.970
  578    HG3  LYS  81           1HG      LYS  81  11.056   4.910  -9.452
  579    HD2  LYS  81           2HD      LYS  81   9.557   6.350 -10.382
  580    HD3  LYS  81           1HD      LYS  81   8.515   4.934 -10.235
  581    HE2  LYS  81           2HE      LYS  81   8.626   6.682  -7.868
  582    HE3  LYS  81           1HE      LYS  81   7.883   7.392  -9.301
  583    HZ1  LYS  81           3HZ      LYS  81   7.076   4.697  -8.451
  584    HZ2  LYS  81           1HZ      LYS  81   6.189   5.869  -9.289
  585    HZ3  LYS  81           2HZ      LYS  81   6.457   6.039  -7.629
  586    H    ALA  82           H        ALA  82   9.857   1.039  -7.143
  587    HA   ALA  82           HA       ALA  82   7.519  -0.306  -7.752
  588    HB1  ALA  82           1HB      ALA  82  10.106  -1.039  -7.186
  589    HB2  ALA  82           2HB      ALA  82   8.777  -2.146  -7.535
  590    HB3  ALA  82           3HB      ALA  82   9.196  -1.771  -5.862
  591    H    PHE  83           H        PHE  83   8.581   1.046  -4.740
  592    HA   PHE  83           HA       PHE  83   6.506  -0.289  -3.205
  593    HB2  PHE  83           2HB      PHE  83   9.031   0.848  -2.618
  594    HB3  PHE  83           1HB      PHE  83   7.833   1.795  -1.741
  595    HD1  PHE  83           1HD      PHE  83   8.478  -1.797  -2.512
  596    HD2  PHE  83           2HD      PHE  83   7.418   1.112   0.407
  597    HE1  PHE  83           1HE      PHE  83   8.363  -3.560  -0.806
  598    HE2  PHE  83           2HE      PHE  83   7.300  -0.647   2.123
  599    HZ   PHE  83           HZ       PHE  83   7.774  -2.988   1.518
  600    H    ALA  84           H        ALA  84   7.209   2.828  -4.620
  601    HA   ALA  84           HA       ALA  84   5.039   4.179  -3.291
  602    HB1  ALA  84           1HB      ALA  84   6.675   5.089  -5.654
  603    HB2  ALA  84           2HB      ALA  84   7.102   5.353  -3.963
  604    HB3  ALA  84           3HB      ALA  84   5.648   6.093  -4.630
  605    H    ALA  85           H        ALA  85   5.416   2.277  -6.135
  606    HA   ALA  85           HA       ALA  85   3.246   3.360  -7.604
  607    HB1  ALA  85           1HB      ALA  85   3.493   1.452  -9.066
  608    HB2  ALA  85           2HB      ALA  85   4.492   0.643  -7.857
  609    HB3  ALA  85           3HB      ALA  85   5.082   2.101  -8.657
  610    H    MET  86           H        MET  86   3.380   1.515  -4.907
  611    HA   MET  86           HA       MET  86   1.063  -0.117  -5.273
  612    HB2  MET  86           2HB      MET  86   2.498   0.697  -2.738
  613    HB3  MET  86           1HB      MET  86   1.247  -0.534  -2.841
  614    HG2  MET  86           2HG      MET  86   3.825  -0.671  -4.378
  615    HG3  MET  86           1HG      MET  86   3.608  -1.376  -2.776
  616    HE1  MET  86           3HE      MET  86   3.641  -4.142  -5.753
  617    HE2  MET  86           1HE      MET  86   4.698  -2.963  -4.973
  618    HE3  MET  86           2HE      MET  86   3.761  -2.504  -6.396
  619    H    LEU  87           H        LEU  87   1.704   3.071  -3.971
  620    HA   LEU  87           HA       LEU  87  -1.061   3.363  -3.142
  621    HB2  LEU  87           2HB      LEU  87   1.296   5.180  -2.843
  622    HB3  LEU  87           1HB      LEU  87  -0.305   5.544  -2.226
  623    HG   LEU  87           HG       LEU  87   0.925   2.997  -1.328
  624   HD11  LEU  87          1HD1      LEU  87   1.787   5.644  -0.180
  625   HD12  LEU  87          2HD1      LEU  87   2.780   4.653  -1.250
  626   HD13  LEU  87          3HD1      LEU  87   2.300   4.036   0.330
  627   HD21  LEU  87          3HD2      LEU  87  -0.279   4.962   0.515
  628   HD22  LEU  87          1HD2      LEU  87  -0.494   3.216   0.417
  629   HD23  LEU  87          2HD2      LEU  87  -1.349   4.274  -0.705
  630    H    TYR  88           H        TYR  88   0.705   3.786  -5.756
  631    HA   TYR  88           HA       TYR  88  -1.116   5.798  -6.886
  632    HB2  TYR  88           2HB      TYR  88   1.794   5.460  -7.638
  633    HB3  TYR  88           1HB      TYR  88   0.684   6.678  -8.260
  634    HD1  TYR  88           1HD      TYR  88  -0.598   7.848  -6.031
  635    HD2  TYR  88           2HD      TYR  88   3.397   6.408  -6.288
  636    HE1  TYR  88           1HE      TYR  88   0.063   9.380  -4.224
  637    HE2  TYR  88           2HE      TYR  88   4.070   7.935  -4.481
  638    HH   TYR  88           HH       TYR  88   2.643  10.479  -3.596
  639    H    SER  89           H        SER  89  -1.046   2.786  -6.872
  640    HA   SER  89           HA       SER  89  -0.553   2.092  -9.638
  641    HB2  SER  89           2HB      SER  89  -1.756  -0.107  -8.684
  642    HB3  SER  89           1HB      SER  89  -0.052   0.242  -8.386
  643    HG   SER  89           HG       SER  89  -2.093   0.064  -6.628
  644    H    VAL  90           H        VAL  90  -2.100   3.673 -10.487
  645    HA   VAL  90           HA       VAL  90  -4.686   2.427 -10.896
  646    HB   VAL  90           HB       VAL  90  -4.570   5.279  -9.914
  647   HG11  VAL  90          1HG1      VAL  90  -6.784   5.419 -10.308
  648   HG12  VAL  90          2HG1      VAL  90  -7.077   3.736  -9.869
  649   HG13  VAL  90          3HG1      VAL  90  -6.454   4.137 -11.470
  650   HG21  VAL  90          3HG2      VAL  90  -5.338   2.762  -8.442
  651   HG22  VAL  90          1HG2      VAL  90  -5.666   4.396  -7.864
  652   HG23  VAL  90          2HG2      VAL  90  -4.002   3.849  -8.067
  653    H    ASP  91           H        ASP  91  -3.245   2.321 -12.912
  654    HA   ASP  91           HA       ASP  91  -2.693   4.582 -14.463
  655    HB2  ASP  91           2HB      ASP  91  -1.890   2.174 -14.803
  656    HB3  ASP  91           1HB      ASP  91  -3.425   1.895 -15.618
  657    H    GLU  92           H        GLU  92  -3.738   5.113 -16.576
  658    HA   GLU  92           HA       GLU  92  -6.388   5.927 -16.191
  659    HB2  GLU  92           2HB      GLU  92  -6.356   6.585 -18.542
  660    HB3  GLU  92           1HB      GLU  92  -4.849   7.032 -17.755
  661    HG2  GLU  92           2HG      GLU  92  -3.864   6.086 -19.512
  662    HG3  GLU  92           1HG      GLU  92  -4.262   4.555 -18.735
  663    H    SER  93           H        SER  93  -8.338   5.246 -17.141
  664    HA   SER  93           HA       SER  93  -8.485   2.368 -17.535
  665    HB2  SER  93           2HB      SER  93 -10.145   3.209 -16.055
  666    HB3  SER  93           1HB      SER  93 -10.570   4.518 -17.157
  667    HG   SER  93           HG       SER  93 -12.119   3.036 -17.494
  Start of MODEL   18
    1    H1   MET   1           1HT      MET   1 -20.826 -32.875  12.321
    2    H2   MET   1           2HT      MET   1 -20.627 -33.518  10.743
    3    H3   MET   1           3HT      MET   1 -21.822 -32.322  11.040
    4    HA   MET   1           HA       MET   1 -18.898 -32.018  11.117
    5    HB2  MET   1           2HB      MET   1 -21.120 -31.290   9.274
    6    HB3  MET   1           1HB      MET   1 -19.798 -30.143   9.442
    7    HG2  MET   1           2HG      MET   1 -18.414 -32.423   9.075
    8    HG3  MET   1           1HG      MET   1 -19.869 -32.781   8.148
    9    HE1  MET   1           2HE      MET   1 -20.247 -30.093   5.691
   10    HE2  MET   1           3HE      MET   1 -19.956 -29.022   7.060
   11    HE3  MET   1           1HE      MET   1 -20.948 -30.466   7.266
   12    H    GLY   2           H        GLY   2 -18.477 -29.511  11.097
   13    HA2  GLY   2           2HA      GLY   2 -19.679 -27.439  12.033
   14    HA3  GLY   2           1HA      GLY   2 -19.888 -28.450  13.455
   15    H    SER   3           H        SER   3 -17.292 -27.379  11.257
   16    HA   SER   3           HA       SER   3 -15.497 -27.250  13.580
   17    HB2  SER   3           2HB      SER   3 -14.843 -28.669  11.591
   18    HB3  SER   3           1HB      SER   3 -14.699 -27.175  10.665
   19    HG   SER   3           HG       SER   3 -13.014 -28.248  12.537
   20    H    SER   4           H        SER   4 -16.696 -25.215  14.101
   21    HA   SER   4           HA       SER   4 -15.616 -22.943  12.564
   22    HB2  SER   4           2HB      SER   4 -18.228 -23.293  14.017
   23    HB3  SER   4           1HB      SER   4 -17.579 -21.685  13.695
   24    HG   SER   4           HG       SER   4 -19.051 -22.903  12.081
   25    H    HIS   5           H        HIS   5 -16.289 -24.222  15.778
   26    HA   HIS   5           HA       HIS   5 -15.417 -23.754  17.825
   27    HB2  HIS   5           2HB      HIS   5 -13.226 -22.595  16.100
   28    HB3  HIS   5           1HB      HIS   5 -13.116 -22.706  17.853
   29    HD1  HIS   5           1HD      HIS   5 -11.035 -24.289  17.450
   30    HD2  HIS   5           2HD      HIS   5 -14.688 -25.786  16.155
   31    HE1  HIS   5           1HE      HIS   5 -10.662 -26.749  17.088
   32    HE2  HIS   5           2HE      HIS   5 -12.910 -27.649  16.390
   33    H    HIS   6           H        HIS   6 -17.258 -21.878  16.556
   34    HA   HIS   6           HA       HIS   6 -18.197 -19.844  16.946
   35    HB2  HIS   6           2HB      HIS   6 -17.733 -20.687  19.335
   36    HB3  HIS   6           1HB      HIS   6 -16.380 -19.559  19.329
   37    HD1  HIS   6           1HD      HIS   6 -20.121 -19.409  18.619
   38    HD2  HIS   6           2HD      HIS   6 -17.071 -17.135  20.290
   39    HE1  HIS   6           1HE      HIS   6 -21.232 -17.325  19.482
   40    HE2  HIS   6           2HE      HIS   6 -19.381 -16.005  20.567
   41    H    HIS   7           H        HIS   7 -17.436 -18.725  15.181
   42    HA   HIS   7           HA       HIS   7 -15.743 -16.512  15.690
   43    HB2  HIS   7           2HB      HIS   7 -14.546 -18.920  14.431
   44    HB3  HIS   7           1HB      HIS   7 -14.150 -17.367  13.699
   45    HD1  HIS   7           1HD      HIS   7 -13.067 -19.606  16.285
   46    HD2  HIS   7           2HD      HIS   7 -13.085 -15.483  15.764
   47    HE1  HIS   7           1HE      HIS   7 -11.381 -18.713  17.925
   48    HE2  HIS   7           2HE      HIS   7 -11.347 -16.225  17.532
   49    H    HIS   8           H        HIS   8 -16.082 -18.442  12.726
   50    HA   HIS   8           HA       HIS   8 -17.018 -17.981  10.705
   51    HB2  HIS   8           2HB      HIS   8 -19.019 -17.704  12.428
   52    HB3  HIS   8           1HB      HIS   8 -18.920 -16.023  11.915
   53    HD1  HIS   8           1HD      HIS   8 -18.375 -18.943   9.593
   54    HD2  HIS   8           2HD      HIS   8 -21.218 -16.018  10.391
   55    HE1  HIS   8           1HE      HIS   8 -20.046 -19.100   7.720
   56    HE2  HIS   8           2HE      HIS   8 -21.709 -17.264   8.179
   57    H    HIS   9           H        HIS   9 -17.761 -16.012   9.260
   58    HA   HIS   9           HA       HIS   9 -16.420 -13.530   9.882
   59    HB2  HIS   9           2HB      HIS   9 -15.277 -15.529   8.003
   60    HB3  HIS   9           1HB      HIS   9 -15.235 -13.844   7.498
   61    HD1  HIS   9           1HD      HIS   9 -13.901 -16.158  10.143
   62    HD2  HIS   9           2HD      HIS   9 -13.384 -12.256   8.813
   63    HE1  HIS   9           1HE      HIS   9 -11.856 -15.309  11.334
   64    HE2  HIS   9           2HE      HIS   9 -11.613 -12.917  10.578
   65    H    HIS  10           H        HIS  10 -17.646 -11.942   9.125
   66    HA   HIS  10           HA       HIS  10 -19.629 -12.540   7.066
   67    HB2  HIS  10           2HB      HIS  10 -19.311 -10.187   8.936
   68    HB3  HIS  10           1HB      HIS  10 -20.579 -10.312   7.722
   69    HD1  HIS  10           1HD      HIS  10 -19.596 -11.518  11.087
   70    HD2  HIS  10           2HD      HIS  10 -22.570 -12.262   8.282
   71    HE1  HIS  10           1HE      HIS  10 -21.358 -12.833  12.308
   72    HE2  HIS  10           2HE      HIS  10 -23.106 -13.347  10.567
   73    H    SER  11           H        SER  11 -20.059 -10.870   5.401
   74    HA   SER  11           HA       SER  11 -17.948  -9.049   4.708
   75    HB2  SER  11           2HB      SER  11 -18.401 -11.013   2.533
   76    HB3  SER  11           1HB      SER  11 -16.935 -10.141   2.979
   77    HG   SER  11           HG       SER  11 -16.448 -12.103   3.667
   78    H    SER  12           H        SER  12 -20.750  -8.854   5.222
   79    HA   SER  12           HA       SER  12 -22.608  -7.819   4.419
   80    HB2  SER  12           2HB      SER  12 -20.550  -6.409   3.404
   81    HB3  SER  12           1HB      SER  12 -21.297  -6.950   1.902
   82    HG   SER  12           HG       SER  12 -23.095  -5.842   2.373
   83    H    GLY  13           H        GLY  13 -24.081  -9.328   3.903
   84    HA2  GLY  13           2HA      GLY  13 -23.765 -10.849   1.418
   85    HA3  GLY  13           1HA      GLY  13 -24.895 -11.211   2.714
   86    H    LEU  14           H        LEU  14 -24.321  -9.354  -0.165
   87    HA   LEU  14           HA       LEU  14 -27.178  -8.938  -0.455
   88    HB2  LEU  14           2HB      LEU  14 -25.206  -6.741  -0.054
   89    HB3  LEU  14           1HB      LEU  14 -26.505  -6.485  -1.201
   90    HG   LEU  14           HG       LEU  14 -27.091  -7.387   1.601
   91   HD11  LEU  14          1HD1      LEU  14 -25.669  -5.340   1.666
   92   HD12  LEU  14          2HD1      LEU  14 -27.290  -5.119   2.323
   93   HD13  LEU  14          3HD1      LEU  14 -26.902  -4.516   0.712
   94   HD21  LEU  14          3HD2      LEU  14 -28.597  -6.339  -0.720
   95   HD22  LEU  14          1HD2      LEU  14 -29.113  -5.796   0.876
   96   HD23  LEU  14          2HD2      LEU  14 -29.068  -7.520   0.502
   97    H    VAL  15           H        VAL  15 -23.999  -8.142  -1.852
   98    HA   VAL  15           HA       VAL  15 -24.376  -9.617  -4.198
   99    HB   VAL  15           HB       VAL  15 -26.092  -7.985  -4.759
  100   HG11  VAL  15          1HG1      VAL  15 -25.853  -5.711  -4.696
  101   HG12  VAL  15          2HG1      VAL  15 -24.107  -5.775  -4.944
  102   HG13  VAL  15          3HG1      VAL  15 -24.790  -6.168  -3.366
  103   HG21  VAL  15          3HG2      VAL  15 -25.388  -7.479  -6.948
  104   HG22  VAL  15          1HG2      VAL  15 -24.498  -8.933  -6.496
  105   HG23  VAL  15          2HG2      VAL  15 -23.696  -7.362  -6.464
  106    HA   PRO  16           HA       PRO  16 -20.017  -8.453  -3.178
  107    HB2  PRO  16           2HB      PRO  16 -19.713 -10.851  -4.924
  108    HB3  PRO  16           1HB      PRO  16 -18.893 -10.450  -3.411
  109    HG2  PRO  16           2HG      PRO  16 -20.830 -12.274  -3.459
  110    HG3  PRO  16           1HG      PRO  16 -20.685 -11.137  -2.105
  111    HD2  PRO  16           2HD      PRO  16 -22.623 -11.147  -4.374
  112    HD3  PRO  16           1HD      PRO  16 -22.866 -10.665  -2.682
  113    H    ARG  17           H        ARG  17 -19.124  -6.884  -4.345
  114    HA   ARG  17           HA       ARG  17 -19.007  -7.177  -7.264
  115    HB2  ARG  17           2HB      ARG  17 -19.381  -4.683  -7.423
  116    HB3  ARG  17           1HB      ARG  17 -20.786  -5.633  -6.964
  117    HG2  ARG  17           2HG      ARG  17 -19.932  -5.062  -4.530
  118    HG3  ARG  17           1HG      ARG  17 -19.204  -3.695  -5.375
  119    HD2  ARG  17           2HD      ARG  17 -22.013  -4.264  -6.055
  120    HD3  ARG  17           1HD      ARG  17 -21.728  -3.714  -4.403
  121    HE   ARG  17           HE       ARG  17 -21.494  -2.167  -6.815
  122   HH11  ARG  17          1HH1      ARG  17 -20.465  -2.458  -3.492
  123   HH12  ARG  17          2HH1      ARG  17 -20.086  -0.777  -3.332
  124   HH21  ARG  17          1HH2      ARG  17 -20.996   0.046  -6.604
  125   HH22  ARG  17          2HH2      ARG  17 -20.389   0.646  -5.097
  126    H    GLY  18           H        GLY  18 -17.261  -6.053  -8.284
  127    HA2  GLY  18           2HA      GLY  18 -14.839  -6.175  -6.835
  128    HA3  GLY  18           1HA      GLY  18 -15.039  -5.492  -8.442
  129    H    SER  19           H        SER  19 -13.240  -4.272  -6.947
  130    HA   SER  19           HA       SER  19 -12.592  -2.261  -6.109
  131    HB2  SER  19           2HB      SER  19 -14.229  -1.624  -8.095
  132    HB3  SER  19           1HB      SER  19 -15.224  -1.014  -6.773
  133    HG   SER  19           HG       SER  19 -12.875  -0.037  -7.809
  134    H    HIS  20           H        HIS  20 -12.647  -3.109  -3.966
  135    HA   HIS  20           HA       HIS  20 -14.985  -2.854  -2.335
  136    HB2  HIS  20           2HB      HIS  20 -12.173  -3.717  -1.941
  137    HB3  HIS  20           1HB      HIS  20 -13.026  -3.137  -0.515
  138    HD1  HIS  20           1HD      HIS  20 -15.306  -4.774  -2.822
  139    HD2  HIS  20           2HD      HIS  20 -12.750  -5.964   0.230
  140    HE1  HIS  20           1HE      HIS  20 -16.046  -7.093  -2.193
  141    HE2  HIS  20           2HE      HIS  20 -14.428  -7.827  -0.406
  142    H    MET  21           H        MET  21 -11.795  -1.402  -1.735
  143    HA   MET  21           HA       MET  21 -12.846   1.263  -1.624
  144    HB2  MET  21           2HB      MET  21 -13.392  -0.059   0.623
  145    HB3  MET  21           1HB      MET  21 -11.736   0.396   1.001
  146    HG2  MET  21           2HG      MET  21 -13.283   2.016   1.899
  147    HG3  MET  21           1HG      MET  21 -12.302   2.746   0.630
  148    HE1  MET  21           3HE      MET  21 -13.245   4.405  -0.660
  149    HE2  MET  21           1HE      MET  21 -14.725   4.306  -1.615
  150    HE3  MET  21           2HE      MET  21 -13.378   3.222  -1.960
  151    H    SER  22           H        SER  22 -11.236   2.836  -1.530
  152    HA   SER  22           HA       SER  22  -8.535   1.798  -1.926
  153    HB2  SER  22           2HB      SER  22 -10.018   4.137  -2.981
  154    HB3  SER  22           1HB      SER  22  -8.290   4.357  -2.706
  155    HG   SER  22           HG       SER  22  -8.314   3.533  -4.688
  156    H    ASP  23           H        ASP  23 -10.203   2.801   0.557
  157    HA   ASP  23           HA       ASP  23  -8.587   4.823   1.700
  158    HB2  ASP  23           2HB      ASP  23 -10.469   2.889   3.024
  159    HB3  ASP  23           1HB      ASP  23  -9.800   4.330   3.788
  160    H    GLU  24           H        GLU  24  -8.173   1.588   1.293
  161    HA   GLU  24           HA       GLU  24  -6.678   0.898   3.567
  162    HB2  GLU  24           2HB      GLU  24  -7.692  -0.701   1.881
  163    HB3  GLU  24           1HB      GLU  24  -6.323  -0.316   0.844
  164    HG2  GLU  24           2HG      GLU  24  -5.573  -2.222   1.845
  165    HG3  GLU  24           1HG      GLU  24  -4.927  -1.006   2.946
  166    H    LYS  25           H        LYS  25  -5.984   2.811   0.971
  167    HA   LYS  25           HA       LYS  25  -3.092   2.561   1.180
  168    HB2  LYS  25           2HB      LYS  25  -4.051   2.757  -1.058
  169    HB3  LYS  25           1HB      LYS  25  -4.805   4.285  -0.621
  170    HG2  LYS  25           2HG      LYS  25  -1.897   4.174  -0.227
  171    HG3  LYS  25           1HG      LYS  25  -2.439   4.055  -1.902
  172    HD2  LYS  25           2HD      LYS  25  -3.540   6.139  -1.801
  173    HD3  LYS  25           1HD      LYS  25  -3.449   6.188  -0.038
  174    HE2  LYS  25           2HE      LYS  25  -1.124   6.607  -0.076
  175    HE3  LYS  25           1HE      LYS  25  -1.001   6.190  -1.784
  176    HZ1  LYS  25           3HZ      LYS  25  -2.591   8.493  -0.814
  177    HZ2  LYS  25           1HZ      LYS  25  -2.098   8.162  -2.399
  178    HZ3  LYS  25           2HZ      LYS  25  -0.960   8.627  -1.237
  179    H    THR  26           H        THR  26  -5.688   4.654   2.149
  180    HA   THR  26           HA       THR  26  -4.150   6.952   2.721
  181    HB   THR  26           HB       THR  26  -6.319   6.998   4.476
  182    HG1  THR  26           1HG      THR  26  -7.948   6.034   3.499
  183   HG21  THR  26          3HG2      THR  26  -7.163   8.058   2.002
  184   HG22  THR  26          1HG2      THR  26  -5.435   8.388   2.158
  185   HG23  THR  26          2HG2      THR  26  -6.557   8.920   3.417
  186    H    GLN  27           H        GLN  27  -4.746   4.001   4.457
  187    HA   GLN  27           HA       GLN  27  -4.052   4.842   7.044
  188    HB2  GLN  27           2HB      GLN  27  -3.972   2.221   5.598
  189    HB3  GLN  27           1HB      GLN  27  -3.192   2.351   7.168
  190    HG2  GLN  27           2HG      GLN  27  -5.181   1.821   8.007
  191    HG3  GLN  27           1HG      GLN  27  -5.630   3.487   7.643
  192   HE21  GLN  27          1HE2      GLN  27  -7.328   3.791   6.388
  193   HE22  GLN  27          2HE2      GLN  27  -8.055   2.607   5.362
  194    H    LEU  28           H        LEU  28  -2.202   4.349   4.192
  195    HA   LEU  28           HA       LEU  28   0.339   4.248   5.556
  196    HB2  LEU  28           2HB      LEU  28  -0.173   2.945   3.476
  197    HB3  LEU  28           1HB      LEU  28  -0.225   4.473   2.619
  198    HG   LEU  28           HG       LEU  28   2.253   3.998   4.144
  199   HD11  LEU  28          1HD1      LEU  28   2.294   1.817   3.468
  200   HD12  LEU  28          2HD1      LEU  28   3.012   2.590   2.055
  201   HD13  LEU  28          3HD1      LEU  28   1.312   2.124   2.037
  202   HD21  LEU  28          3HD2      LEU  28   2.988   4.607   1.635
  203   HD22  LEU  28          1HD2      LEU  28   2.530   5.818   2.832
  204   HD23  LEU  28          2HD2      LEU  28   1.355   5.271   1.637
  205    H    ILE  29           H        ILE  29  -1.756   6.534   4.532
  206    HA   ILE  29           HA       ILE  29  -0.058   8.584   3.646
  207    HB   ILE  29           HB       ILE  29  -2.786   8.745   4.854
  208   HG12  ILE  29          2HG1      ILE  29  -2.431   7.453   2.691
  209   HG13  ILE  29          1HG1      ILE  29  -3.661   8.711   2.678
  210   HG21  ILE  29          1HG2      ILE  29  -1.947  10.918   5.095
  211   HG22  ILE  29          2HG2      ILE  29  -2.856  10.975   3.585
  212   HG23  ILE  29          3HG2      ILE  29  -1.096  10.859   3.552
  213   HD11  ILE  29          3HD1      ILE  29  -2.683   9.699   0.986
  214   HD12  ILE  29          1HD1      ILE  29  -1.531   8.366   0.917
  215   HD13  ILE  29          2HD1      ILE  29  -1.155   9.805   1.868
  216    H    GLU  30           H        GLU  30  -0.576   7.320   6.565
  217    HA   GLU  30           HA       GLU  30  -0.057   9.608   8.180
  218    HB2  GLU  30           2HB      GLU  30  -0.504   6.726   8.708
  219    HB3  GLU  30           1HB      GLU  30   0.372   7.636   9.930
  220    HG2  GLU  30           2HG      GLU  30  -2.136   8.828   8.923
  221    HG3  GLU  30           1HG      GLU  30  -2.278   7.383   9.924
  222    H    ALA  31           H        ALA  31   1.842   8.085   6.186
  223    HA   ALA  31           HA       ALA  31   4.237   8.004   7.849
  224    HB1  ALA  31           1HB      ALA  31   3.559   6.271   6.021
  225    HB2  ALA  31           2HB      ALA  31   5.247   6.747   6.201
  226    HB3  ALA  31           3HB      ALA  31   4.266   7.449   4.915
  227    H    PHE  32           H        PHE  32   2.747   9.906   5.330
  228    HA   PHE  32           HA       PHE  32   4.958  11.387   4.473
  229    HB2  PHE  32           2HB      PHE  32   2.027  11.666   4.356
  230    HB3  PHE  32           1HB      PHE  32   2.916  13.183   4.255
  231    HD1  PHE  32           2HD      PHE  32   5.009  13.057   2.598
  232    HD2  PHE  32           1HD      PHE  32   1.541  10.602   2.390
  233    HE1  PHE  32           2HE      PHE  32   5.452  12.641   0.214
  234    HE2  PHE  32           1HE      PHE  32   1.976  10.181   0.006
  235    HZ   PHE  32           HZ       PHE  32   3.934  11.201  -1.086
  236    H    TYR  33           H        TYR  33   3.008  11.630   7.349
  237    HA   TYR  33           HA       TYR  33   4.271  14.166   8.085
  238    HB2  TYR  33           2HB      TYR  33   2.179  12.668   9.659
  239    HB3  TYR  33           1HB      TYR  33   2.617  14.369   9.785
  240    HD1  TYR  33           2HD      TYR  33   1.856  15.975   8.099
  241    HD2  TYR  33           1HD      TYR  33   0.698  11.886   7.923
  242    HE1  TYR  33           2HE      TYR  33   0.075  16.555   6.506
  243    HE2  TYR  33           1HE      TYR  33  -1.086  12.453   6.329
  244    HH   TYR  33           HH       TYR  33  -2.395  15.134   5.910
  245    H    ASN  34           H        ASN  34   5.731  11.600   8.008
  246    HA   ASN  34           HA       ASN  34   7.147  11.876  10.448
  247    HB2  ASN  34           2HB      ASN  34   5.076  10.563  11.148
  248    HB3  ASN  34           1HB      ASN  34   5.709   9.237  10.175
  249   HD21  ASN  34          1HD2      ASN  34   7.155  11.573  12.424
  250   HD22  ASN  34          2HD2      ASN  34   7.930  10.392  13.418
  251    H    PHE  35           H        PHE  35   7.652  11.830   7.609
  252    HA   PHE  35           HA       PHE  35  10.029  10.356   7.551
  253    HB2  PHE  35           2HB      PHE  35   8.551   8.398   7.419
  254    HB3  PHE  35           1HB      PHE  35   7.765   9.081   6.000
  255    HD1  PHE  35           2HD      PHE  35  11.379   8.930   6.852
  256    HD2  PHE  35           1HD      PHE  35   8.256   7.611   4.280
  257    HE1  PHE  35           2HE      PHE  35  13.039   7.829   5.406
  258    HE2  PHE  35           1HE      PHE  35   9.909   6.507   2.831
  259    HZ   PHE  35           HZ       PHE  35  12.305   6.615   3.394
  260    H    ASP  36           H        ASP  36  10.406  12.593   6.871
  261    HA   ASP  36           HA       ASP  36  10.472  12.766   3.985
  262    HB2  ASP  36           2HB      ASP  36   8.271  13.848   5.053
  263    HB3  ASP  36           1HB      ASP  36   9.369  15.205   5.287
  264    H    GLY  37           H        GLY  37  12.716  12.440   4.961
  265    HA2  GLY  37           2HA      GLY  37  13.870  14.987   5.875
  266    HA3  GLY  37           1HA      GLY  37  14.617  13.407   6.055
  267    H    ASP  38           H        ASP  38  15.630  12.438   4.248
  268    HA   ASP  38           HA       ASP  38  15.743  13.533   1.676
  269    HB2  ASP  38           2HB      ASP  38  16.978  15.275   3.278
  270    HB3  ASP  38           1HB      ASP  38  18.326  14.174   3.014
  271    H    TYR  39           H        TYR  39  15.510  11.165   1.616
  272    HA   TYR  39           HA       TYR  39  18.095   9.777   1.875
  273    HB2  TYR  39           2HB      TYR  39  15.772   9.055   3.047
  274    HB3  TYR  39           1HB      TYR  39  15.620   8.187   1.523
  275    HD1  TYR  39           2HD      TYR  39  18.646   8.877   3.590
  276    HD2  TYR  39           1HD      TYR  39  15.976   5.948   2.042
  277    HE1  TYR  39           2HE      TYR  39  20.099   7.099   4.466
  278    HE2  TYR  39           1HE      TYR  39  17.422   4.161   2.916
  279    HH   TYR  39           HH       TYR  39  19.117   3.817   4.595
  280    H    ASP  40           H        ASP  40  17.007  11.435  -0.398
  281    HA   ASP  40           HA       ASP  40  16.915  11.392  -2.671
  282    HB2  ASP  40           2HB      ASP  40  19.233  10.553  -2.277
  283    HB3  ASP  40           1HB      ASP  40  18.613   8.908  -2.376
  284    H    GLY  41           H        GLY  41  14.904   9.810  -1.112
  285    HA2  GLY  41           2HA      GLY  41  12.970   8.729  -1.806
  286    HA3  GLY  41           1HA      GLY  41  13.690   8.524  -3.396
  287    H    PHE  42           H        PHE  42  15.813   7.027  -3.129
  288    HA   PHE  42           HA       PHE  42  14.890   4.441  -2.760
  289    HB2  PHE  42           2HB      PHE  42  16.921   5.073  -4.054
  290    HB3  PHE  42           1HB      PHE  42  17.762   5.367  -2.535
  291    HD1  PHE  42           2HD      PHE  42  16.295   2.799  -4.711
  292    HD2  PHE  42           1HD      PHE  42  18.568   3.562  -1.196
  293    HE1  PHE  42           2HE      PHE  42  16.950   0.428  -4.623
  294    HE2  PHE  42           1HE      PHE  42  19.227   1.194  -1.101
  295    HZ   PHE  42           HZ       PHE  42  18.418  -0.377  -2.816
  296    H    VAL  43           H        VAL  43  14.454   3.270  -1.027
  297    HA   VAL  43           HA       VAL  43  15.897   3.804   1.472
  298    HB   VAL  43           HB       VAL  43  13.812   4.977   1.742
  299   HG11  VAL  43          1HG1      VAL  43  12.643   3.616  -0.053
  300   HG12  VAL  43          2HG1      VAL  43  11.678   4.074   1.350
  301   HG13  VAL  43          3HG1      VAL  43  12.307   2.432   1.211
  302   HG21  VAL  43          3HG2      VAL  43  14.620   3.796   3.703
  303   HG22  VAL  43          1HG2      VAL  43  13.753   2.341   3.212
  304   HG23  VAL  43          2HG2      VAL  43  12.857   3.791   3.672
  305    H    SER  44           H        SER  44  17.004   1.964   1.718
  306    HA   SER  44           HA       SER  44  16.281  -0.554   0.751
  307    HB2  SER  44           2HB      SER  44  18.178   0.312   2.930
  308    HB3  SER  44           1HB      SER  44  17.973  -1.384   2.490
  309    HG   SER  44           HG       SER  44  18.431  -0.594   0.264
  310    H    VAL  45           H        VAL  45  15.595  -2.451   1.858
  311    HA   VAL  45           HA       VAL  45  13.307  -2.157   3.417
  312    HB   VAL  45           HB       VAL  45  15.109  -4.571   3.199
  313   HG11  VAL  45          1HG1      VAL  45  13.198  -5.881   3.887
  314   HG12  VAL  45          2HG1      VAL  45  12.221  -4.423   4.046
  315   HG13  VAL  45          3HG1      VAL  45  13.589  -4.693   5.125
  316   HG21  VAL  45          3HG2      VAL  45  13.553  -5.320   1.471
  317   HG22  VAL  45          1HG2      VAL  45  14.304  -3.785   1.034
  318   HG23  VAL  45          2HG2      VAL  45  12.646  -3.816   1.632
  319    H    GLU  46           H        GLU  46  16.505  -3.346   4.455
  320    HA   GLU  46           HA       GLU  46  16.060  -3.660   7.134
  321    HB2  GLU  46           2HB      GLU  46  18.587  -2.436   6.037
  322    HB3  GLU  46           1HB      GLU  46  18.414  -3.445   7.467
  323    HG2  GLU  46           2HG      GLU  46  17.626  -5.268   5.864
  324    HG3  GLU  46           1HG      GLU  46  18.275  -4.245   4.584
  325    H    GLU  47           H        GLU  47  16.404  -0.678   5.366
  326    HA   GLU  47           HA       GLU  47  16.580   0.919   7.789
  327    HB2  GLU  47           2HB      GLU  47  17.672   1.353   5.411
  328    HB3  GLU  47           1HB      GLU  47  16.126   2.132   5.100
  329    HG2  GLU  47           2HG      GLU  47  17.205   3.934   5.900
  330    HG3  GLU  47           1HG      GLU  47  16.716   3.259   7.454
  331    H    PHE  48           H        PHE  48  14.238  -0.080   5.418
  332    HA   PHE  48           HA       PHE  48  12.232   1.827   5.954
  333    HB2  PHE  48           2HB      PHE  48  12.552  -0.282   4.192
  334    HB3  PHE  48           1HB      PHE  48  11.236  -0.825   5.225
  335    HD1  PHE  48           2HD      PHE  48   9.726   1.544   5.801
  336    HD2  PHE  48           1HD      PHE  48  11.686   0.420   2.193
  337    HE1  PHE  48           2HE      PHE  48   8.153   2.935   4.518
  338    HE2  PHE  48           1HE      PHE  48  10.115   1.809   0.903
  339    HZ   PHE  48           HZ       PHE  48   8.345   3.068   2.066
  340    H    ARG  49           H        ARG  49  13.178  -1.136   7.542
  341    HA   ARG  49           HA       ARG  49  10.892  -1.702   9.018
  342    HB2  ARG  49           2HB      ARG  49  13.816  -2.170   9.480
  343    HB3  ARG  49           1HB      ARG  49  12.659  -2.568  10.743
  344    HG2  ARG  49           2HG      ARG  49  11.883  -4.369   9.647
  345    HG3  ARG  49           1HG      ARG  49  11.988  -3.586   8.069
  346    HD2  ARG  49           2HD      ARG  49  14.245  -4.121   7.820
  347    HD3  ARG  49           1HD      ARG  49  14.461  -4.412   9.545
  348    HE   ARG  49           HE       ARG  49  13.526  -6.282   7.573
  349   HH11  ARG  49          1HH1      ARG  49  13.529  -5.465  10.965
  350   HH12  ARG  49          2HH1      ARG  49  13.218  -7.088  11.484
  351   HH21  ARG  49          1HH2      ARG  49  13.119  -8.417   8.253
  352   HH22  ARG  49          2HH2      ARG  49  12.985  -8.763   9.945
  353    H    GLY  50           H        GLY  50  13.672   0.332   9.942
  354    HA2  GLY  50           2HA      GLY  50  12.744   1.111  12.456
  355    HA3  GLY  50           1HA      GLY  50  13.847   2.045  11.458
  356    H    ILE  51           H        ILE  51  11.754   2.154   9.300
  357    HA   ILE  51           HA       ILE  51  10.465   4.559  10.255
  358    HB   ILE  51           HB       ILE  51  10.128   3.239   7.562
  359   HG12  ILE  51          2HG1      ILE  51  12.118   5.376   8.350
  360   HG13  ILE  51          1HG1      ILE  51  12.523   3.679   8.108
  361   HG21  ILE  51          1HG2      ILE  51   9.359   5.849   8.750
  362   HG22  ILE  51          2HG2      ILE  51   8.499   4.831   7.594
  363   HG23  ILE  51          3HG2      ILE  51   9.854   5.825   7.057
  364   HD11  ILE  51          3HD1      ILE  51  13.083   5.061   6.171
  365   HD12  ILE  51          1HD1      ILE  51  11.385   5.512   6.011
  366   HD13  ILE  51          2HD1      ILE  51  11.877   3.834   5.781
  367    H    ILE  52           H        ILE  52   9.610   1.243   9.631
  368    HA   ILE  52           HA       ILE  52   6.757   1.792   9.797
  369    HB   ILE  52           HB       ILE  52   8.226  -0.831   9.493
  370   HG12  ILE  52          2HG1      ILE  52   8.451   0.711   7.566
  371   HG13  ILE  52          1HG1      ILE  52   7.527  -0.733   7.164
  372   HG21  ILE  52          1HG2      ILE  52   6.215  -1.494  10.391
  373   HG22  ILE  52          2HG2      ILE  52   5.837  -1.493   8.668
  374   HG23  ILE  52          3HG2      ILE  52   5.328  -0.144   9.682
  375   HD11  ILE  52          3HD1      ILE  52   5.889   0.547   6.429
  376   HD12  ILE  52          1HD1      ILE  52   6.787   1.991   6.894
  377   HD13  ILE  52          2HD1      ILE  52   5.693   1.223   8.046
  378    H    ARG  53           H        ARG  53   9.202  -0.072  11.592
  379    HA   ARG  53           HA       ARG  53   7.595  -1.023  13.639
  380    HB2  ARG  53           2HB      ARG  53  10.066  -1.518  13.128
  381    HB3  ARG  53           1HB      ARG  53  10.420  -0.102  14.106
  382    HG2  ARG  53           2HG      ARG  53   8.810  -2.440  15.096
  383    HG3  ARG  53           1HG      ARG  53  10.557  -2.293  15.305
  384    HD2  ARG  53           2HD      ARG  53   9.747   0.114  16.222
  385    HD3  ARG  53           1HD      ARG  53   8.354  -0.876  16.657
  386    HE   ARG  53           HE       ARG  53   9.630  -1.924  18.246
  387   HH11  ARG  53          1HH1      ARG  53  11.723  -0.126  16.109
  388   HH12  ARG  53          2HH1      ARG  53  13.132  -0.361  17.087
  389   HH21  ARG  53          1HH2      ARG  53  11.482  -2.235  19.534
  390   HH22  ARG  53          2HH2      ARG  53  12.997  -1.559  19.032
  391    H    ASP  54           H        ASP  54   9.089   2.135  13.251
  392    HA   ASP  54           HA       ASP  54   7.818   3.000  15.762
  393    HB2  ASP  54           2HB      ASP  54  10.113   4.306  14.289
  394    HB3  ASP  54           1HB      ASP  54   9.455   4.802  15.845
  395    H    GLY  55           H        GLY  55   6.861   2.859  12.787
  396    HA2  GLY  55           2HA      GLY  55   5.870   5.643  12.724
  397    HA3  GLY  55           1HA      GLY  55   6.282   4.753  11.268
  398    H    LEU  56           H        LEU  56   4.904   3.118  10.524
  399    HA   LEU  56           HA       LEU  56   2.160   3.388  11.507
  400    HB2  LEU  56           2HB      LEU  56   3.083   2.006   8.992
  401    HB3  LEU  56           1HB      LEU  56   1.453   2.516   9.394
  402    HG   LEU  56           HG       LEU  56   2.531   4.911   9.445
  403   HD11  LEU  56          1HD1      LEU  56   4.763   4.686   9.088
  404   HD12  LEU  56          2HD1      LEU  56   4.231   4.804   7.411
  405   HD13  LEU  56          3HD1      LEU  56   4.576   3.225   8.118
  406   HD21  LEU  56          3HD2      LEU  56   0.799   3.915   7.868
  407   HD22  LEU  56          1HD2      LEU  56   2.142   3.608   6.767
  408   HD23  LEU  56          2HD2      LEU  56   1.761   5.261   7.254
  409    HA   PRO  57           HA       PRO  57   2.322  -0.677  13.260
  410    HB2  PRO  57           2HB      PRO  57  -0.292  -1.097  13.690
  411    HB3  PRO  57           1HB      PRO  57   0.612   0.119  14.602
  412    HG2  PRO  57           2HG      PRO  57  -1.216   0.478  12.260
  413    HG3  PRO  57           1HG      PRO  57  -1.084   1.451  13.736
  414    HD2  PRO  57           2HD      PRO  57   0.064   2.133  11.335
  415    HD3  PRO  57           1HD      PRO  57   0.670   2.672  12.914
  416    H    MET  58           H        MET  58   2.857  -0.991  10.677
  417    HA   MET  58           HA       MET  58   0.825  -2.603   9.378
  418    HB2  MET  58           2HB      MET  58   2.559  -0.949   8.295
  419    HB3  MET  58           1HB      MET  58   3.635  -2.335   8.371
  420    HG2  MET  58           2HG      MET  58   2.348  -3.572   6.879
  421    HG3  MET  58           1HG      MET  58   0.929  -2.549   7.109
  422    HE1  MET  58           3HE      MET  58   3.086  -3.678   4.647
  423    HE2  MET  58           1HE      MET  58   3.004  -2.413   3.421
  424    HE3  MET  58           2HE      MET  58   1.519  -3.121   4.059
  425    H    THR  59           H        THR  59   0.815  -4.792   9.219
  426    HA   THR  59           HA       THR  59   2.575  -6.268  10.976
  427    HB   THR  59           HB       THR  59   1.178  -8.227   9.867
  428    HG1  THR  59           1HG      THR  59  -0.623  -6.077   9.548
  429   HG21  THR  59          3HG2      THR  59   0.778  -7.969  12.110
  430   HG22  THR  59          1HG2      THR  59  -0.790  -7.552  11.419
  431   HG23  THR  59          2HG2      THR  59   0.310  -6.276  11.943
  432    H    GLU  60           H        GLU  60   4.100  -7.752  10.408
  433    HA   GLU  60           HA       GLU  60   5.762  -7.371   8.313
  434    HB2  GLU  60           2HB      GLU  60   6.875  -9.119   9.185
  435    HB3  GLU  60           1HB      GLU  60   5.579  -9.183  10.365
  436    HG2  GLU  60           2HG      GLU  60   4.456 -10.896   9.147
  437    HG3  GLU  60           1HG      GLU  60   5.588 -10.752   7.802
  438    H    ALA  61           H        ALA  61   3.155  -9.748   8.354
  439    HA   ALA  61           HA       ALA  61   3.358 -10.870   5.890
  440    HB1  ALA  61           1HB      ALA  61   0.849 -11.063   5.939
  441    HB2  ALA  61           2HB      ALA  61   0.891 -10.093   7.413
  442    HB3  ALA  61           3HB      ALA  61   1.697 -11.661   7.366
  443    H    GLU  62           H        GLU  62   2.373  -7.606   6.591
  444    HA   GLU  62           HA       GLU  62   1.439  -7.193   3.865
  445    HB2  GLU  62           2HB      GLU  62   1.701  -4.794   5.513
  446    HB3  GLU  62           1HB      GLU  62   0.311  -5.404   4.634
  447    HG2  GLU  62           2HG      GLU  62   0.411  -7.143   6.704
  448    HG3  GLU  62           1HG      GLU  62   1.040  -5.678   7.455
  449    H    ILE  63           H        ILE  63   3.930  -5.867   6.038
  450    HA   ILE  63           HA       ILE  63   5.226  -4.406   3.936
  451    HB   ILE  63           HB       ILE  63   6.642  -5.160   6.467
  452   HG12  ILE  63          2HG1      ILE  63   5.499  -2.797   7.140
  453   HG13  ILE  63          1HG1      ILE  63   4.197  -3.521   6.205
  454   HG21  ILE  63          1HG2      ILE  63   7.637  -3.828   4.509
  455   HG22  ILE  63          2HG2      ILE  63   7.844  -3.192   6.140
  456   HG23  ILE  63          3HG2      ILE  63   6.616  -2.505   5.077
  457   HD11  ILE  63          3HD1      ILE  63   3.614  -4.552   8.067
  458   HD12  ILE  63          1HD1      ILE  63   5.127  -4.132   8.869
  459   HD13  ILE  63          2HD1      ILE  63   5.037  -5.567   7.845
  460    H    THR  64           H        THR  64   5.881  -7.458   5.604
  461    HA   THR  64           HA       THR  64   8.321  -8.018   4.296
  462    HB   THR  64           HB       THR  64   6.270  -9.802   5.593
  463    HG1  THR  64           1HG      THR  64   7.409  -8.458   7.005
  464   HG21  THR  64          3HG2      THR  64   9.022 -10.586   4.681
  465   HG22  THR  64          1HG2      THR  64   7.499 -11.144   3.988
  466   HG23  THR  64          2HG2      THR  64   7.922 -11.572   5.648
  467    H    GLU  65           H        GLU  65   4.976  -9.011   3.651
  468    HA   GLU  65           HA       GLU  65   5.594 -10.487   1.333
  469    HB2  GLU  65           2HB      GLU  65   3.466 -10.690   2.654
  470    HB3  GLU  65           1HB      GLU  65   2.968  -9.158   1.949
  471    HG2  GLU  65           2HG      GLU  65   2.469 -10.082  -0.040
  472    HG3  GLU  65           1HG      GLU  65   3.812 -11.222   0.031
  473    H    PHE  66           H        PHE  66   5.459  -7.257   1.978
  474    HA   PHE  66           HA       PHE  66   5.126  -6.495  -0.806
  475    HB2  PHE  66           2HB      PHE  66   4.869  -5.051   1.773
  476    HB3  PHE  66           1HB      PHE  66   5.492  -4.119   0.419
  477    HD1  PHE  66           2HD      PHE  66   3.937  -5.362  -1.806
  478    HD2  PHE  66           1HD      PHE  66   2.754  -4.122   2.090
  479    HE1  PHE  66           2HE      PHE  66   1.644  -5.005  -2.620
  480    HE2  PHE  66           1HE      PHE  66   0.459  -3.765   1.282
  481    HZ   PHE  66           HZ       PHE  66  -0.099  -4.206  -1.076
  482    H    PHE  67           H        PHE  67   7.490  -6.801   1.698
  483    HA   PHE  67           HA       PHE  67   9.510  -5.156   0.576
  484    HB2  PHE  67           2HB      PHE  67   9.400  -7.295   2.653
  485    HB3  PHE  67           1HB      PHE  67  10.975  -6.834   2.020
  486    HD1  PHE  67           1HD      PHE  67  10.336  -3.865   1.626
  487    HD2  PHE  67           2HD      PHE  67   9.670  -6.553   4.861
  488    HE1  PHE  67           1HE      PHE  67  10.400  -1.980   3.207
  489    HE2  PHE  67           2HE      PHE  67   9.734  -4.671   6.444
  490    HZ   PHE  67           HZ       PHE  67  10.098  -2.383   5.616
  491    H    GLU  68           H        GLU  68   8.896  -8.648   0.425
  492    HA   GLU  68           HA       GLU  68  11.099  -9.129  -1.349
  493    HB2  GLU  68           2HB      GLU  68  10.012 -11.415  -1.555
  494    HB3  GLU  68           1HB      GLU  68  10.518 -10.937   0.059
  495    HG2  GLU  68           2HG      GLU  68   8.438 -11.001   0.858
  496    HG3  GLU  68           1HG      GLU  68   7.768 -10.195  -0.560
  497    H    ALA  69           H        ALA  69   7.735  -8.345  -1.697
  498    HA   ALA  69           HA       ALA  69   7.505  -9.197  -4.407
  499    HB1  ALA  69           1HB      ALA  69   5.347  -8.105  -4.385
  500    HB2  ALA  69           2HB      ALA  69   5.775  -7.278  -2.886
  501    HB3  ALA  69           3HB      ALA  69   5.567  -9.030  -2.898
  502    H    ALA  70           H        ALA  70   8.969  -6.658  -2.964
  503    HA   ALA  70           HA       ALA  70   8.674  -4.820  -5.217
  504    HB1  ALA  70           1HB      ALA  70   8.503  -3.547  -3.321
  505    HB2  ALA  70           2HB      ALA  70  10.232  -3.409  -3.635
  506    HB3  ALA  70           3HB      ALA  70   9.645  -4.540  -2.416
  507    H    ASP  71           H        ASP  71  11.040  -6.866  -3.644
  508    HA   ASP  71           HA       ASP  71  12.967  -6.187  -5.767
  509    HB2  ASP  71           2HB      ASP  71  13.463  -5.667  -3.221
  510    HB3  ASP  71           1HB      ASP  71  13.879  -7.378  -3.182
  511    HA   PRO  72           HA       PRO  72  12.239 -10.472  -6.887
  512    HB2  PRO  72           2HB      PRO  72  14.094 -10.578  -8.885
  513    HB3  PRO  72           1HB      PRO  72  12.491  -9.859  -9.082
  514    HG2  PRO  72           2HG      PRO  72  15.115  -8.521  -8.551
  515    HG3  PRO  72           1HG      PRO  72  13.822  -8.047  -9.668
  516    HD2  PRO  72           2HD      PRO  72  14.144  -6.866  -7.266
  517    HD3  PRO  72           1HD      PRO  72  12.541  -7.113  -7.988
  518    H    ASN  73           H        ASN  73  15.354  -9.059  -6.120
  519    HA   ASN  73           HA       ASN  73  16.639 -11.631  -5.793
  520    HB2  ASN  73           2HB      ASN  73  17.689  -8.913  -4.998
  521    HB3  ASN  73           1HB      ASN  73  18.623 -10.385  -5.243
  522   HD21  ASN  73          1HD2      ASN  73  18.837  -7.753  -6.508
  523   HD22  ASN  73          2HD2      ASN  73  18.696  -8.035  -8.208
  524    H    ASN  74           H        ASN  74  15.161  -9.170  -3.804
  525    HA   ASN  74           HA       ASN  74  14.453  -9.198  -1.642
  526    HB2  ASN  74           2HB      ASN  74  15.484 -12.026  -1.407
  527    HB3  ASN  74           1HB      ASN  74  14.234 -11.244  -0.442
  528   HD21  ASN  74          1HD2      ASN  74  12.198 -11.544  -1.013
  529   HD22  ASN  74          2HD2      ASN  74  11.657 -12.187  -2.521
  530    H    THR  75           H        THR  75  16.936  -8.193  -2.349
  531    HA   THR  75           HA       THR  75  18.816  -9.064  -0.318
  532    HB   THR  75           HB       THR  75  19.860  -8.623  -2.382
  533    HG1  THR  75           1HG      THR  75  21.085  -7.707  -0.788
  534   HG21  THR  75          3HG2      THR  75  18.249  -6.102  -2.471
  535   HG22  THR  75          1HG2      THR  75  18.313  -7.416  -3.646
  536   HG23  THR  75          2HG2      THR  75  19.695  -6.335  -3.456
  537    H    GLY  76           H        GLY  76  16.454  -8.013   0.727
  538    HA2  GLY  76           2HA      GLY  76  15.639  -6.446   2.185
  539    HA3  GLY  76           1HA      GLY  76  17.317  -6.284   2.681
  540    H    PHE  77           H        PHE  77  16.364  -5.509  -0.573
  541    HA   PHE  77           HA       PHE  77  16.542  -2.644   0.085
  542    HB2  PHE  77           2HB      PHE  77  17.649  -3.968  -2.402
  543    HB3  PHE  77           1HB      PHE  77  17.754  -2.259  -1.994
  544    HD1  PHE  77           1HD      PHE  77  18.454  -2.486   0.899
  545    HD2  PHE  77           2HD      PHE  77  19.893  -4.590  -2.509
  546    HE1  PHE  77           1HE      PHE  77  20.587  -2.894   2.057
  547    HE2  PHE  77           2HE      PHE  77  22.027  -5.003  -1.358
  548    HZ   PHE  77           HZ       PHE  77  22.376  -4.154   0.928
  549    H    ILE  78           H        ILE  78  15.288  -1.228  -1.165
  550    HA   ILE  78           HA       ILE  78  13.236  -2.517  -2.850
  551    HB   ILE  78           HB       ILE  78  12.823  -0.266  -0.875
  552   HG12  ILE  78          2HG1      ILE  78  11.712  -3.072  -0.970
  553   HG13  ILE  78          1HG1      ILE  78  12.869  -2.446   0.207
  554   HG21  ILE  78          1HG2      ILE  78  10.864  -1.500  -2.808
  555   HG22  ILE  78          2HG2      ILE  78  11.521   0.135  -2.892
  556   HG23  ILE  78          3HG2      ILE  78  10.467  -0.323  -1.557
  557   HD11  ILE  78          3HD1      ILE  78  11.209  -1.741   1.484
  558   HD12  ILE  78          1HD1      ILE  78  10.059  -2.437   0.341
  559   HD13  ILE  78          2HD1      ILE  78  10.573  -0.757   0.162
  560    H    ASP  79           H        ASP  79  12.338  -1.244  -4.493
  561    HA   ASP  79           HA       ASP  79  14.081   0.929  -5.414
  562    HB2  ASP  79           2HB      ASP  79  12.369  -1.089  -6.754
  563    HB3  ASP  79           1HB      ASP  79  12.348   0.518  -7.471
  564    H    TYR  80           H        TYR  80  13.355   2.651  -4.245
  565    HA   TYR  80           HA       TYR  80  11.086   3.388  -3.164
  566    HB2  TYR  80           2HB      TYR  80  13.035   4.879  -3.337
  567    HB3  TYR  80           1HB      TYR  80  12.613   5.238  -5.008
  568    HD1  TYR  80           1HD      TYR  80  11.099   5.351  -1.593
  569    HD2  TYR  80           2HD      TYR  80  11.384   7.146  -5.440
  570    HE1  TYR  80           1HE      TYR  80   9.671   7.203  -0.830
  571    HE2  TYR  80           2HE      TYR  80   9.958   9.001  -4.686
  572    HH   TYR  80           HH       TYR  80   9.411  10.078  -2.362
  573    H    LYS  81           H        LYS  81  11.539   3.490  -6.680
  574    HA   LYS  81           HA       LYS  81   9.002   4.641  -7.233
  575    HB2  LYS  81           2HB      LYS  81  10.927   3.060  -8.941
  576    HB3  LYS  81           1HB      LYS  81   9.428   3.736  -9.564
  577    HG2  LYS  81           2HG      LYS  81  11.505   5.427  -8.210
  578    HG3  LYS  81           1HG      LYS  81  11.544   5.077  -9.941
  579    HD2  LYS  81           2HD      LYS  81   8.952   6.015  -8.915
  580    HD3  LYS  81           1HD      LYS  81  10.261   7.195  -8.831
  581    HE2  LYS  81           2HE      LYS  81   9.243   5.746 -11.267
  582    HE3  LYS  81           1HE      LYS  81   9.150   7.473 -10.928
  583    HZ1  LYS  81           3HZ      LYS  81  10.965   7.474 -12.252
  584    HZ2  LYS  81           1HZ      LYS  81  11.403   5.885 -11.876
  585    HZ3  LYS  81           2HZ      LYS  81  11.762   7.138 -10.799
  586    H    ALA  82           H        ALA  82  10.186   1.284  -7.517
  587    HA   ALA  82           HA       ALA  82   7.806   0.069  -8.248
  588    HB1  ALA  82           1HB      ALA  82  10.338  -0.800  -7.596
  589    HB2  ALA  82           2HB      ALA  82   8.976  -1.828  -8.043
  590    HB3  ALA  82           3HB      ALA  82   9.331  -1.526  -6.342
  591    H    PHE  83           H        PHE  83   8.801   1.348  -5.187
  592    HA   PHE  83           HA       PHE  83   6.612   0.073  -3.755
  593    HB2  PHE  83           2HB      PHE  83   9.172   1.040  -3.041
  594    HB3  PHE  83           1HB      PHE  83   7.999   2.039  -2.188
  595    HD1  PHE  83           2HD      PHE  83   8.486  -1.564  -3.015
  596    HD2  PHE  83           1HD      PHE  83   7.415   1.331  -0.088
  597    HE1  PHE  83           2HE      PHE  83   8.183  -3.356  -1.364
  598    HE2  PHE  83           1HE      PHE  83   7.109  -0.458   1.574
  599    HZ   PHE  83           HZ       PHE  83   7.492  -2.806   0.937
  600    H    ALA  84           H        ALA  84   7.589   3.226  -4.958
  601    HA   ALA  84           HA       ALA  84   5.448   4.650  -3.689
  602    HB1  ALA  84           1HB      ALA  84   7.084   5.588  -6.033
  603    HB2  ALA  84           2HB      ALA  84   7.665   5.636  -4.367
  604    HB3  ALA  84           3HB      ALA  84   6.241   6.568  -4.832
  605    H    ALA  85           H        ALA  85   5.905   3.014  -6.732
  606    HA   ALA  85           HA       ALA  85   3.676   4.192  -8.046
  607    HB1  ALA  85           1HB      ALA  85   5.485   3.311  -9.364
  608    HB2  ALA  85           2HB      ALA  85   4.012   2.411  -9.727
  609    HB3  ALA  85           3HB      ALA  85   5.236   1.709  -8.669
  610    H    MET  86           H        MET  86   3.940   1.967  -5.668
  611    HA   MET  86           HA       MET  86   1.617   0.381  -6.333
  612    HB2  MET  86           2HB      MET  86   3.449   0.456  -3.943
  613    HB3  MET  86           1HB      MET  86   2.005  -0.548  -3.988
  614    HG2  MET  86           2HG      MET  86   4.054  -0.731  -6.156
  615    HG3  MET  86           1HG      MET  86   4.280  -1.576  -4.625
  616    HE1  MET  86           3HE      MET  86   3.903  -4.208  -5.007
  617    HE2  MET  86           1HE      MET  86   2.196  -4.599  -4.797
  618    HE3  MET  86           2HE      MET  86   2.965  -3.412  -3.742
  619    H    LEU  87           H        LEU  87   2.390   3.170  -4.397
  620    HA   LEU  87           HA       LEU  87  -0.277   3.171  -3.236
  621    HB2  LEU  87           2HB      LEU  87   2.091   4.899  -2.636
  622    HB3  LEU  87           1HB      LEU  87   0.567   4.953  -1.770
  623    HG   LEU  87           HG       LEU  87   1.958   2.334  -1.850
  624   HD11  LEU  87          1HD1      LEU  87   3.316   3.071   0.154
  625   HD12  LEU  87          2HD1      LEU  87   2.987   4.727  -0.354
  626   HD13  LEU  87          3HD1      LEU  87   3.872   3.637  -1.420
  627   HD21  LEU  87          3HD2      LEU  87   0.836   1.953   0.105
  628   HD22  LEU  87          1HD2      LEU  87  -0.257   3.113  -0.648
  629   HD23  LEU  87          2HD2      LEU  87   0.879   3.648   0.590
  630    H    TYR  88           H        TYR  88   1.280   4.342  -5.760
  631    HA   TYR  88           HA       TYR  88  -0.600   6.573  -6.104
  632    HB2  TYR  88           2HB      TYR  88   2.204   6.532  -7.220
  633    HB3  TYR  88           1HB      TYR  88   1.068   7.878  -7.235
  634    HD1  TYR  88           2HD      TYR  88   0.086   7.809  -4.441
  635    HD2  TYR  88           1HD      TYR  88   4.018   7.340  -5.994
  636    HE1  TYR  88           2HE      TYR  88   1.016   8.621  -2.315
  637    HE2  TYR  88           1HE      TYR  88   4.960   8.148  -3.871
  638    HH   TYR  88           HH       TYR  88   4.329   9.445  -1.952
  639    H    SER  89           H        SER  89  -0.557   3.689  -6.987
  640    HA   SER  89           HA       SER  89  -0.935   2.418  -8.850
  641    HB2  SER  89           2HB      SER  89  -2.514   4.923  -9.161
  642    HB3  SER  89           1HB      SER  89  -2.436   3.835 -10.546
  643    HG   SER  89           HG       SER  89  -3.437   2.281  -9.402
  644    H    VAL  90           H        VAL  90   1.571   3.857  -8.914
  645    HA   VAL  90           HA       VAL  90   3.310   4.153 -10.357
  646    HB   VAL  90           HB       VAL  90   1.487   3.260 -12.588
  647   HG11  VAL  90          1HG1      VAL  90   4.038   4.218 -12.682
  648   HG12  VAL  90          2HG1      VAL  90   3.316   3.139 -13.877
  649   HG13  VAL  90          3HG1      VAL  90   4.308   2.477 -12.578
  650   HG21  VAL  90          3HG2      VAL  90   3.158   1.149 -11.621
  651   HG22  VAL  90          1HG2      VAL  90   1.400   1.202 -11.757
  652   HG23  VAL  90          2HG2      VAL  90   2.188   1.782 -10.290
  653    H    ASP  91           H        ASP  91   1.574   6.312  -9.737
  654    HA   ASP  91           HA       ASP  91   1.180   8.471 -10.326
  655    HB2  ASP  91           2HB      ASP  91   3.656   7.946 -11.259
  656    HB3  ASP  91           1HB      ASP  91   2.848   8.341 -12.773
  657    H    GLU  92           H        GLU  92  -0.804   8.883 -11.033
  658    HA   GLU  92           HA       GLU  92  -1.479   8.146 -13.806
  659    HB2  GLU  92           2HB      GLU  92  -2.677   7.064 -11.656
  660    HB3  GLU  92           1HB      GLU  92  -3.673   8.500 -11.842
  661    HG2  GLU  92           2HG      GLU  92  -4.638   7.756 -13.734
  662    HG3  GLU  92           1HG      GLU  92  -3.167   6.967 -14.302
  663    H    SER  93           H        SER  93  -3.242   9.518 -14.742
  664    HA   SER  93           HA       SER  93  -3.921  12.027 -13.687
  665    HB2  SER  93           2HB      SER  93  -1.567  12.587 -13.956
  666    HB3  SER  93           1HB      SER  93  -1.608  12.063 -15.640
  667    HG   SER  93           HG       SER  93  -2.174  14.030 -16.068
  Start of MODEL   19
    1    H1   MET   1           1HT      MET   1 -43.365  -6.349  16.886
    2    H2   MET   1           2HT      MET   1 -43.345  -4.921  15.932
    3    H3   MET   1           3HT      MET   1 -44.784  -5.398  16.736
    4    HA   MET   1           HA       MET   1 -43.652  -3.574  17.820
    5    HB2  MET   1           2HB      MET   1 -45.110  -5.201  19.000
    6    HB3  MET   1           1HB      MET   1 -43.693  -6.178  19.361
    7    HG2  MET   1           2HG      MET   1 -42.853  -4.637  20.871
    8    HG3  MET   1           1HG      MET   1 -43.815  -3.316  20.210
    9    HE1  MET   1           2HE      MET   1 -44.773  -6.937  21.088
   10    HE2  MET   1           3HE      MET   1 -45.683  -6.788  22.591
   11    HE3  MET   1           1HE      MET   1 -43.935  -6.554  22.591
   12    H    GLY   2           H        GLY   2 -41.599  -3.054  16.956
   13    HA2  GLY   2           2HA      GLY   2 -39.429  -3.090  18.524
   14    HA3  GLY   2           1HA      GLY   2 -39.304  -4.655  17.736
   15    H    SER   3           H        SER   3 -39.246  -1.186  17.261
   16    HA   SER   3           HA       SER   3 -38.413  -1.503  14.483
   17    HB2  SER   3           2HB      SER   3 -40.065   0.257  15.079
   18    HB3  SER   3           1HB      SER   3 -38.838   1.036  16.077
   19    HG   SER   3           HG       SER   3 -39.145   1.027  13.345
   20    H    SER   4           H        SER   4 -36.460  -0.565  13.683
   21    HA   SER   4           HA       SER   4 -34.452   0.449  15.431
   22    HB2  SER   4           2HB      SER   4 -32.842  -1.475  15.027
   23    HB3  SER   4           1HB      SER   4 -34.154  -1.803  16.158
   24    HG   SER   4           HG       SER   4 -34.509  -3.451  14.903
   25    H    HIS   5           H        HIS   5 -34.450  -1.592  12.502
   26    HA   HIS   5           HA       HIS   5 -32.761   0.367  11.165
   27    HB2  HIS   5           2HB      HIS   5 -33.479  -2.485  10.709
   28    HB3  HIS   5           1HB      HIS   5 -33.055  -1.523   9.296
   29    HD1  HIS   5           1HD      HIS   5 -31.591  -2.542  12.642
   30    HD2  HIS   5           2HD      HIS   5 -30.377  -1.223   8.894
   31    HE1  HIS   5           1HE      HIS   5 -29.081  -2.704  12.654
   32    HE2  HIS   5           2HE      HIS   5 -28.375  -1.984  10.346
   33    H    HIS   6           H        HIS   6 -33.321   1.492   9.331
   34    HA   HIS   6           HA       HIS   6 -36.202   1.626   8.784
   35    HB2  HIS   6           2HB      HIS   6 -33.966   3.583   8.667
   36    HB3  HIS   6           1HB      HIS   6 -35.260   3.773   7.488
   37    HD1  HIS   6           1HD      HIS   6 -36.579   5.688   8.360
   38    HD2  HIS   6           2HD      HIS   6 -35.675   2.929  11.333
   39    HE1  HIS   6           1HE      HIS   6 -37.816   6.473  10.404
   40    HE2  HIS   6           2HE      HIS   6 -37.184   4.836  12.213
   41    H    HIS   7           H        HIS   7 -36.120  -0.301   7.462
   42    HA   HIS   7           HA       HIS   7 -34.651  -0.112   4.954
   43    HB2  HIS   7           2HB      HIS   7 -34.859  -2.248   6.352
   44    HB3  HIS   7           1HB      HIS   7 -36.518  -2.335   5.765
   45    HD1  HIS   7           1HD      HIS   7 -32.972  -2.748   4.667
   46    HD2  HIS   7           2HD      HIS   7 -36.795  -3.052   3.067
   47    HE1  HIS   7           1HE      HIS   7 -32.684  -3.899   2.450
   48    HE2  HIS   7           2HE      HIS   7 -35.020  -4.152   1.541
   49    H    HIS   8           H        HIS   8 -38.009  -1.007   5.768
   50    HA   HIS   8           HA       HIS   8 -39.988  -0.584   4.731
   51    HB2  HIS   8           2HB      HIS   8 -38.815   1.837   5.035
   52    HB3  HIS   8           1HB      HIS   8 -39.007   1.802   3.286
   53    HD1  HIS   8           1HD      HIS   8 -40.615   3.894   4.539
   54    HD2  HIS   8           2HD      HIS   8 -41.998  -0.017   4.309
   55    HE1  HIS   8           1HE      HIS   8 -43.116   4.052   4.755
   56    HE2  HIS   8           2HE      HIS   8 -43.937   1.681   4.523
   57    H    HIS   9           H        HIS   9 -40.732   0.391   2.310
   58    HA   HIS   9           HA       HIS   9 -39.156  -1.127   0.347
   59    HB2  HIS   9           2HB      HIS   9 -41.471  -2.111   1.315
   60    HB3  HIS   9           1HB      HIS   9 -42.101  -1.119   0.003
   61    HD1  HIS   9           1HD      HIS   9 -39.368  -1.813  -1.722
   62    HD2  HIS   9           2HD      HIS   9 -42.215  -4.413  -0.172
   63    HE1  HIS   9           1HE      HIS   9 -39.195  -3.904  -3.109
   64    HE2  HIS   9           2HE      HIS   9 -40.986  -5.430  -2.208
   65    H    HIS  10           H        HIS  10 -41.959   1.068   0.596
   66    HA   HIS  10           HA       HIS  10 -40.966   2.464  -1.796
   67    HB2  HIS  10           2HB      HIS  10 -43.740   2.254  -0.620
   68    HB3  HIS  10           1HB      HIS  10 -43.324   3.379  -1.910
   69    HD1  HIS  10           1HD      HIS  10 -43.193   2.461  -4.260
   70    HD2  HIS  10           2HD      HIS  10 -43.621  -0.506  -1.382
   71    HE1  HIS  10           1HE      HIS  10 -43.641   0.342  -5.539
   72    HE2  HIS  10           2HE      HIS  10 -43.983  -1.422  -3.773
   73    H    SER  11           H        SER  11 -39.435   3.648  -0.494
   74    HA   SER  11           HA       SER  11 -40.344   6.205   0.233
   75    HB2  SER  11           2HB      SER  11 -41.233   5.105   2.224
   76    HB3  SER  11           1HB      SER  11 -39.653   4.398   2.563
   77    HG   SER  11           HG       SER  11 -40.229   6.392   3.730
   78    H    SER  12           H        SER  12 -37.857   4.131   1.717
   79    HA   SER  12           HA       SER  12 -35.825   6.100   1.185
   80    HB2  SER  12           2HB      SER  12 -35.793   4.779   3.264
   81    HB3  SER  12           1HB      SER  12 -35.578   3.304   2.322
   82    HG   SER  12           HG       SER  12 -33.542   3.806   1.974
   83    H    GLY  13           H        GLY  13 -33.665   5.276   0.267
   84    HA2  GLY  13           2HA      GLY  13 -33.451   3.168  -1.517
   85    HA3  GLY  13           1HA      GLY  13 -34.120   4.510  -2.434
   86    H    LEU  14           H        LEU  14 -31.388   3.537  -0.411
   87    HA   LEU  14           HA       LEU  14 -29.622   5.113  -2.102
   88    HB2  LEU  14           2HB      LEU  14 -28.486   6.094  -0.106
   89    HB3  LEU  14           1HB      LEU  14 -30.094   6.722  -0.414
   90    HG   LEU  14           HG       LEU  14 -29.771   4.477   1.531
   91   HD11  LEU  14          1HD1      LEU  14 -29.117   7.370   2.054
   92   HD12  LEU  14          2HD1      LEU  14 -28.082   5.963   2.303
   93   HD13  LEU  14          3HD1      LEU  14 -29.500   6.205   3.323
   94   HD21  LEU  14          3HD2      LEU  14 -31.738   6.599   0.891
   95   HD22  LEU  14          1HD2      LEU  14 -31.587   6.114   2.581
   96   HD23  LEU  14          2HD2      LEU  14 -31.992   4.916   1.351
   97    H    VAL  15           H        VAL  15 -29.851   2.395  -2.085
   98    HA   VAL  15           HA       VAL  15 -27.930   1.213  -0.306
   99    HB   VAL  15           HB       VAL  15 -29.880  -0.061  -1.124
  100   HG11  VAL  15          1HG1      VAL  15 -29.682  -1.042  -3.447
  101   HG12  VAL  15          2HG1      VAL  15 -28.488   0.214  -3.774
  102   HG13  VAL  15          3HG1      VAL  15 -30.143   0.659  -3.357
  103   HG21  VAL  15          3HG2      VAL  15 -27.386  -1.408  -2.107
  104   HG22  VAL  15          1HG2      VAL  15 -28.770  -2.112  -1.271
  105   HG23  VAL  15          2HG2      VAL  15 -27.643  -1.076  -0.394
  106    HA   PRO  16           HA       PRO  16 -25.554   1.310  -4.691
  107    HB2  PRO  16           2HB      PRO  16 -25.897   4.262  -4.911
  108    HB3  PRO  16           1HB      PRO  16 -25.789   3.043  -6.187
  109    HG2  PRO  16           2HG      PRO  16 -28.131   4.133  -5.560
  110    HG3  PRO  16           1HG      PRO  16 -28.010   2.406  -5.948
  111    HD2  PRO  16           2HD      PRO  16 -28.309   3.739  -3.292
  112    HD3  PRO  16           1HD      PRO  16 -29.012   2.219  -3.879
  113    H    ARG  17           H        ARG  17 -25.646   4.170  -2.561
  114    HA   ARG  17           HA       ARG  17 -22.870   4.602  -2.513
  115    HB2  ARG  17           2HB      ARG  17 -24.573   6.268  -1.815
  116    HB3  ARG  17           1HB      ARG  17 -24.888   5.307  -0.376
  117    HG2  ARG  17           2HG      ARG  17 -23.460   6.992   0.354
  118    HG3  ARG  17           1HG      ARG  17 -22.404   5.594   0.142
  119    HD2  ARG  17           2HD      ARG  17 -21.134   7.083  -0.986
  120    HD3  ARG  17           1HD      ARG  17 -22.224   6.675  -2.310
  121    HE   ARG  17           HE       ARG  17 -23.115   8.782  -2.185
  122   HH11  ARG  17          1HH1      ARG  17 -21.229   8.175   0.687
  123   HH12  ARG  17          2HH1      ARG  17 -21.327   9.810   1.249
  124   HH21  ARG  17          1HH2      ARG  17 -23.246  10.933  -1.447
  125   HH22  ARG  17          2HH2      ARG  17 -22.473  11.376   0.037
  126    H    GLY  18           H        GLY  18 -21.258   3.938  -1.143
  127    HA2  GLY  18           2HA      GLY  18 -20.496   2.909   0.896
  128    HA3  GLY  18           1HA      GLY  18 -21.974   1.962   0.920
  129    H    SER  19           H        SER  19 -18.827   2.336  -0.576
  130    HA   SER  19           HA       SER  19 -18.409  -0.427  -0.832
  131    HB2  SER  19           2HB      SER  19 -18.300  -0.171  -3.507
  132    HB3  SER  19           1HB      SER  19 -19.735  -0.754  -2.664
  133    HG   SER  19           HG       SER  19 -20.343   0.876  -4.068
  134    H    HIS  20           H        HIS  20 -16.548  -0.746  -2.652
  135    HA   HIS  20           HA       HIS  20 -14.369  -0.357  -3.165
  136    HB2  HIS  20           2HB      HIS  20 -15.300   2.514  -2.993
  137    HB3  HIS  20           1HB      HIS  20 -13.709   2.033  -3.571
  138    HD1  HIS  20           1HD      HIS  20 -15.955  -0.453  -4.762
  139    HD2  HIS  20           2HD      HIS  20 -15.029   3.432  -5.913
  140    HE1  HIS  20           1HE      HIS  20 -16.740  -0.250  -7.142
  141    HE2  HIS  20           2HE      HIS  20 -16.248   2.134  -7.789
  142    H    MET  21           H        MET  21 -12.932  -0.961  -1.692
  143    HA   MET  21           HA       MET  21 -12.710   0.598   0.794
  144    HB2  MET  21           2HB      MET  21 -12.310  -2.282   0.136
  145    HB3  MET  21           1HB      MET  21 -11.325  -1.584   1.413
  146    HG2  MET  21           2HG      MET  21 -14.333  -1.559   1.316
  147    HG3  MET  21           1HG      MET  21 -13.344  -2.661   2.274
  148    HE1  MET  21           3HE      MET  21 -15.097   0.327   1.773
  149    HE2  MET  21           1HE      MET  21 -14.015   1.629   2.267
  150    HE3  MET  21           2HE      MET  21 -15.219   1.006   3.396
  151    H    SER  22           H        SER  22 -11.429   2.185  -0.390
  152    HA   SER  22           HA       SER  22  -8.727   1.287  -1.050
  153    HB2  SER  22           2HB      SER  22  -9.462   4.102  -1.571
  154    HB3  SER  22           1HB      SER  22  -8.591   2.957  -2.591
  155    HG   SER  22           HG       SER  22 -11.332   3.417  -2.360
  156    H    ASP  23           H        ASP  23 -10.201   2.208   1.586
  157    HA   ASP  23           HA       ASP  23  -8.577   4.310   2.572
  158    HB2  ASP  23           2HB      ASP  23 -10.247   2.306   4.065
  159    HB3  ASP  23           1HB      ASP  23  -9.572   3.776   4.763
  160    H    GLU  24           H        GLU  24  -8.066   1.092   2.129
  161    HA   GLU  24           HA       GLU  24  -6.343   0.477   4.256
  162    HB2  GLU  24           2HB      GLU  24  -7.443  -1.169   2.670
  163    HB3  GLU  24           1HB      GLU  24  -6.188  -0.738   1.516
  164    HG2  GLU  24           2HG      GLU  24  -5.041  -2.427   2.397
  165    HG3  GLU  24           1HG      GLU  24  -4.735  -1.338   3.750
  166    H    LYS  25           H        LYS  25  -5.973   2.401   1.605
  167    HA   LYS  25           HA       LYS  25  -3.065   2.273   1.545
  168    HB2  LYS  25           2HB      LYS  25  -4.447   2.448  -0.560
  169    HB3  LYS  25           1HB      LYS  25  -4.873   4.079  -0.065
  170    HG2  LYS  25           2HG      LYS  25  -2.164   4.163   0.113
  171    HG3  LYS  25           1HG      LYS  25  -2.395   3.048  -1.235
  172    HD2  LYS  25           2HD      LYS  25  -2.525   4.934  -2.460
  173    HD3  LYS  25           1HD      LYS  25  -4.183   4.989  -1.859
  174    HE2  LYS  25           2HE      LYS  25  -3.352   7.130  -1.435
  175    HE3  LYS  25           1HE      LYS  25  -3.226   6.304   0.117
  176    HZ1  LYS  25           3HZ      LYS  25  -0.927   6.265  -1.709
  177    HZ2  LYS  25           1HZ      LYS  25  -0.959   6.196  -0.019
  178    HZ3  LYS  25           2HZ      LYS  25  -1.233   7.665  -0.811
  179    H    THR  26           H        THR  26  -5.641   4.247   2.771
  180    HA   THR  26           HA       THR  26  -4.151   6.614   3.186
  181    HB   THR  26           HB       THR  26  -6.155   6.591   5.124
  182    HG1  THR  26           1HG      THR  26  -7.187   4.830   4.392
  183   HG21  THR  26          3HG2      THR  26  -7.253   7.593   2.723
  184   HG22  THR  26          1HG2      THR  26  -5.533   7.998   2.735
  185   HG23  THR  26          2HG2      THR  26  -6.570   8.489   4.079
  186    H    GLN  27           H        GLN  27  -4.484   3.654   4.979
  187    HA   GLN  27           HA       GLN  27  -3.603   4.533   7.493
  188    HB2  GLN  27           2HB      GLN  27  -3.168   1.866   6.130
  189    HB3  GLN  27           1HB      GLN  27  -2.878   2.178   7.836
  190    HG2  GLN  27           2HG      GLN  27  -5.561   2.862   6.824
  191    HG3  GLN  27           1HG      GLN  27  -5.154   1.147   6.882
  192   HE21  GLN  27          1HE2      GLN  27  -6.878   3.159   8.492
  193   HE22  GLN  27          2HE2      GLN  27  -6.533   2.732  10.129
  194    H    LEU  28           H        LEU  28  -1.979   4.091   4.496
  195    HA   LEU  28           HA       LEU  28   0.668   4.098   5.644
  196    HB2  LEU  28           2HB      LEU  28   0.093   2.742   3.645
  197    HB3  LEU  28           1HB      LEU  28  -0.196   4.237   2.774
  198    HG   LEU  28           HG       LEU  28   2.460   4.130   3.990
  199   HD11  LEU  28          1HD1      LEU  28   1.499   1.843   2.420
  200   HD12  LEU  28          2HD1      LEU  28   2.864   1.971   3.528
  201   HD13  LEU  28          3HD1      LEU  28   3.018   2.547   1.868
  202   HD21  LEU  28          3HD2      LEU  28   2.247   4.327   1.095
  203   HD22  LEU  28          1HD2      LEU  28   2.937   5.456   2.260
  204   HD23  LEU  28          2HD2      LEU  28   1.204   5.469   1.941
  205    H    ILE  29           H        ILE  29  -1.592   6.296   4.786
  206    HA   ILE  29           HA       ILE  29  -0.058   8.401   3.746
  207    HB   ILE  29           HB       ILE  29  -2.671   8.464   5.191
  208   HG12  ILE  29          2HG1      ILE  29  -2.455   7.184   3.003
  209   HG13  ILE  29          1HG1      ILE  29  -3.734   8.388   3.102
  210   HG21  ILE  29          1HG2      ILE  29  -1.200  10.640   3.730
  211   HG22  ILE  29          2HG2      ILE  29  -1.878  10.668   5.359
  212   HG23  ILE  29          3HG2      ILE  29  -2.949  10.687   3.957
  213   HD11  ILE  29          3HD1      ILE  29  -1.755   8.130   1.159
  214   HD12  ILE  29          1HD1      ILE  29  -1.358   9.585   2.074
  215   HD13  ILE  29          2HD1      ILE  29  -2.953   9.412   1.331
  216    H    GLU  30           H        GLU  30  -0.259   7.142   6.706
  217    HA   GLU  30           HA       GLU  30   0.299   9.458   8.265
  218    HB2  GLU  30           2HB      GLU  30   0.630   6.571   9.061
  219    HB3  GLU  30           1HB      GLU  30   0.588   7.947  10.153
  220    HG2  GLU  30           2HG      GLU  30  -1.736   7.532   8.362
  221    HG3  GLU  30           1HG      GLU  30  -1.528   6.429   9.721
  222    H    ALA  31           H        ALA  31   2.087   8.032   6.103
  223    HA   ALA  31           HA       ALA  31   4.624   8.068   7.538
  224    HB1  ALA  31           1HB      ALA  31   4.904   6.329   6.154
  225    HB2  ALA  31           2HB      ALA  31   5.277   7.554   4.942
  226    HB3  ALA  31           3HB      ALA  31   3.650   6.883   5.045
  227    H    PHE  32           H        PHE  32   2.804   9.944   5.230
  228    HA   PHE  32           HA       PHE  32   4.818  11.533   4.145
  229    HB2  PHE  32           2HB      PHE  32   1.887  11.889   4.599
  230    HB3  PHE  32           1HB      PHE  32   2.839  13.290   4.112
  231    HD1  PHE  32           1HD      PHE  32   2.176   9.756   3.145
  232    HD2  PHE  32           2HD      PHE  32   3.213  13.682   1.871
  233    HE1  PHE  32           1HE      PHE  32   2.036   9.027   0.798
  234    HE2  PHE  32           2HE      PHE  32   3.074  12.960  -0.477
  235    HZ   PHE  32           HZ       PHE  32   2.485  10.630  -1.015
  236    H    TYR  33           H        TYR  33   3.322  11.613   7.284
  237    HA   TYR  33           HA       TYR  33   4.590  14.174   7.916
  238    HB2  TYR  33           2HB      TYR  33   2.765  12.508   9.658
  239    HB3  TYR  33           1HB      TYR  33   3.246  14.181   9.923
  240    HD1  TYR  33           1HD      TYR  33   1.383  11.991   7.560
  241    HD2  TYR  33           2HD      TYR  33   1.954  15.930   9.064
  242    HE1  TYR  33           1HE      TYR  33  -0.590  12.750   6.304
  243    HE2  TYR  33           2HE      TYR  33  -0.020  16.699   7.813
  244    HH   TYR  33           HH       TYR  33  -2.299  14.696   6.558
  245    H    ASN  34           H        ASN  34   6.291  11.957   7.468
  246    HA   ASN  34           HA       ASN  34   7.930  12.095   9.758
  247    HB2  ASN  34           2HB      ASN  34   6.051  10.448  10.441
  248    HB3  ASN  34           1HB      ASN  34   6.846   9.320   9.347
  249   HD21  ASN  34          1HD2      ASN  34   8.966   8.637   9.816
  250   HD22  ASN  34          2HD2      ASN  34   9.598   8.726  11.421
  251    H    PHE  35           H        PHE  35   8.177  12.474   6.958
  252    HA   PHE  35           HA       PHE  35  10.560  10.959   6.488
  253    HB2  PHE  35           2HB      PHE  35   8.860   9.321   5.767
  254    HB3  PHE  35           1HB      PHE  35   8.210  10.502   4.634
  255    HD1  PHE  35           1HD      PHE  35  11.139   8.404   5.417
  256    HD2  PHE  35           2HD      PHE  35   9.214  10.864   2.527
  257    HE1  PHE  35           1HE      PHE  35  12.724   7.624   3.704
  258    HE2  PHE  35           2HE      PHE  35  10.794  10.088   0.808
  259    HZ   PHE  35           HZ       PHE  35  12.552   8.466   1.396
  260    H    ASP  36           H        ASP  36  11.036  13.324   6.625
  261    HA   ASP  36           HA       ASP  36  11.033  14.450   3.923
  262    HB2  ASP  36           2HB      ASP  36   9.172  15.427   5.436
  263    HB3  ASP  36           1HB      ASP  36  10.490  16.237   6.281
  264    H    GLY  37           H        GLY  37  13.129  13.124   5.178
  265    HA2  GLY  37           2HA      GLY  37  14.913  14.732   6.616
  266    HA3  GLY  37           1HA      GLY  37  15.370  13.356   5.621
  267    H    ASP  38           H        ASP  38  15.206  13.900   3.159
  268    HA   ASP  38           HA       ASP  38  15.750  16.597   2.397
  269    HB2  ASP  38           2HB      ASP  38  18.017  14.718   2.889
  270    HB3  ASP  38           1HB      ASP  38  18.126  15.816   1.516
  271    H    TYR  39           H        TYR  39  13.946  14.606   1.558
  272    HA   TYR  39           HA       TYR  39  13.075  13.696  -0.336
  273    HB2  TYR  39           2HB      TYR  39  14.122  16.046  -1.126
  274    HB3  TYR  39           1HB      TYR  39  15.093  14.957  -2.111
  275    HD1  TYR  39           2HD      TYR  39  11.490  15.158  -1.107
  276    HD2  TYR  39           1HD      TYR  39  14.314  14.744  -4.263
  277    HE1  TYR  39           2HE      TYR  39   9.647  14.993  -2.727
  278    HE2  TYR  39           1HE      TYR  39  12.478  14.579  -5.891
  279    HH   TYR  39           HH       TYR  39   9.546  15.555  -5.464
  280    H    ASP  40           H        ASP  40  13.708  11.583   0.147
  281    HA   ASP  40           HA       ASP  40  16.271  10.625  -0.848
  282    HB2  ASP  40           2HB      ASP  40  14.164   9.575   0.966
  283    HB3  ASP  40           1HB      ASP  40  15.104   8.389   0.065
  284    H    GLY  41           H        GLY  41  16.500   8.986  -2.398
  285    HA2  GLY  41           2HA      GLY  41  14.201   8.778  -4.233
  286    HA3  GLY  41           1HA      GLY  41  15.885   8.671  -4.719
  287    H    PHE  42           H        PHE  42  16.416   6.936  -2.303
  288    HA   PHE  42           HA       PHE  42  14.968   4.507  -3.027
  289    HB2  PHE  42           2HB      PHE  42  17.655   5.070  -3.867
  290    HB3  PHE  42           1HB      PHE  42  17.671   3.717  -2.741
  291    HD1  PHE  42           1HD      PHE  42  15.822   4.929  -5.742
  292    HD2  PHE  42           2HD      PHE  42  17.321   1.598  -3.558
  293    HE1  PHE  42           1HE      PHE  42  15.101   3.424  -7.550
  294    HE2  PHE  42           2HE      PHE  42  16.604   0.087  -5.363
  295    HZ   PHE  42           HZ       PHE  42  15.491   1.001  -7.362
  296    H    VAL  43           H        VAL  43  14.351   3.484  -1.246
  297    HA   VAL  43           HA       VAL  43  15.909   3.898   1.223
  298    HB   VAL  43           HB       VAL  43  13.706   4.960   1.356
  299   HG11  VAL  43          1HG1      VAL  43  12.526   2.206   1.025
  300   HG12  VAL  43          2HG1      VAL  43  12.597   3.412  -0.262
  301   HG13  VAL  43          3HG1      VAL  43  11.661   3.733   1.200
  302   HG21  VAL  43          3HG2      VAL  43  14.729   3.976   3.372
  303   HG22  VAL  43          1HG2      VAL  43  13.850   2.477   3.069
  304   HG23  VAL  43          2HG2      VAL  43  12.967   3.960   3.437
  305    H    SER  44           H        SER  44  16.852   2.139   2.001
  306    HA   SER  44           HA       SER  44  16.353  -0.444   0.883
  307    HB2  SER  44           2HB      SER  44  17.898  -0.322   3.393
  308    HB3  SER  44           1HB      SER  44  18.326  -1.031   1.837
  309    HG   SER  44           HG       SER  44  19.027   1.353   2.865
  310    H    VAL  45           H        VAL  45  15.720  -2.341   2.063
  311    HA   VAL  45           HA       VAL  45  13.352  -2.039   3.525
  312    HB   VAL  45           HB       VAL  45  15.180  -4.446   3.499
  313   HG11  VAL  45          1HG1      VAL  45  13.342  -5.733   4.193
  314   HG12  VAL  45          2HG1      VAL  45  12.206  -4.418   3.907
  315   HG13  VAL  45          3HG1      VAL  45  13.345  -4.325   5.250
  316   HG21  VAL  45          3HG2      VAL  45  14.131  -5.202   1.566
  317   HG22  VAL  45          1HG2      VAL  45  14.368  -3.482   1.255
  318   HG23  VAL  45          2HG2      VAL  45  12.783  -4.079   1.742
  319    H    GLU  46           H        GLU  46  16.586  -3.025   4.641
  320    HA   GLU  46           HA       GLU  46  16.098  -3.331   7.326
  321    HB2  GLU  46           2HB      GLU  46  18.587  -1.984   6.295
  322    HB3  GLU  46           1HB      GLU  46  18.423  -3.037   7.693
  323    HG2  GLU  46           2HG      GLU  46  17.774  -4.855   6.022
  324    HG3  GLU  46           1HG      GLU  46  18.412  -3.769   4.789
  325    H    GLU  47           H        GLU  47  16.575  -0.350   5.525
  326    HA   GLU  47           HA       GLU  47  16.540   1.305   7.889
  327    HB2  GLU  47           2HB      GLU  47  17.650   1.727   5.523
  328    HB3  GLU  47           1HB      GLU  47  16.071   2.409   5.152
  329    HG2  GLU  47           2HG      GLU  47  17.617   4.131   5.869
  330    HG3  GLU  47           1HG      GLU  47  16.291   3.959   7.018
  331    H    PHE  48           H        PHE  48  14.281   0.115   5.532
  332    HA   PHE  48           HA       PHE  48  12.176   1.949   6.071
  333    HB2  PHE  48           2HB      PHE  48  12.660  -0.081   4.222
  334    HB3  PHE  48           1HB      PHE  48  11.289  -0.668   5.154
  335    HD1  PHE  48           2HD      PHE  48   9.948   1.927   5.760
  336    HD2  PHE  48           1HD      PHE  48  11.696   0.440   2.175
  337    HE1  PHE  48           2HE      PHE  48   8.444   3.358   4.438
  338    HE2  PHE  48           1HE      PHE  48  10.194   1.870   0.846
  339    HZ   PHE  48           HZ       PHE  48   8.567   3.331   1.978
  340    H    ARG  49           H        ARG  49  13.042  -1.243   7.311
  341    HA   ARG  49           HA       ARG  49  10.749  -1.785   8.795
  342    HB2  ARG  49           2HB      ARG  49  13.631  -2.561   9.193
  343    HB3  ARG  49           1HB      ARG  49  12.360  -3.127  10.268
  344    HG2  ARG  49           2HG      ARG  49  11.201  -4.031   8.215
  345    HG3  ARG  49           1HG      ARG  49  12.694  -3.692   7.338
  346    HD2  ARG  49           2HD      ARG  49  12.262  -5.600   9.621
  347    HD3  ARG  49           1HD      ARG  49  12.816  -5.961   7.986
  348    HE   ARG  49           HE       ARG  49  14.732  -4.308   8.926
  349   HH11  ARG  49          1HH1      ARG  49  13.279  -7.218  10.193
  350   HH12  ARG  49          2HH1      ARG  49  14.705  -7.706  11.047
  351   HH21  ARG  49          1HH2      ARG  49  16.607  -4.950  10.050
  352   HH22  ARG  49          2HH2      ARG  49  16.593  -6.419  10.968
  353    H    GLY  50           H        GLY  50  13.758  -0.196   9.860
  354    HA2  GLY  50           2HA      GLY  50  13.045   0.321  12.493
  355    HA3  GLY  50           1HA      GLY  50  14.142   1.317  11.546
  356    H    ILE  51           H        ILE  51  11.935   1.854   9.584
  357    HA   ILE  51           HA       ILE  51  10.800   4.115  11.019
  358    HB   ILE  51           HB       ILE  51  10.505   3.408   8.097
  359   HG12  ILE  51          2HG1      ILE  51  12.377   5.497   9.175
  360   HG13  ILE  51          1HG1      ILE  51  12.890   3.817   9.064
  361   HG21  ILE  51          1HG2      ILE  51   8.881   4.971   8.385
  362   HG22  ILE  51          2HG2      ILE  51  10.253   6.057   8.170
  363   HG23  ILE  51          3HG2      ILE  51   9.666   5.690   9.791
  364   HD11  ILE  51          3HD1      ILE  51  13.630   4.581   7.061
  365   HD12  ILE  51          1HD1      ILE  51  12.349   5.785   6.919
  366   HD13  ILE  51          2HD1      ILE  51  12.003   4.086   6.593
  367    H    ILE  52           H        ILE  52   9.708   1.275   9.206
  368    HA   ILE  52           HA       ILE  52   6.931   1.798   9.540
  369    HB   ILE  52           HB       ILE  52   8.348  -0.789   8.886
  370   HG12  ILE  52          2HG1      ILE  52   8.693   1.066   7.266
  371   HG13  ILE  52          1HG1      ILE  52   7.802  -0.288   6.579
  372   HG21  ILE  52          1HG2      ILE  52   6.209  -1.380   9.693
  373   HG22  ILE  52          2HG2      ILE  52   6.093  -1.411   7.933
  374   HG23  ILE  52          3HG2      ILE  52   5.435  -0.047   8.836
  375   HD11  ILE  52          3HD1      ILE  52   6.315   1.202   5.887
  376   HD12  ILE  52          1HD1      ILE  52   7.028   2.475   6.876
  377   HD13  ILE  52          2HD1      ILE  52   5.833   1.380   7.574
  378    H    ARG  53           H        ARG  53   9.353   0.235  11.485
  379    HA   ARG  53           HA       ARG  53   7.867  -1.450  13.082
  380    HB2  ARG  53           2HB      ARG  53  10.434  -0.155  13.218
  381    HB3  ARG  53           1HB      ARG  53   9.683  -0.150  14.808
  382    HG2  ARG  53           2HG      ARG  53  10.824  -2.136  14.850
  383    HG3  ARG  53           1HG      ARG  53   9.233  -2.664  14.296
  384    HD2  ARG  53           2HD      ARG  53  11.456  -1.950  12.400
  385    HD3  ARG  53           1HD      ARG  53  11.244  -3.580  13.042
  386    HE   ARG  53           HE       ARG  53   9.664  -2.295  11.017
  387   HH11  ARG  53          1HH1      ARG  53   9.688  -4.770  13.478
  388   HH12  ARG  53          2HH1      ARG  53   8.429  -5.697  12.734
  389   HH21  ARG  53          1HH2      ARG  53   8.008  -3.514  10.037
  390   HH22  ARG  53          2HH2      ARG  53   7.475  -4.985  10.781
  391    H    ASP  54           H        ASP  54   8.656   1.941  13.877
  392    HA   ASP  54           HA       ASP  54   6.247   2.000  15.569
  393    HB2  ASP  54           2HB      ASP  54   8.833   3.547  15.765
  394    HB3  ASP  54           1HB      ASP  54   7.397   3.944  16.707
  395    H    GLY  55           H        GLY  55   6.799   2.681  12.569
  396    HA2  GLY  55           2HA      GLY  55   5.843   5.461  12.614
  397    HA3  GLY  55           1HA      GLY  55   6.533   4.640  11.223
  398    H    LEU  56           H        LEU  56   5.243   3.158  10.045
  399    HA   LEU  56           HA       LEU  56   2.412   3.816  10.169
  400    HB2  LEU  56           2HB      LEU  56   3.901   2.161   8.134
  401    HB3  LEU  56           1HB      LEU  56   2.258   2.756   7.988
  402    HG   LEU  56           HG       LEU  56   3.579   5.091   8.349
  403   HD11  LEU  56          1HD1      LEU  56   5.715   5.102   7.659
  404   HD12  LEU  56          2HD1      LEU  56   5.436   3.866   6.432
  405   HD13  LEU  56          3HD1      LEU  56   5.678   3.400   8.115
  406   HD21  LEU  56          3HD2      LEU  56   2.546   3.569   6.070
  407   HD22  LEU  56          1HD2      LEU  56   3.715   4.817   5.640
  408   HD23  LEU  56          2HD2      LEU  56   2.262   5.244   6.542
  409    HA   PRO  57           HA       PRO  57   1.494  -0.071  12.144
  410    HB2  PRO  57           2HB      PRO  57  -1.185   0.078  12.102
  411    HB3  PRO  57           1HB      PRO  57  -0.217   1.125  13.148
  412    HG2  PRO  57           2HG      PRO  57  -1.491   1.738  10.511
  413    HG3  PRO  57           1HG      PRO  57  -1.417   2.732  11.977
  414    HD2  PRO  57           2HD      PRO  57   0.248   3.057   9.822
  415    HD3  PRO  57           1HD      PRO  57   0.676   3.518  11.482
  416    H    MET  58           H        MET  58   2.351  -1.360  10.413
  417    HA   MET  58           HA       MET  58   0.247  -2.467   8.675
  418    HB2  MET  58           2HB      MET  58   2.706  -1.233   7.920
  419    HB3  MET  58           1HB      MET  58   2.815  -2.942   7.526
  420    HG2  MET  58           2HG      MET  58   0.961  -2.840   6.092
  421    HG3  MET  58           1HG      MET  58   0.463  -1.269   6.716
  422    HE1  MET  58           3HE      MET  58   3.545  -2.152   3.472
  423    HE2  MET  58           1HE      MET  58   2.024  -2.994   3.769
  424    HE3  MET  58           2HE      MET  58   3.362  -3.164   4.904
  425    H    THR  59           H        THR  59   0.141  -4.669   8.498
  426    HA   THR  59           HA       THR  59   1.430  -6.195  10.566
  427    HB   THR  59           HB       THR  59   0.168  -8.021   8.909
  428    HG1  THR  59           1HG      THR  59  -1.758  -7.043   8.309
  429   HG21  THR  59          3HG2      THR  59  -0.392  -6.740  11.445
  430   HG22  THR  59          1HG2      THR  59  -0.644  -8.408  10.935
  431   HG23  THR  59          2HG2      THR  59  -1.858  -7.182  10.570
  432    H    GLU  60           H        GLU  60   2.837  -7.960  10.283
  433    HA   GLU  60           HA       GLU  60   5.035  -7.726   8.741
  434    HB2  GLU  60           2HB      GLU  60   5.147 -10.297   8.802
  435    HB3  GLU  60           1HB      GLU  60   5.098  -9.441  10.336
  436    HG2  GLU  60           2HG      GLU  60   2.569  -9.843  10.252
  437    HG3  GLU  60           1HG      GLU  60   2.936 -11.016   8.990
  438    H    ALA  61           H        ALA  61   2.197  -9.613   7.829
  439    HA   ALA  61           HA       ALA  61   2.923 -10.551   5.374
  440    HB1  ALA  61           1HB      ALA  61   0.207  -9.470   6.099
  441    HB2  ALA  61           2HB      ALA  61   0.807 -11.078   6.504
  442    HB3  ALA  61           3HB      ALA  61   0.567 -10.625   4.816
  443    H    GLU  62           H        GLU  62   1.336  -7.413   5.998
  444    HA   GLU  62           HA       GLU  62   1.332  -6.485   3.368
  445    HB2  GLU  62           2HB      GLU  62   1.927  -4.448   5.433
  446    HB3  GLU  62           1HB      GLU  62   0.681  -4.464   4.196
  447    HG2  GLU  62           2HG      GLU  62   0.646  -5.831   6.864
  448    HG3  GLU  62           1HG      GLU  62  -0.387  -4.518   6.307
  449    H    ILE  63           H        ILE  63   3.666  -5.626   5.911
  450    HA   ILE  63           HA       ILE  63   5.530  -4.368   4.236
  451    HB   ILE  63           HB       ILE  63   6.357  -5.894   6.694
  452   HG12  ILE  63          2HG1      ILE  63   5.790  -3.343   7.572
  453   HG13  ILE  63          1HG1      ILE  63   4.439  -3.692   6.496
  454   HG21  ILE  63          1HG2      ILE  63   7.863  -4.487   5.020
  455   HG22  ILE  63          2HG2      ILE  63   8.164  -4.514   6.759
  456   HG23  ILE  63          3HG2      ILE  63   7.297  -3.159   6.034
  457   HD11  ILE  63          3HD1      ILE  63   5.077  -4.780   9.119
  458   HD12  ILE  63          1HD1      ILE  63   4.639  -6.000   7.923
  459   HD13  ILE  63          2HD1      ILE  63   3.535  -4.670   8.272
  460    H    THR  64           H        THR  64   5.811  -7.604   5.684
  461    HA   THR  64           HA       THR  64   8.040  -8.491   4.329
  462    HB   THR  64           HB       THR  64   5.624 -10.032   5.251
  463    HG1  THR  64           1HG      THR  64   6.691  -9.033   6.937
  464   HG21  THR  64          3HG2      THR  64   8.330 -11.071   4.470
  465   HG22  THR  64          1HG2      THR  64   6.777 -11.456   3.726
  466   HG23  THR  64          2HG2      THR  64   7.124 -11.990   5.372
  467    H    GLU  65           H        GLU  65   4.628  -8.959   3.385
  468    HA   GLU  65           HA       GLU  65   5.254 -10.251   0.958
  469    HB2  GLU  65           2HB      GLU  65   3.016 -10.297   2.149
  470    HB3  GLU  65           1HB      GLU  65   2.742  -8.693   1.483
  471    HG2  GLU  65           2HG      GLU  65   3.041  -9.662  -0.791
  472    HG3  GLU  65           1HG      GLU  65   3.109 -11.258  -0.044
  473    H    PHE  66           H        PHE  66   5.463  -7.121   1.928
  474    HA   PHE  66           HA       PHE  66   5.340  -6.031  -0.760
  475    HB2  PHE  66           2HB      PHE  66   5.327  -4.816   1.971
  476    HB3  PHE  66           1HB      PHE  66   5.885  -3.846   0.615
  477    HD1  PHE  66           2HD      PHE  66   3.245  -6.381   0.286
  478    HD2  PHE  66           1HD      PHE  66   4.123  -2.242   0.747
  479    HE1  PHE  66           2HE      PHE  66   0.915  -5.827  -0.281
  480    HE2  PHE  66           1HE      PHE  66   1.796  -1.681   0.180
  481    HZ   PHE  66           HZ       PHE  66   0.189  -3.475  -0.336
  482    H    PHE  67           H        PHE  67   7.573  -6.931   1.726
  483    HA   PHE  67           HA       PHE  67   9.813  -5.481   0.650
  484    HB2  PHE  67           2HB      PHE  67   9.441  -7.535   2.802
  485    HB3  PHE  67           1HB      PHE  67  11.060  -7.154   2.232
  486    HD1  PHE  67           2HD      PHE  67   9.820  -4.115   1.762
  487    HD2  PHE  67           1HD      PHE  67  10.394  -6.809   5.014
  488    HE1  PHE  67           2HE      PHE  67   9.902  -2.217   3.320
  489    HE2  PHE  67           1HE      PHE  67  10.478  -4.910   6.574
  490    HZ   PHE  67           HZ       PHE  67  10.234  -2.611   5.728
  491    H    GLU  68           H        GLU  68   8.358  -8.589   0.153
  492    HA   GLU  68           HA       GLU  68  10.674  -9.607  -1.287
  493    HB2  GLU  68           2HB      GLU  68   7.973 -10.917  -0.968
  494    HB3  GLU  68           1HB      GLU  68   9.487 -11.685  -1.430
  495    HG2  GLU  68           2HG      GLU  68  10.144 -10.622   0.978
  496    HG3  GLU  68           1HG      GLU  68   8.442 -11.009   1.220
  497    H    ALA  69           H        ALA  69   7.556  -8.190  -1.900
  498    HA   ALA  69           HA       ALA  69   7.631  -8.858  -4.712
  499    HB1  ALA  69           1HB      ALA  69   5.660  -7.167  -3.214
  500    HB2  ALA  69           2HB      ALA  69   5.500  -8.904  -3.482
  501    HB3  ALA  69           3HB      ALA  69   5.464  -7.792  -4.852
  502    H    ALA  70           H        ALA  70   8.817  -6.517  -2.767
  503    HA   ALA  70           HA       ALA  70   8.754  -4.376  -4.743
  504    HB1  ALA  70           1HB      ALA  70  10.023  -3.121  -2.922
  505    HB2  ALA  70           2HB      ALA  70   9.676  -4.506  -1.887
  506    HB3  ALA  70           3HB      ALA  70   8.353  -3.567  -2.578
  507    H    ASP  71           H        ASP  71  10.946  -6.724  -3.389
  508    HA   ASP  71           HA       ASP  71  13.037  -5.755  -5.221
  509    HB2  ASP  71           2HB      ASP  71  13.443  -5.415  -2.695
  510    HB3  ASP  71           1HB      ASP  71  13.661  -7.162  -2.634
  511    HA   PRO  72           HA       PRO  72  12.414  -9.885  -6.872
  512    HB2  PRO  72           2HB      PRO  72  14.432  -9.760  -8.713
  513    HB3  PRO  72           1HB      PRO  72  12.833  -9.055  -8.965
  514    HG2  PRO  72           2HG      PRO  72  15.370  -7.733  -8.092
  515    HG3  PRO  72           1HG      PRO  72  14.151  -7.163  -9.246
  516    HD2  PRO  72           2HD      PRO  72  14.262  -6.236  -6.722
  517    HD3  PRO  72           1HD      PRO  72  12.720  -6.450  -7.575
  518    H    ASN  73           H        ASN  73  15.644  -8.622  -6.111
  519    HA   ASN  73           HA       ASN  73  16.783 -11.237  -5.787
  520    HB2  ASN  73           2HB      ASN  73  17.883  -8.552  -4.929
  521    HB3  ASN  73           1HB      ASN  73  18.790 -10.056  -5.065
  522   HD21  ASN  73          1HD2      ASN  73  18.979  -7.385  -6.416
  523   HD22  ASN  73          2HD2      ASN  73  19.009  -7.755  -8.103
  524    H    ASN  74           H        ASN  74  15.331  -8.832  -3.719
  525    HA   ASN  74           HA       ASN  74  14.573  -8.947  -1.577
  526    HB2  ASN  74           2HB      ASN  74  15.583 -11.785  -1.421
  527    HB3  ASN  74           1HB      ASN  74  14.309 -11.032  -0.465
  528   HD21  ASN  74          1HD2      ASN  74  15.025 -12.877  -3.176
  529   HD22  ASN  74          2HD2      ASN  74  13.465 -12.855  -3.917
  530    H    THR  75           H        THR  75  17.102  -7.963  -2.220
  531    HA   THR  75           HA       THR  75  18.917  -8.912  -0.163
  532    HB   THR  75           HB       THR  75  20.010  -8.424  -2.195
  533    HG1  THR  75           1HG      THR  75  20.385  -6.093  -0.636
  534   HG21  THR  75          3HG2      THR  75  18.388  -5.919  -2.243
  535   HG22  THR  75          1HG2      THR  75  18.579  -7.152  -3.490
  536   HG23  THR  75          2HG2      THR  75  19.904  -6.041  -3.136
  537    H    GLY  76           H        GLY  76  16.552  -7.869   0.867
  538    HA2  GLY  76           2HA      GLY  76  15.725  -6.342   2.358
  539    HA3  GLY  76           1HA      GLY  76  17.399  -6.184   2.870
  540    H    PHE  77           H        PHE  77  16.484  -5.352  -0.376
  541    HA   PHE  77           HA       PHE  77  16.621  -2.497   0.333
  542    HB2  PHE  77           2HB      PHE  77  18.257  -4.046  -1.555
  543    HB3  PHE  77           1HB      PHE  77  17.589  -2.566  -2.233
  544    HD1  PHE  77           1HD      PHE  77  18.191  -0.389  -1.296
  545    HD2  PHE  77           2HD      PHE  77  19.946  -3.992   0.135
  546    HE1  PHE  77           1HE      PHE  77  19.974   0.915  -0.213
  547    HE2  PHE  77           2HE      PHE  77  21.731  -2.695   1.223
  548    HZ   PHE  77           HZ       PHE  77  21.746  -0.239   1.050
  549    H    ILE  78           H        ILE  78  15.001  -1.282  -0.413
  550    HA   ILE  78           HA       ILE  78  13.099  -2.518  -2.284
  551    HB   ILE  78           HB       ILE  78  12.758  -0.202  -0.372
  552   HG12  ILE  78          2HG1      ILE  78  11.506  -2.950  -0.448
  553   HG13  ILE  78          1HG1      ILE  78  12.703  -2.384   0.718
  554   HG21  ILE  78          1HG2      ILE  78  10.786  -1.351  -2.343
  555   HG22  ILE  78          2HG2      ILE  78  11.482   0.270  -2.369
  556   HG23  ILE  78          3HG2      ILE  78  10.389  -0.199  -1.069
  557   HD11  ILE  78          3HD1      ILE  78   9.951  -2.296   0.981
  558   HD12  ILE  78          1HD1      ILE  78  10.407  -0.632   0.604
  559   HD13  ILE  78          2HD1      ILE  78  11.135  -1.459   1.986
  560    H    ASP  79           H        ASP  79  12.194  -1.302  -3.973
  561    HA   ASP  79           HA       ASP  79  13.962   0.804  -5.002
  562    HB2  ASP  79           2HB      ASP  79  13.538  -1.122  -6.508
  563    HB3  ASP  79           1HB      ASP  79  11.810  -0.799  -6.421
  564    H    TYR  80           H        TYR  80  13.243   2.578  -3.911
  565    HA   TYR  80           HA       TYR  80  10.978   3.380  -2.873
  566    HB2  TYR  80           2HB      TYR  80  13.008   4.809  -3.200
  567    HB3  TYR  80           1HB      TYR  80  12.422   5.193  -4.814
  568    HD1  TYR  80           2HD      TYR  80  11.904   5.708  -1.224
  569    HD2  TYR  80           1HD      TYR  80  10.520   6.662  -5.132
  570    HE1  TYR  80           2HE      TYR  80  10.570   7.552  -0.294
  571    HE2  TYR  80           1HE      TYR  80   9.182   8.510  -4.214
  572    HH   TYR  80           HH       TYR  80   9.595   9.710  -1.101
  573    H    LYS  81           H        LYS  81  11.451   3.345  -6.390
  574    HA   LYS  81           HA       LYS  81   8.954   4.505  -7.029
  575    HB2  LYS  81           2HB      LYS  81  10.593   2.601  -8.714
  576    HB3  LYS  81           1HB      LYS  81   9.350   3.700  -9.292
  577    HG2  LYS  81           2HG      LYS  81  10.965   5.466  -8.095
  578    HG3  LYS  81           1HG      LYS  81  12.149   4.232  -8.531
  579    HD2  LYS  81           2HD      LYS  81  11.833   4.531 -10.784
  580    HD3  LYS  81           1HD      LYS  81  10.173   5.096 -10.584
  581    HE2  LYS  81           2HE      LYS  81  10.956   7.222  -9.747
  582    HE3  LYS  81           1HE      LYS  81  12.626   6.660  -9.792
  583    HZ1  LYS  81           3HZ      LYS  81  10.834   7.214 -12.084
  584    HZ2  LYS  81           1HZ      LYS  81  12.282   6.353 -12.248
  585    HZ3  LYS  81           2HZ      LYS  81  12.308   7.957 -11.712
  586    H    ALA  82           H        ALA  82  10.007   1.092  -7.118
  587    HA   ALA  82           HA       ALA  82   7.563  -0.062  -7.741
  588    HB1  ALA  82           1HB      ALA  82  10.023  -1.042  -7.244
  589    HB2  ALA  82           2HB      ALA  82   8.574  -2.042  -7.332
  590    HB3  ALA  82           3HB      ALA  82   9.194  -1.525  -5.762
  591    H    PHE  83           H        PHE  83   8.666   1.348  -4.781
  592    HA   PHE  83           HA       PHE  83   6.473   0.230  -3.229
  593    HB2  PHE  83           2HB      PHE  83   9.076   1.173  -2.633
  594    HB3  PHE  83           1HB      PHE  83   7.945   2.245  -1.811
  595    HD1  PHE  83           2HD      PHE  83   8.382  -1.405  -2.432
  596    HD2  PHE  83           1HD      PHE  83   7.358   1.666   0.328
  597    HE1  PHE  83           2HE      PHE  83   8.088  -3.094  -0.672
  598    HE2  PHE  83           1HE      PHE  83   7.060  -0.019   2.098
  599    HZ   PHE  83           HZ       PHE  83   7.426  -2.404   1.598
  600    H    ALA  84           H        ALA  84   7.433   3.210  -4.777
  601    HA   ALA  84           HA       ALA  84   5.389   4.797  -3.508
  602    HB1  ALA  84           1HB      ALA  84   6.137   6.421  -5.422
  603    HB2  ALA  84           2HB      ALA  84   7.481   5.290  -5.572
  604    HB3  ALA  84           3HB      ALA  84   7.189   6.115  -4.041
  605    H    ALA  85           H        ALA  85   5.910   3.403  -6.731
  606    HA   ALA  85           HA       ALA  85   3.473   4.377  -7.794
  607    HB1  ALA  85           1HB      ALA  85   5.416   3.809  -9.195
  608    HB2  ALA  85           2HB      ALA  85   3.942   2.993  -9.718
  609    HB3  ALA  85           3HB      ALA  85   5.161   2.110  -8.797
  610    H    MET  86           H        MET  86   4.143   1.958  -5.691
  611    HA   MET  86           HA       MET  86   2.209   0.010  -6.403
  612    HB2  MET  86           2HB      MET  86   4.099  -0.503  -4.923
  613    HB3  MET  86           1HB      MET  86   3.453   0.592  -3.709
  614    HG2  MET  86           2HG      MET  86   2.783  -1.472  -2.939
  615    HG3  MET  86           1HG      MET  86   1.356  -0.900  -3.802
  616    HE1  MET  86           3HE      MET  86   4.393  -3.096  -3.684
  617    HE2  MET  86           1HE      MET  86   3.983  -4.477  -4.701
  618    HE3  MET  86           2HE      MET  86   3.094  -4.190  -3.205
  619    H    LEU  87           H        LEU  87   2.146   2.902  -4.415
  620    HA   LEU  87           HA       LEU  87  -0.644   2.415  -3.747
  621    HB2  LEU  87           2HB      LEU  87   1.247   4.499  -2.730
  622    HB3  LEU  87           1HB      LEU  87  -0.390   4.262  -2.149
  623    HG   LEU  87           HG       LEU  87   0.666   1.782  -1.745
  624   HD11  LEU  87          1HD1      LEU  87   2.887   1.942  -2.029
  625   HD12  LEU  87          2HD1      LEU  87   2.855   2.696  -0.435
  626   HD13  LEU  87          3HD1      LEU  87   2.885   3.700  -1.886
  627   HD21  LEU  87          3HD2      LEU  87   0.544   4.183   0.063
  628   HD22  LEU  87          1HD2      LEU  87   0.961   2.569   0.641
  629   HD23  LEU  87          2HD2      LEU  87  -0.619   2.865  -0.085
  630    H    TYR  88           H        TYR  88   1.115   3.898  -5.948
  631    HA   TYR  88           HA       TYR  88  -1.013   5.805  -6.632
  632    HB2  TYR  88           2HB      TYR  88   1.899   6.251  -7.281
  633    HB3  TYR  88           1HB      TYR  88   0.574   7.403  -7.413
  634    HD1  TYR  88           1HD      TYR  88  -0.770   7.135  -4.832
  635    HD2  TYR  88           2HD      TYR  88   3.386   7.149  -5.742
  636    HE1  TYR  88           1HE      TYR  88  -0.283   7.958  -2.566
  637    HE2  TYR  88           2HE      TYR  88   3.885   7.970  -3.478
  638    HH   TYR  88           HH       TYR  88   2.325   7.732  -1.048
  639    H    SER  89           H        SER  89  -0.367   2.987  -7.475
  640    HA   SER  89           HA       SER  89   0.566   3.028 -10.145
  641    HB2  SER  89           2HB      SER  89   0.112   1.047  -8.381
  642    HB3  SER  89           1HB      SER  89  -1.360   0.911  -9.345
  643    HG   SER  89           HG       SER  89   0.121   0.901 -11.209
  644    H    VAL  90           H        VAL  90  -0.641   4.874 -10.958
  645    HA   VAL  90           HA       VAL  90  -3.102   4.013 -12.239
  646    HB   VAL  90           HB       VAL  90  -4.307   6.097 -11.624
  647   HG11  VAL  90          1HG1      VAL  90  -5.041   5.337  -9.468
  648   HG12  VAL  90          2HG1      VAL  90  -3.542   4.443  -9.222
  649   HG13  VAL  90          3HG1      VAL  90  -4.681   3.928 -10.466
  650   HG21  VAL  90          3HG2      VAL  90  -2.217   7.344 -10.987
  651   HG22  VAL  90          1HG2      VAL  90  -2.217   6.425  -9.481
  652   HG23  VAL  90          2HG2      VAL  90  -3.561   7.502  -9.857
  653    H    ASP  91           H        ASP  91  -0.381   4.658 -13.079
  654    HA   ASP  91           HA       ASP  91  -1.052   6.760 -15.017
  655    HB2  ASP  91           2HB      ASP  91   1.356   7.535 -14.852
  656    HB3  ASP  91           1HB      ASP  91   0.340   7.911 -13.462
  657    H    GLU  92           H        GLU  92  -0.143   6.522 -17.061
  658    HA   GLU  92           HA       GLU  92   1.401   4.064 -17.528
  659    HB2  GLU  92           2HB      GLU  92  -0.906   5.023 -19.233
  660    HB3  GLU  92           1HB      GLU  92   0.084   3.600 -19.534
  661    HG2  GLU  92           2HG      GLU  92  -0.757   3.020 -17.066
  662    HG3  GLU  92           1HG      GLU  92  -2.108   4.017 -17.603
  663    H    SER  93           H        SER  93   2.677   4.070 -19.470
  664    HA   SER  93           HA       SER  93   4.167   4.996 -20.916
  665    HB2  SER  93           2HB      SER  93   1.818   6.848 -21.176
  666    HB3  SER  93           1HB      SER  93   3.327   7.218 -22.014
  667    HG   SER  93           HG       SER  93   2.852   5.740 -23.418
  Start of MODEL   20
    1    H1   MET   1           1HT      MET   1 -42.369  13.633   3.058
    2    H2   MET   1           2HT      MET   1 -41.313  14.972   3.258
    3    H3   MET   1           3HT      MET   1 -40.847  13.417   3.818
    4    HA   MET   1           HA       MET   1 -41.079  12.679   1.453
    5    HB2  MET   1           2HB      MET   1 -41.365  15.648   1.282
    6    HB3  MET   1           1HB      MET   1 -40.502  14.815  -0.003
    7    HG2  MET   1           2HG      MET   1 -42.536  13.312  -0.190
    8    HG3  MET   1           1HG      MET   1 -43.362  14.485   0.835
    9    HE1  MET   1           2HE      MET   1 -44.634  17.013  -1.280
   10    HE2  MET   1           3HE      MET   1 -43.206  17.523  -0.379
   11    HE3  MET   1           1HE      MET   1 -44.318  16.346   0.322
   12    H    GLY   2           H        GLY   2 -39.090  12.659   0.149
   13    HA2  GLY   2           2HA      GLY   2 -36.763  13.997   0.512
   14    HA3  GLY   2           1HA      GLY   2 -36.778  12.875   1.865
   15    H    SER   3           H        SER   3 -36.630  10.639   1.470
   16    HA   SER   3           HA       SER   3 -35.830   8.781   0.433
   17    HB2  SER   3           2HB      SER   3 -37.298  10.185  -1.757
   18    HB3  SER   3           1HB      SER   3 -36.282   8.806  -2.179
   19    HG   SER   3           HG       SER   3 -37.609   7.493  -1.153
   20    H    SER   4           H        SER   4 -33.662   8.856   0.684
   21    HA   SER   4           HA       SER   4 -32.082   9.632  -1.609
   22    HB2  SER   4           2HB      SER   4 -31.428  10.873   1.069
   23    HB3  SER   4           1HB      SER   4 -30.649  11.189  -0.481
   24    HG   SER   4           HG       SER   4 -32.350  12.357  -1.121
   25    H    HIS   5           H        HIS   5 -31.326   7.577  -1.826
   26    HA   HIS   5           HA       HIS   5 -29.146   6.757  -0.251
   27    HB2  HIS   5           2HB      HIS   5 -30.082   4.744   0.800
   28    HB3  HIS   5           1HB      HIS   5 -30.865   6.199   1.406
   29    HD1  HIS   5           1HD      HIS   5 -31.520   3.067  -0.472
   30    HD2  HIS   5           2HD      HIS   5 -33.565   6.520   0.604
   31    HE1  HIS   5           1HE      HIS   5 -33.947   2.576  -0.912
   32    HE2  HIS   5           2HE      HIS   5 -35.172   4.649  -0.170
   33    H    HIS   6           H        HIS   6 -31.782   5.704  -2.357
   34    HA   HIS   6           HA       HIS   6 -29.799   4.268  -3.985
   35    HB2  HIS   6           2HB      HIS   6 -31.588   2.917  -2.490
   36    HB3  HIS   6           1HB      HIS   6 -32.557   3.178  -3.938
   37    HD1  HIS   6           1HD      HIS   6 -29.578   1.322  -2.674
   38    HD2  HIS   6           2HD      HIS   6 -31.693   1.785  -6.220
   39    HE1  HIS   6           1HE      HIS   6 -28.744  -0.498  -4.195
   40    HE2  HIS   6           2HE      HIS   6 -30.101  -0.252  -6.304
   41    H    HIS   7           H        HIS   7 -29.642   5.661  -5.657
   42    HA   HIS   7           HA       HIS   7 -30.192   6.804  -7.544
   43    HB2  HIS   7           2HB      HIS   7 -31.424   4.491  -7.846
   44    HB3  HIS   7           1HB      HIS   7 -32.870   5.475  -7.650
   45    HD1  HIS   7           1HD      HIS   7 -31.306   7.922  -9.237
   46    HD2  HIS   7           2HD      HIS   7 -32.173   4.078 -10.555
   47    HE1  HIS   7           1HE      HIS   7 -31.306   8.057 -11.746
   48    HE2  HIS   7           2HE      HIS   7 -31.917   5.739 -12.521
   49    H    HIS   8           H        HIS   8 -30.535   8.903  -7.241
   50    HA   HIS   8           HA       HIS   8 -33.192   9.904  -6.872
   51    HB2  HIS   8           2HB      HIS   8 -32.584  11.257  -4.823
   52    HB3  HIS   8           1HB      HIS   8 -32.799   9.531  -4.552
   53    HD1  HIS   8           1HD      HIS   8 -30.268  12.240  -4.414
   54    HD2  HIS   8           2HD      HIS   8 -30.416   8.112  -3.965
   55    HE1  HIS   8           1HE      HIS   8 -28.080  11.601  -3.352
   56    HE2  HIS   8           2HE      HIS   8 -28.228   9.109  -3.011
   57    H    HIS   9           H        HIS   9 -32.604  10.812  -8.911
   58    HA   HIS   9           HA       HIS   9 -30.423  12.682  -9.076
   59    HB2  HIS   9           2HB      HIS   9 -31.365  11.226 -10.977
   60    HB3  HIS   9           1HB      HIS   9 -32.654  12.420 -11.081
   61    HD1  HIS   9           1HD      HIS   9 -31.593  15.016 -11.312
   62    HD2  HIS   9           2HD      HIS   9 -29.320  11.799 -12.635
   63    HE1  HIS   9           1HE      HIS   9 -29.902  15.993 -12.897
   64    HE2  HIS   9           2HE      HIS   9 -28.593  14.017 -13.750
   65    H    HIS  10           H        HIS  10 -30.474  14.775  -8.596
   66    HA   HIS  10           HA       HIS  10 -32.983  16.252  -8.751
   67    HB2  HIS  10           2HB      HIS  10 -31.515  15.641  -6.238
   68    HB3  HIS  10           1HB      HIS  10 -32.154  17.272  -6.418
   69    HD1  HIS  10           1HD      HIS  10 -34.842  16.722  -7.720
   70    HD2  HIS  10           2HD      HIS  10 -33.313  14.456  -4.592
   71    HE1  HIS  10           1HE      HIS  10 -36.838  15.650  -6.629
   72    HE2  HIS  10           2HE      HIS  10 -35.896  14.353  -4.686
   73    H    SER  11           H        SER  11 -32.431  18.654  -7.978
   74    HA   SER  11           HA       SER  11 -30.305  19.509  -9.747
   75    HB2  SER  11           2HB      SER  11 -31.161  21.828  -9.041
   76    HB3  SER  11           1HB      SER  11 -32.267  20.804  -9.957
   77    HG   SER  11           HG       SER  11 -32.848  21.931  -7.759
   78    H    SER  12           H        SER  12 -31.165  20.076  -6.333
   79    HA   SER  12           HA       SER  12 -28.667  21.317  -5.728
   80    HB2  SER  12           2HB      SER  12 -30.652  20.128  -3.779
   81    HB3  SER  12           1HB      SER  12 -29.437  21.361  -3.444
   82    HG   SER  12           HG       SER  12 -31.727  22.031  -3.866
   83    H    GLY  13           H        GLY  13 -27.242  20.465  -3.943
   84    HA2  GLY  13           2HA      GLY  13 -26.801  18.154  -2.849
   85    HA3  GLY  13           1HA      GLY  13 -26.642  17.647  -4.524
   86    H    LEU  14           H        LEU  14 -24.478  16.988  -3.912
   87    HA   LEU  14           HA       LEU  14 -22.600  19.232  -4.126
   88    HB2  LEU  14           2HB      LEU  14 -21.117  17.629  -2.603
   89    HB3  LEU  14           1HB      LEU  14 -22.158  18.869  -1.934
   90    HG   LEU  14           HG       LEU  14 -23.439  16.239  -2.302
   91   HD11  LEU  14          1HD1      LEU  14 -21.702  16.431   0.090
   92   HD12  LEU  14          2HD1      LEU  14 -20.938  15.986  -1.437
   93   HD13  LEU  14          3HD1      LEU  14 -22.262  15.013  -0.797
   94   HD21  LEU  14          3HD2      LEU  14 -23.324  17.775   0.245
   95   HD22  LEU  14          1HD2      LEU  14 -24.657  16.867  -0.467
   96   HD23  LEU  14          2HD2      LEU  14 -24.225  18.449  -1.113
   97    H    VAL  15           H        VAL  15 -22.174  15.724  -3.738
   98    HA   VAL  15           HA       VAL  15 -21.354  15.466  -6.516
   99    HB   VAL  15           HB       VAL  15 -19.211  14.342  -5.868
  100   HG11  VAL  15          1HG1      VAL  15 -17.970  16.437  -5.522
  101   HG12  VAL  15          2HG1      VAL  15 -19.486  17.262  -5.162
  102   HG13  VAL  15          3HG1      VAL  15 -19.205  16.593  -6.769
  103   HG21  VAL  15          3HG2      VAL  15 -20.138  15.215  -3.191
  104   HG22  VAL  15          1HG2      VAL  15 -18.414  15.355  -3.536
  105   HG23  VAL  15          2HG2      VAL  15 -19.214  13.788  -3.662
  106    HA   PRO  16           HA       PRO  16 -23.087  11.428  -6.374
  107    HB2  PRO  16           2HB      PRO  16 -20.481  10.395  -7.391
  108    HB3  PRO  16           1HB      PRO  16 -22.112  10.155  -8.028
  109    HG2  PRO  16           2HG      PRO  16 -20.426  11.833  -9.222
  110    HG3  PRO  16           1HG      PRO  16 -22.150  12.222  -9.079
  111    HD2  PRO  16           2HD      PRO  16 -19.827  13.295  -7.542
  112    HD3  PRO  16           1HD      PRO  16 -21.309  14.117  -8.070
  113    H    ARG  17           H        ARG  17 -19.608  10.996  -5.697
  114    HA   ARG  17           HA       ARG  17 -20.017  10.297  -2.972
  115    HB2  ARG  17           2HB      ARG  17 -20.567   8.237  -4.754
  116    HB3  ARG  17           1HB      ARG  17 -18.925   7.904  -4.222
  117    HG2  ARG  17           2HG      ARG  17 -21.313   8.300  -2.429
  118    HG3  ARG  17           1HG      ARG  17 -20.558   6.756  -2.834
  119    HD2  ARG  17           2HD      ARG  17 -18.830   7.082  -1.421
  120    HD3  ARG  17           1HD      ARG  17 -18.742   8.810  -1.764
  121    HE   ARG  17           HE       ARG  17 -21.014   8.593  -0.320
  122   HH11  ARG  17          1HH1      ARG  17 -17.748   7.483   0.209
  123   HH12  ARG  17          2HH1      ARG  17 -17.858   7.588   1.934
  124   HH21  ARG  17          1HH2      ARG  17 -21.161   8.731   1.949
  125   HH22  ARG  17          2HH2      ARG  17 -19.796   8.296   2.922
  126    H    GLY  18           H        GLY  18 -17.786   9.010  -5.436
  127    HA2  GLY  18           2HA      GLY  18 -15.543   9.431  -5.785
  128    HA3  GLY  18           1HA      GLY  18 -15.675  10.802  -4.694
  129    H    SER  19           H        SER  19 -16.425   7.420  -3.994
  130    HA   SER  19           HA       SER  19 -14.009   6.752  -2.736
  131    HB2  SER  19           2HB      SER  19 -14.465   8.410  -1.073
  132    HB3  SER  19           1HB      SER  19 -16.142   7.886  -0.918
  133    HG   SER  19           HG       SER  19 -14.048   7.045   0.453
  134    H    HIS  20           H        HIS  20 -14.235   4.774  -1.346
  135    HA   HIS  20           HA       HIS  20 -16.681   3.314  -1.369
  136    HB2  HIS  20           2HB      HIS  20 -15.481   3.236  -3.791
  137    HB3  HIS  20           1HB      HIS  20 -14.683   1.873  -3.012
  138    HD1  HIS  20           1HD      HIS  20 -17.617   1.496  -1.379
  139    HD2  HIS  20           2HD      HIS  20 -16.716   1.188  -5.423
  140    HE1  HIS  20           1HE      HIS  20 -19.431   0.062  -2.363
  141    HE2  HIS  20           2HE      HIS  20 -18.914  -0.037  -4.827
  142    H    MET  21           H        MET  21 -13.255   2.386  -1.717
  143    HA   MET  21           HA       MET  21 -13.068   1.674   1.071
  144    HB2  MET  21           2HB      MET  21 -13.560  -0.348  -1.020
  145    HB3  MET  21           1HB      MET  21 -12.233  -0.716   0.073
  146    HG2  MET  21           2HG      MET  21 -13.595  -1.090   1.817
  147    HG3  MET  21           1HG      MET  21 -14.707   0.202   1.364
  148    HE1  MET  21           3HE      MET  21 -15.454  -2.563   2.611
  149    HE2  MET  21           1HE      MET  21 -14.360  -3.594   1.688
  150    HE3  MET  21           2HE      MET  21 -16.106  -3.774   1.507
  151    H    SER  22           H        SER  22 -11.718   3.434  -0.823
  152    HA   SER  22           HA       SER  22  -9.093   2.212  -1.102
  153    HB2  SER  22           2HB      SER  22  -9.880   4.984  -1.988
  154    HB3  SER  22           1HB      SER  22  -8.515   4.018  -2.546
  155    HG   SER  22           HG       SER  22 -10.614   4.152  -3.838
  156    H    ASP  23           H        ASP  23 -10.606   3.549   1.324
  157    HA   ASP  23           HA       ASP  23  -8.807   5.543   2.227
  158    HB2  ASP  23           2HB      ASP  23 -10.798   3.906   3.772
  159    HB3  ASP  23           1HB      ASP  23  -9.995   5.352   4.378
  160    H    GLU  24           H        GLU  24  -8.664   2.261   2.124
  161    HA   GLU  24           HA       GLU  24  -7.163   1.670   4.421
  162    HB2  GLU  24           2HB      GLU  24  -8.356   0.010   2.918
  163    HB3  GLU  24           1HB      GLU  24  -6.986   0.171   1.827
  164    HG2  GLU  24           2HG      GLU  24  -6.234  -1.613   2.963
  165    HG3  GLU  24           1HG      GLU  24  -5.683  -0.384   4.102
  166    H    LYS  25           H        LYS  25  -6.401   3.260   1.636
  167    HA   LYS  25           HA       LYS  25  -3.532   2.793   1.799
  168    HB2  LYS  25           2HB      LYS  25  -4.537   2.852  -0.424
  169    HB3  LYS  25           1HB      LYS  25  -5.164   4.466  -0.120
  170    HG2  LYS  25           2HG      LYS  25  -2.259   4.168   0.210
  171    HG3  LYS  25           1HG      LYS  25  -2.865   3.942  -1.432
  172    HD2  LYS  25           2HD      LYS  25  -3.913   6.108  -1.400
  173    HD3  LYS  25           1HD      LYS  25  -3.512   6.322   0.306
  174    HE2  LYS  25           2HE      LYS  25  -1.530   6.078  -1.956
  175    HE3  LYS  25           1HE      LYS  25  -1.995   7.578  -1.153
  176    HZ1  LYS  25           3HZ      LYS  25  -0.237   5.453  -0.240
  177    HZ2  LYS  25           1HZ      LYS  25  -1.249   6.125   0.936
  178    HZ3  LYS  25           2HZ      LYS  25  -0.183   7.113   0.073
  179    H    THR  26           H        THR  26  -5.920   5.165   2.645
  180    HA   THR  26           HA       THR  26  -4.179   7.373   2.945
  181    HB   THR  26           HB       THR  26  -6.285   7.772   4.731
  182    HG1  THR  26           1HG      THR  26  -7.782   6.458   4.122
  183   HG21  THR  26          3HG2      THR  26  -7.097   8.659   2.174
  184   HG22  THR  26          1HG2      THR  26  -5.345   8.863   2.285
  185   HG23  THR  26          2HG2      THR  26  -6.402   9.596   3.497
  186    H    GLN  27           H        GLN  27  -4.987   4.671   4.981
  187    HA   GLN  27           HA       GLN  27  -4.130   5.701   7.452
  188    HB2  GLN  27           2HB      GLN  27  -3.897   2.851   6.460
  189    HB3  GLN  27           1HB      GLN  27  -3.856   3.371   8.138
  190    HG2  GLN  27           2HG      GLN  27  -6.240   4.232   6.684
  191    HG3  GLN  27           1HG      GLN  27  -6.061   2.483   6.815
  192   HE21  GLN  27          1HE2      GLN  27  -7.038   1.652   8.500
  193   HE22  GLN  27          2HE2      GLN  27  -7.279   2.419  10.030
  194    H    LEU  28           H        LEU  28  -2.437   4.717   4.626
  195    HA   LEU  28           HA       LEU  28   0.126   4.502   5.937
  196    HB2  LEU  28           2HB      LEU  28  -0.697   3.099   3.959
  197    HB3  LEU  28           1HB      LEU  28  -0.381   4.527   2.991
  198    HG   LEU  28           HG       LEU  28   1.929   3.876   4.601
  199   HD11  LEU  28          1HD1      LEU  28   2.342   1.712   4.196
  200   HD12  LEU  28          2HD1      LEU  28   1.629   1.769   2.585
  201   HD13  LEU  28          3HD1      LEU  28   0.593   1.592   4.001
  202   HD21  LEU  28          3HD2      LEU  28   2.998   4.578   2.762
  203   HD22  LEU  28          1HD2      LEU  28   1.399   5.075   2.209
  204   HD23  LEU  28          2HD2      LEU  28   2.068   3.524   1.699
  205    H    ILE  29           H        ILE  29  -1.760   6.871   4.713
  206    HA   ILE  29           HA       ILE  29   0.093   8.622   3.551
  207    HB   ILE  29           HB       ILE  29  -2.539   9.195   4.842
  208   HG12  ILE  29          2HG1      ILE  29  -2.413   7.678   2.801
  209   HG13  ILE  29          1HG1      ILE  29  -3.517   9.046   2.718
  210   HG21  ILE  29          1HG2      ILE  29  -0.652  10.988   3.371
  211   HG22  ILE  29          2HG2      ILE  29  -1.576  11.298   4.840
  212   HG23  ILE  29          3HG2      ILE  29  -2.390  11.275   3.276
  213   HD11  ILE  29          3HD1      ILE  29  -0.959   9.803   1.706
  214   HD12  ILE  29          1HD1      ILE  29  -2.533   9.782   0.905
  215   HD13  ILE  29          2HD1      ILE  29  -1.526   8.334   0.911
  216    H    GLU  30           H        GLU  30  -0.396   7.739   6.613
  217    HA   GLU  30           HA       GLU  30   0.433  10.113   7.946
  218    HB2  GLU  30           2HB      GLU  30  -1.042   8.381   9.002
  219    HB3  GLU  30           1HB      GLU  30   0.364   7.330   9.093
  220    HG2  GLU  30           2HG      GLU  30   0.745   9.994  10.255
  221    HG3  GLU  30           1HG      GLU  30  -0.459   8.993  11.065
  222    H    ALA  31           H        ALA  31   2.072   8.220   6.044
  223    HA   ALA  31           HA       ALA  31   4.534   8.064   7.598
  224    HB1  ALA  31           1HB      ALA  31   5.256   7.131   5.180
  225    HB2  ALA  31           2HB      ALA  31   3.524   6.797   5.135
  226    HB3  ALA  31           3HB      ALA  31   4.517   6.132   6.432
  227    H    PHE  32           H        PHE  32   3.095   9.879   4.993
  228    HA   PHE  32           HA       PHE  32   5.384  11.044   3.887
  229    HB2  PHE  32           2HB      PHE  32   2.491  11.675   3.941
  230    HB3  PHE  32           1HB      PHE  32   3.566  13.012   3.550
  231    HD1  PHE  32           1HD      PHE  32   3.823   9.401   2.690
  232    HD2  PHE  32           2HD      PHE  32   3.312  13.386   1.286
  233    HE1  PHE  32           1HE      PHE  32   3.971   8.598   0.369
  234    HE2  PHE  32           2HE      PHE  32   3.459  12.591  -1.038
  235    HZ   PHE  32           HZ       PHE  32   3.789  10.193  -1.498
  236    H    TYR  33           H        TYR  33   3.692  11.708   6.849
  237    HA   TYR  33           HA       TYR  33   5.151  14.205   7.250
  238    HB2  TYR  33           2HB      TYR  33   3.166  12.919   9.128
  239    HB3  TYR  33           1HB      TYR  33   3.712  14.593   9.122
  240    HD1  TYR  33           1HD      TYR  33   1.633  12.108   7.360
  241    HD2  TYR  33           2HD      TYR  33   2.723  16.210   7.664
  242    HE1  TYR  33           1HE      TYR  33  -0.263  12.713   5.919
  243    HE2  TYR  33           2HE      TYR  33   0.827  16.827   6.225
  244    HH   TYR  33           HH       TYR  33  -1.633  15.429   5.723
  245    H    ASN  34           H        ASN  34   6.801  11.982   7.149
  246    HA   ASN  34           HA       ASN  34   8.300  12.257   9.496
  247    HB2  ASN  34           2HB      ASN  34   8.039   9.881  10.351
  248    HB3  ASN  34           1HB      ASN  34   6.688  10.966  10.673
  249   HD21  ASN  34          1HD2      ASN  34   7.530   7.966   9.600
  250   HD22  ASN  34          2HD2      ASN  34   6.085   7.555   8.746
  251    H    PHE  35           H        PHE  35   8.702  12.260   6.685
  252    HA   PHE  35           HA       PHE  35  11.087  10.803   6.495
  253    HB2  PHE  35           2HB      PHE  35   9.308   8.948   6.309
  254    HB3  PHE  35           1HB      PHE  35   8.967   9.617   4.716
  255    HD1  PHE  35           2HD      PHE  35  12.147   9.010   6.569
  256    HD2  PHE  35           1HD      PHE  35   9.802   8.209   3.109
  257    HE1  PHE  35           2HE      PHE  35  13.998   7.692   5.625
  258    HE2  PHE  35           1HE      PHE  35  11.649   6.889   2.159
  259    HZ   PHE  35           HZ       PHE  35  13.750   6.629   3.418
  260    H    ASP  36           H        ASP  36  11.429  13.074   5.894
  261    HA   ASP  36           HA       ASP  36  11.798  13.386   3.134
  262    HB2  ASP  36           2HB      ASP  36   9.209  13.742   3.543
  263    HB3  ASP  36           1HB      ASP  36   9.733  15.348   4.039
  264    H    GLY  37           H        GLY  37  13.823  13.838   4.254
  265    HA2  GLY  37           2HA      GLY  37  13.960  16.666   5.094
  266    HA3  GLY  37           1HA      GLY  37  14.854  15.410   5.939
  267    H    ASP  38           H        ASP  38  15.756  13.921   3.750
  268    HA   ASP  38           HA       ASP  38  16.960  15.433   1.718
  269    HB2  ASP  38           2HB      ASP  38  18.155  16.122   4.014
  270    HB3  ASP  38           1HB      ASP  38  19.100  14.681   3.644
  271    H    TYR  39           H        TYR  39  16.051  13.465   0.801
  272    HA   TYR  39           HA       TYR  39  17.995  11.258   0.889
  273    HB2  TYR  39           2HB      TYR  39  15.006  11.130   1.112
  274    HB3  TYR  39           1HB      TYR  39  15.892   9.787   0.397
  275    HD1  TYR  39           1HD      TYR  39  16.021  11.966   3.435
  276    HD2  TYR  39           2HD      TYR  39  16.540   8.073   1.798
  277    HE1  TYR  39           1HE      TYR  39  16.491  11.090   5.684
  278    HE2  TYR  39           2HE      TYR  39  17.011   7.186   4.042
  279    HH   TYR  39           HH       TYR  39  17.971   8.715   6.462
  280    H    ASP  40           H        ASP  40  17.816   9.817  -1.052
  281    HA   ASP  40           HA       ASP  40  17.387  11.481  -3.431
  282    HB2  ASP  40           2HB      ASP  40  19.249   9.264  -2.752
  283    HB3  ASP  40           1HB      ASP  40  18.716   9.382  -4.427
  284    H    GLY  41           H        GLY  41  15.207  10.152  -2.033
  285    HA2  GLY  41           2HA      GLY  41  13.296   9.005  -2.580
  286    HA3  GLY  41           1HA      GLY  41  13.833   9.088  -4.251
  287    H    PHE  42           H        PHE  42  15.404   7.503  -1.499
  288    HA   PHE  42           HA       PHE  42  14.663   4.879  -2.482
  289    HB2  PHE  42           2HB      PHE  42  17.520   5.859  -2.512
  290    HB3  PHE  42           1HB      PHE  42  17.080   4.156  -2.578
  291    HD1  PHE  42           2HD      PHE  42  15.440   3.479  -4.477
  292    HD2  PHE  42           1HD      PHE  42  17.749   7.054  -4.470
  293    HE1  PHE  42           2HE      PHE  42  15.198   3.635  -6.921
  294    HE2  PHE  42           1HE      PHE  42  17.511   7.217  -6.913
  295    HZ   PHE  42           HZ       PHE  42  16.234   5.506  -8.142
  296    H    VAL  43           H        VAL  43  14.257   3.633  -0.788
  297    HA   VAL  43           HA       VAL  43  15.763   4.092   1.700
  298    HB   VAL  43           HB       VAL  43  13.514   5.039   1.946
  299   HG11  VAL  43          1HG1      VAL  43  12.406   3.550   0.299
  300   HG12  VAL  43          2HG1      VAL  43  11.529   3.688   1.822
  301   HG13  VAL  43          3HG1      VAL  43  12.483   2.245   1.482
  302   HG21  VAL  43          3HG2      VAL  43  14.492   4.200   3.944
  303   HG22  VAL  43          1HG2      VAL  43  14.086   2.536   3.522
  304   HG23  VAL  43          2HG2      VAL  43  12.808   3.678   3.941
  305    H    SER  44           H        SER  44  16.763   2.332   2.414
  306    HA   SER  44           HA       SER  44  16.362  -0.203   1.136
  307    HB2  SER  44           2HB      SER  44  18.245  -0.956   2.377
  308    HB3  SER  44           1HB      SER  44  18.584   0.727   1.974
  309    HG   SER  44           HG       SER  44  18.768   1.051   4.029
  310    H    VAL  45           H        VAL  45  15.658  -2.133   2.078
  311    HA   VAL  45           HA       VAL  45  13.420  -1.978   3.740
  312    HB   VAL  45           HB       VAL  45  15.181  -4.386   3.240
  313   HG11  VAL  45          1HG1      VAL  45  13.598  -5.723   4.166
  314   HG12  VAL  45          2HG1      VAL  45  12.278  -4.629   3.759
  315   HG13  VAL  45          3HG1      VAL  45  13.317  -4.279   5.138
  316   HG21  VAL  45          3HG2      VAL  45  13.690  -4.928   1.428
  317   HG22  VAL  45          1HG2      VAL  45  14.327  -3.305   1.180
  318   HG23  VAL  45          2HG2      VAL  45  12.687  -3.523   1.783
  319    H    GLU  46           H        GLU  46  16.794  -2.692   4.472
  320    HA   GLU  46           HA       GLU  46  16.538  -3.543   7.104
  321    HB2  GLU  46           2HB      GLU  46  18.807  -1.812   6.142
  322    HB3  GLU  46           1HB      GLU  46  18.849  -3.080   7.360
  323    HG2  GLU  46           2HG      GLU  46  18.250  -4.683   5.477
  324    HG3  GLU  46           1HG      GLU  46  18.651  -3.360   4.382
  325    H    GLU  47           H        GLU  47  16.377  -0.332   5.753
  326    HA   GLU  47           HA       GLU  47  16.346   0.876   8.415
  327    HB2  GLU  47           2HB      GLU  47  17.631   1.809   6.362
  328    HB3  GLU  47           1HB      GLU  47  16.056   2.390   5.837
  329    HG2  GLU  47           2HG      GLU  47  17.282   4.123   7.006
  330    HG3  GLU  47           1HG      GLU  47  15.829   3.669   7.895
  331    H    PHE  48           H        PHE  48  14.275   0.182   5.690
  332    HA   PHE  48           HA       PHE  48  12.102   1.825   6.294
  333    HB2  PHE  48           2HB      PHE  48  12.670  -0.023   4.351
  334    HB3  PHE  48           1HB      PHE  48  11.385  -0.825   5.248
  335    HD1  PHE  48           1HD      PHE  48   9.820   1.605   6.069
  336    HD2  PHE  48           2HD      PHE  48  11.580   0.500   2.354
  337    HE1  PHE  48           1HE      PHE  48   8.147   2.960   4.877
  338    HE2  PHE  48           2HE      PHE  48   9.912   1.855   1.156
  339    HZ   PHE  48           HZ       PHE  48   8.193   3.088   2.418
  340    H    ARG  49           H        ARG  49  12.913  -1.416   7.456
  341    HA   ARG  49           HA       ARG  49  10.551  -1.984   8.821
  342    HB2  ARG  49           2HB      ARG  49  13.383  -2.793   9.508
  343    HB3  ARG  49           1HB      ARG  49  11.937  -3.517  10.197
  344    HG2  ARG  49           2HG      ARG  49  11.488  -4.722   8.343
  345    HG3  ARG  49           1HG      ARG  49  12.095  -3.474   7.253
  346    HD2  ARG  49           2HD      ARG  49  13.910  -4.735   6.985
  347    HD3  ARG  49           1HD      ARG  49  14.342  -4.326   8.644
  348    HE   ARG  49           HE       ARG  49  13.342  -6.845   7.677
  349   HH11  ARG  49          1HH1      ARG  49  13.709  -4.786  10.471
  350   HH12  ARG  49          2HH1      ARG  49  13.613  -6.093  11.602
  351   HH21  ARG  49          1HH2      ARG  49  13.215  -8.565   9.165
  352   HH22  ARG  49          2HH2      ARG  49  13.333  -8.238  10.861
  353    H    GLY  50           H        GLY  50  13.508  -0.396  10.011
  354    HA2  GLY  50           2HA      GLY  50  12.664  -0.004  12.653
  355    HA3  GLY  50           1HA      GLY  50  13.864   0.974  11.819
  356    H    ILE  51           H        ILE  51  11.878   1.742   9.741
  357    HA   ILE  51           HA       ILE  51  10.746   3.985  11.191
  358    HB   ILE  51           HB       ILE  51  10.468   3.421   8.243
  359   HG12  ILE  51          2HG1      ILE  51  12.544   5.315   9.199
  360   HG13  ILE  51          1HG1      ILE  51  12.894   3.601   9.402
  361   HG21  ILE  51          1HG2      ILE  51  10.015   5.735   8.021
  362   HG22  ILE  51          2HG2      ILE  51  10.499   6.060   9.685
  363   HG23  ILE  51          3HG2      ILE  51   9.023   5.153   9.359
  364   HD11  ILE  51          3HD1      ILE  51  11.985   3.727   6.822
  365   HD12  ILE  51          1HD1      ILE  51  13.675   3.694   7.324
  366   HD13  ILE  51          2HD1      ILE  51  12.882   5.235   7.001
  367    H    ILE  52           H        ILE  52   9.564   1.398   9.059
  368    HA   ILE  52           HA       ILE  52   6.848   2.002   9.192
  369    HB   ILE  52           HB       ILE  52   8.141   0.268   7.731
  370   HG12  ILE  52          2HG1      ILE  52   5.863  -1.107   7.688
  371   HG13  ILE  52          1HG1      ILE  52   5.324   0.233   8.696
  372   HG21  ILE  52          1HG2      ILE  52   7.176  -1.524   9.952
  373   HG22  ILE  52          2HG2      ILE  52   8.865  -1.133   9.620
  374   HG23  ILE  52          3HG2      ILE  52   7.917  -2.035   8.435
  375   HD11  ILE  52          3HD1      ILE  52   5.199   1.610   6.959
  376   HD12  ILE  52          1HD1      ILE  52   5.343   0.168   5.954
  377   HD13  ILE  52          2HD1      ILE  52   6.779   1.116   6.345
  378    H    ARG  53           H        ARG  53   8.841   0.011  11.327
  379    HA   ARG  53           HA       ARG  53   6.960  -1.234  12.880
  380    HB2  ARG  53           2HB      ARG  53   9.678  -0.138  13.455
  381    HB3  ARG  53           1HB      ARG  53   8.707  -0.717  14.801
  382    HG2  ARG  53           2HG      ARG  53   8.508  -2.899  13.721
  383    HG3  ARG  53           1HG      ARG  53   9.485  -2.318  12.372
  384    HD2  ARG  53           2HD      ARG  53  11.165  -3.248  13.564
  385    HD3  ARG  53           1HD      ARG  53  11.118  -1.702  14.410
  386    HE   ARG  53           HE       ARG  53  10.369  -2.792  16.274
  387   HH11  ARG  53          1HH1      ARG  53   9.915  -4.871  13.507
  388   HH12  ARG  53          2HH1      ARG  53   9.434  -6.237  14.456
  389   HH21  ARG  53          1HH2      ARG  53   9.736  -4.588  17.523
  390   HH22  ARG  53          2HH2      ARG  53   9.332  -6.076  16.735
  391    H    ASP  54           H        ASP  54   8.502   1.810  13.917
  392    HA   ASP  54           HA       ASP  54   6.143   2.414  15.524
  393    HB2  ASP  54           2HB      ASP  54   8.592   2.603  16.338
  394    HB3  ASP  54           1HB      ASP  54   8.634   4.096  15.406
  395    H    GLY  55           H        GLY  55   6.555   2.730  12.448
  396    HA2  GLY  55           2HA      GLY  55   5.776   5.570  12.292
  397    HA3  GLY  55           1HA      GLY  55   6.504   4.660  10.978
  398    H    LEU  56           H        LEU  56   5.096   2.503  10.598
  399    HA   LEU  56           HA       LEU  56   2.278   3.336  10.450
  400    HB2  LEU  56           2HB      LEU  56   3.576   1.752   8.261
  401    HB3  LEU  56           1HB      LEU  56   2.083   2.670   8.215
  402    HG   LEU  56           HG       LEU  56   4.847   3.874   8.379
  403   HD11  LEU  56          1HD1      LEU  56   3.703   2.688   6.190
  404   HD12  LEU  56          2HD1      LEU  56   4.943   3.941   6.150
  405   HD13  LEU  56          3HD1      LEU  56   3.242   4.380   5.999
  406   HD21  LEU  56          3HD2      LEU  56   2.508   5.464   7.545
  407   HD22  LEU  56          1HD2      LEU  56   3.902   5.917   8.526
  408   HD23  LEU  56          2HD2      LEU  56   2.572   5.014   9.249
  409    HA   PRO  57           HA       PRO  57   1.663  -0.719  12.186
  410    HB2  PRO  57           2HB      PRO  57  -1.018  -0.763  12.191
  411    HB3  PRO  57           1HB      PRO  57  -0.110   0.303  13.272
  412    HG2  PRO  57           2HG      PRO  57  -1.476   0.943  10.689
  413    HG3  PRO  57           1HG      PRO  57  -1.447   1.870  12.199
  414    HD2  PRO  57           2HD      PRO  57   0.150   2.410  10.032
  415    HD3  PRO  57           1HD      PRO  57   0.566   2.840  11.701
  416    H    MET  58           H        MET  58   2.477  -2.079  10.594
  417    HA   MET  58           HA       MET  58   0.472  -3.089   8.693
  418    HB2  MET  58           2HB      MET  58   2.935  -1.813   8.066
  419    HB3  MET  58           1HB      MET  58   3.101  -3.513   7.648
  420    HG2  MET  58           2HG      MET  58   1.361  -3.429   6.104
  421    HG3  MET  58           1HG      MET  58   0.717  -1.933   6.772
  422    HE1  MET  58           3HE      MET  58   3.439  -3.730   5.101
  423    HE2  MET  58           1HE      MET  58   4.721  -2.527   5.206
  424    HE3  MET  58           2HE      MET  58   3.825  -2.731   3.700
  425    H    THR  59           H        THR  59   0.354  -5.276   8.467
  426    HA   THR  59           HA       THR  59   1.580  -6.873  10.518
  427    HB   THR  59           HB       THR  59   0.358  -8.652   8.802
  428    HG1  THR  59           1HG      THR  59  -1.264  -6.337   8.832
  429   HG21  THR  59          3HG2      THR  59  -1.731  -7.855  10.376
  430   HG22  THR  59          1HG2      THR  59  -0.323  -7.358  11.314
  431   HG23  THR  59          2HG2      THR  59  -0.500  -9.041  10.814
  432    H    GLU  60           H        GLU  60   2.998  -8.615  10.234
  433    HA   GLU  60           HA       GLU  60   5.228  -8.353   8.743
  434    HB2  GLU  60           2HB      GLU  60   5.357 -10.922   8.793
  435    HB3  GLU  60           1HB      GLU  60   5.267 -10.074  10.330
  436    HG2  GLU  60           2HG      GLU  60   2.740 -10.494  10.177
  437    HG3  GLU  60           1HG      GLU  60   3.155 -11.668   8.932
  438    H    ALA  61           H        ALA  61   2.429 -10.260   7.756
  439    HA   ALA  61           HA       ALA  61   3.231 -11.166   5.311
  440    HB1  ALA  61           1HB      ALA  61   0.513 -10.325   5.080
  441    HB2  ALA  61           2HB      ALA  61   0.793 -10.944   6.708
  442    HB3  ALA  61           3HB      ALA  61   1.157 -11.950   5.307
  443    H    GLU  62           H        GLU  62   1.575  -8.068   5.948
  444    HA   GLU  62           HA       GLU  62   1.591  -7.115   3.327
  445    HB2  GLU  62           2HB      GLU  62   2.117  -5.095   5.424
  446    HB3  GLU  62           1HB      GLU  62   0.882  -5.121   4.174
  447    HG2  GLU  62           2HG      GLU  62  -0.159  -7.006   5.627
  448    HG3  GLU  62           1HG      GLU  62   0.852  -6.320   6.897
  449    H    ILE  63           H        ILE  63   3.870  -6.222   5.913
  450    HA   ILE  63           HA       ILE  63   5.739  -4.912   4.299
  451    HB   ILE  63           HB       ILE  63   6.549  -6.512   6.715
  452   HG12  ILE  63          2HG1      ILE  63   5.984  -3.964   7.635
  453   HG13  ILE  63          1HG1      ILE  63   4.632  -4.315   6.561
  454   HG21  ILE  63          1HG2      ILE  63   8.110  -5.120   5.120
  455   HG22  ILE  63          2HG2      ILE  63   8.345  -5.106   6.868
  456   HG23  ILE  63          3HG2      ILE  63   7.507  -3.768   6.080
  457   HD11  ILE  63          3HD1      ILE  63   3.751  -5.314   8.340
  458   HD12  ILE  63          1HD1      ILE  63   5.301  -5.436   9.167
  459   HD13  ILE  63          2HD1      ILE  63   4.849  -6.635   7.953
  460    H    THR  64           H        THR  64   6.047  -8.189   5.643
  461    HA   THR  64           HA       THR  64   8.291  -9.004   4.263
  462    HB   THR  64           HB       THR  64   5.894 -10.587   5.161
  463    HG1  THR  64           1HG      THR  64   7.014  -9.632   6.849
  464   HG21  THR  64          3HG2      THR  64   8.583 -11.609   4.299
  465   HG22  THR  64          1HG2      THR  64   7.019 -11.956   3.559
  466   HG23  THR  64          2HG2      THR  64   7.380 -12.553   5.179
  467    H    GLU  65           H        GLU  65   4.880  -9.447   3.315
  468    HA   GLU  65           HA       GLU  65   5.507 -10.665   0.844
  469    HB2  GLU  65           2HB      GLU  65   3.273 -10.784   2.009
  470    HB3  GLU  65           1HB      GLU  65   2.992  -9.139   1.454
  471    HG2  GLU  65           2HG      GLU  65   1.905 -10.377  -0.146
  472    HG3  GLU  65           1HG      GLU  65   3.479 -10.118  -0.896
  473    H    PHE  66           H        PHE  66   5.700  -7.564   1.910
  474    HA   PHE  66           HA       PHE  66   5.585  -6.404  -0.749
  475    HB2  PHE  66           2HB      PHE  66   5.483  -5.272   2.005
  476    HB3  PHE  66           1HB      PHE  66   6.147  -4.260   0.730
  477    HD1  PHE  66           1HD      PHE  66   4.456  -5.040  -1.559
  478    HD2  PHE  66           2HD      PHE  66   3.441  -4.286   2.505
  479    HE1  PHE  66           1HE      PHE  66   2.183  -4.401  -2.250
  480    HE2  PHE  66           2HE      PHE  66   1.165  -3.650   1.822
  481    HZ   PHE  66           HZ       PHE  66   0.533  -3.706  -0.557
  482    H    PHE  67           H        PHE  67   7.812  -7.406   1.686
  483    HA   PHE  67           HA       PHE  67  10.051  -5.902   0.638
  484    HB2  PHE  67           2HB      PHE  67   9.699  -7.970   2.789
  485    HB3  PHE  67           1HB      PHE  67  11.309  -7.528   2.238
  486    HD1  PHE  67           2HD      PHE  67   9.739  -4.565   1.801
  487    HD2  PHE  67           1HD      PHE  67  10.823  -7.187   4.980
  488    HE1  PHE  67           2HE      PHE  67   9.743  -2.668   3.361
  489    HE2  PHE  67           1HE      PHE  67  10.827  -5.290   6.544
  490    HZ   PHE  67           HZ       PHE  67  10.289  -3.027   5.735
  491    H    GLU  68           H        GLU  68   8.641  -9.056   0.215
  492    HA   GLU  68           HA       GLU  68  10.951 -10.002  -1.300
  493    HB2  GLU  68           2HB      GLU  68   8.372 -11.484  -0.797
  494    HB3  GLU  68           1HB      GLU  68   9.927 -12.157  -1.268
  495    HG2  GLU  68           2HG      GLU  68  10.575 -10.933   1.059
  496    HG3  GLU  68           1HG      GLU  68   8.909 -11.417   1.378
  497    H    ALA  69           H        ALA  69   7.705  -8.826  -1.759
  498    HA   ALA  69           HA       ALA  69   7.607  -9.623  -4.527
  499    HB1  ALA  69           1HB      ALA  69   5.413  -8.609  -4.564
  500    HB2  ALA  69           2HB      ALA  69   5.718  -7.878  -2.988
  501    HB3  ALA  69           3HB      ALA  69   5.577  -9.630  -3.134
  502    H    ALA  70           H        ALA  70   8.883  -7.142  -2.827
  503    HA   ALA  70           HA       ALA  70   8.738  -5.233  -5.051
  504    HB1  ALA  70           1HB      ALA  70   8.058  -4.414  -2.826
  505    HB2  ALA  70           2HB      ALA  70   9.435  -3.530  -3.486
  506    HB3  ALA  70           3HB      ALA  70   9.686  -4.744  -2.230
  507    H    ASP  71           H        ASP  71  10.934  -7.176  -3.165
  508    HA   ASP  71           HA       ASP  71  13.156  -6.243  -4.862
  509    HB2  ASP  71           2HB      ASP  71  13.148  -5.860  -2.246
  510    HB3  ASP  71           1HB      ASP  71  13.673  -7.541  -2.220
  511    HA   PRO  72           HA       PRO  72  12.535 -10.610  -6.095
  512    HB2  PRO  72           2HB      PRO  72  13.939 -10.354  -8.429
  513    HB3  PRO  72           1HB      PRO  72  12.223  -9.963  -8.269
  514    HG2  PRO  72           2HG      PRO  72  14.595  -8.139  -8.225
  515    HG3  PRO  72           1HG      PRO  72  13.026  -7.920  -9.023
  516    HD2  PRO  72           2HD      PRO  72  13.623  -6.709  -6.693
  517    HD3  PRO  72           1HD      PRO  72  11.980  -7.268  -7.067
  518    H    ASN  73           H        ASN  73  15.518  -8.710  -6.172
  519    HA   ASN  73           HA       ASN  73  17.222 -11.022  -6.140
  520    HB2  ASN  73           2HB      ASN  73  19.018  -9.285  -5.652
  521    HB3  ASN  73           1HB      ASN  73  18.142  -9.090  -7.167
  522   HD21  ASN  73          1HD2      ASN  73  18.359  -6.937  -7.419
  523   HD22  ASN  73          2HD2      ASN  73  17.707  -5.761  -6.334
  524    H    ASN  74           H        ASN  74  15.791  -8.905  -3.773
  525    HA   ASN  74           HA       ASN  74  15.545  -9.120  -1.521
  526    HB2  ASN  74           2HB      ASN  74  17.220 -11.631  -1.671
  527    HB3  ASN  74           1HB      ASN  74  16.125 -11.150  -0.382
  528   HD21  ASN  74          1HD2      ASN  74  14.687 -12.766  -0.427
  529   HD22  ASN  74          2HD2      ASN  74  13.708 -13.175  -1.792
  530    H    THR  75           H        THR  75  17.359  -7.390  -2.428
  531    HA   THR  75           HA       THR  75  19.841  -7.824  -0.958
  532    HB   THR  75           HB       THR  75  20.736  -5.965  -2.152
  533    HG1  THR  75           1HG      THR  75  19.517  -4.366  -2.685
  534   HG21  THR  75          3HG2      THR  75  19.729  -6.454  -4.579
  535   HG22  THR  75          1HG2      THR  75  19.183  -7.901  -3.733
  536   HG23  THR  75          2HG2      THR  75  20.901  -7.504  -3.783
  537    H    GLY  76           H        GLY  76  17.194  -7.299   0.330
  538    HA2  GLY  76           2HA      GLY  76  16.329  -6.051   2.047
  539    HA3  GLY  76           1HA      GLY  76  18.006  -5.713   2.453
  540    H    PHE  77           H        PHE  77  16.791  -4.761  -0.641
  541    HA   PHE  77           HA       PHE  77  16.285  -2.033   0.261
  542    HB2  PHE  77           2HB      PHE  77  18.468  -1.589  -0.284
  543    HB3  PHE  77           1HB      PHE  77  18.567  -2.922  -1.428
  544    HD1  PHE  77           2HD      PHE  77  17.078   0.460  -1.000
  545    HD2  PHE  77           1HD      PHE  77  18.510  -2.504  -3.698
  546    HE1  PHE  77           2HE      PHE  77  16.841   2.049  -2.865
  547    HE2  PHE  77           1HE      PHE  77  18.274  -0.921  -5.568
  548    HZ   PHE  77           HZ       PHE  77  17.438   1.359  -5.152
  549    H    ILE  78           H        ILE  78  14.587  -1.168  -0.753
  550    HA   ILE  78           HA       ILE  78  13.514  -2.584  -3.099
  551    HB   ILE  78           HB       ILE  78  12.059  -0.587  -1.373
  552   HG12  ILE  78          2HG1      ILE  78  11.477  -3.492  -1.162
  553   HG13  ILE  78          1HG1      ILE  78  12.902  -2.883  -0.319
  554   HG21  ILE  78          1HG2      ILE  78  10.065  -1.746  -2.353
  555   HG22  ILE  78          2HG2      ILE  78  11.170  -2.568  -3.453
  556   HG23  ILE  78          3HG2      ILE  78  11.029  -0.811  -3.494
  557   HD11  ILE  78          3HD1      ILE  78  11.666  -1.908   1.260
  558   HD12  ILE  78          1HD1      ILE  78  10.348  -2.911   0.654
  559   HD13  ILE  78          2HD1      ILE  78  10.525  -1.249   0.086
  560    H    ASP  79           H        ASP  79  12.541  -1.355  -4.793
  561    HA   ASP  79           HA       ASP  79  14.000   1.087  -5.393
  562    HB2  ASP  79           2HB      ASP  79  12.033  -0.578  -6.987
  563    HB3  ASP  79           1HB      ASP  79  12.729   0.926  -7.580
  564    H    TYR  80           H        TYR  80  13.188   2.664  -4.101
  565    HA   TYR  80           HA       TYR  80  10.921   3.164  -2.909
  566    HB2  TYR  80           2HB      TYR  80  12.766   4.793  -3.048
  567    HB3  TYR  80           1HB      TYR  80  12.231   5.252  -4.661
  568    HD1  TYR  80           2HD      TYR  80  10.114   6.484  -4.962
  569    HD2  TYR  80           1HD      TYR  80  11.638   5.595  -1.090
  570    HE1  TYR  80           2HE      TYR  80   8.609   8.165  -3.990
  571    HE2  TYR  80           1HE      TYR  80  10.136   7.276  -0.107
  572    HH   TYR  80           HH       TYR  80   7.777   8.326  -0.901
  573    H    LYS  81           H        LYS  81  11.212   3.525  -6.424
  574    HA   LYS  81           HA       LYS  81   8.635   4.601  -6.824
  575    HB2  LYS  81           2HB      LYS  81  10.661   3.271  -8.571
  576    HB3  LYS  81           1HB      LYS  81   9.027   3.480  -9.189
  577    HG2  LYS  81           2HG      LYS  81  10.704   5.731  -8.104
  578    HG3  LYS  81           1HG      LYS  81  10.627   5.287  -9.811
  579    HD2  LYS  81           2HD      LYS  81   8.287   6.128  -8.100
  580    HD3  LYS  81           1HD      LYS  81   9.111   7.141  -9.288
  581    HE2  LYS  81           2HE      LYS  81   7.513   4.639  -9.795
  582    HE3  LYS  81           1HE      LYS  81   7.127   6.283 -10.304
  583    HZ1  LYS  81           3HZ      LYS  81   9.318   6.151 -11.578
  584    HZ2  LYS  81           1HZ      LYS  81   8.000   5.285 -12.194
  585    HZ3  LYS  81           2HZ      LYS  81   9.220   4.478 -11.344
  586    H    ALA  82           H        ALA  82   9.832   1.260  -7.185
  587    HA   ALA  82           HA       ALA  82   7.419   0.042  -7.835
  588    HB1  ALA  82           1HB      ALA  82   8.675  -1.797  -7.809
  589    HB2  ALA  82           2HB      ALA  82   8.960  -1.646  -6.074
  590    HB3  ALA  82           3HB      ALA  82  10.010  -0.808  -7.218
  591    H    PHE  83           H        PHE  83   8.543   1.309  -4.824
  592    HA   PHE  83           HA       PHE  83   6.444  -0.018  -3.302
  593    HB2  PHE  83           2HB      PHE  83   9.047   0.928  -2.714
  594    HB3  PHE  83           1HB      PHE  83   7.925   1.891  -1.755
  595    HD1  PHE  83           2HD      PHE  83   7.611  -1.651  -2.795
  596    HD2  PHE  83           1HD      PHE  83   8.242   1.076   0.408
  597    HE1  PHE  83           2HE      PHE  83   7.425  -3.501  -1.193
  598    HE2  PHE  83           1HE      PHE  83   8.058  -0.773   2.022
  599    HZ   PHE  83           HZ       PHE  83   7.649  -3.066   1.223
  600    H    ALA  84           H        ALA  84   7.278   3.108  -4.611
  601    HA   ALA  84           HA       ALA  84   5.245   4.521  -3.133
  602    HB1  ALA  84           1HB      ALA  84   5.884   6.334  -4.908
  603    HB2  ALA  84           2HB      ALA  84   7.246   5.256  -5.216
  604    HB3  ALA  84           3HB      ALA  84   7.000   5.927  -3.605
  605    H    ALA  85           H        ALA  85   5.637   3.230  -6.393
  606    HA   ALA  85           HA       ALA  85   3.200   4.313  -7.370
  607    HB1  ALA  85           1HB      ALA  85   3.584   2.976  -9.346
  608    HB2  ALA  85           2HB      ALA  85   4.809   2.040  -8.486
  609    HB3  ALA  85           3HB      ALA  85   5.090   3.746  -8.843
  610    H    MET  86           H        MET  86   3.880   1.830  -5.355
  611    HA   MET  86           HA       MET  86   1.905  -0.075  -6.055
  612    HB2  MET  86           2HB      MET  86   3.949  -0.318  -4.471
  613    HB3  MET  86           1HB      MET  86   2.875   0.331  -3.240
  614    HG2  MET  86           2HG      MET  86   2.872  -2.063  -3.121
  615    HG3  MET  86           1HG      MET  86   1.298  -1.505  -3.684
  616    HE1  MET  86           3HE      MET  86   4.715  -2.389  -6.183
  617    HE2  MET  86           1HE      MET  86   4.425  -4.028  -5.597
  618    HE3  MET  86           2HE      MET  86   4.671  -2.712  -4.449
  619    H    LEU  87           H        LEU  87   1.914   2.776  -4.001
  620    HA   LEU  87           HA       LEU  87  -0.880   2.322  -3.321
  621    HB2  LEU  87           2HB      LEU  87   1.040   4.363  -2.271
  622    HB3  LEU  87           1HB      LEU  87  -0.586   4.102  -1.668
  623    HG   LEU  87           HG       LEU  87   0.590   1.605  -1.425
  624   HD11  LEU  87          1HD1      LEU  87   2.738   1.781  -0.628
  625   HD12  LEU  87          2HD1      LEU  87   2.570   3.490  -0.233
  626   HD13  LEU  87          3HD1      LEU  87   2.750   2.989  -1.912
  627   HD21  LEU  87          3HD2      LEU  87   0.515   2.049   0.964
  628   HD22  LEU  87          1HD2      LEU  87  -0.919   2.698   0.168
  629   HD23  LEU  87          2HD2      LEU  87   0.384   3.780   0.655
  630    H    TYR  88           H        TYR  88   0.890   3.828  -5.498
  631    HA   TYR  88           HA       TYR  88  -1.199   5.805  -6.107
  632    HB2  TYR  88           2HB      TYR  88   1.779   6.100  -6.549
  633    HB3  TYR  88           1HB      TYR  88   0.560   7.244  -7.105
  634    HD1  TYR  88           1HD      TYR  88   1.512   5.525  -3.917
  635    HD2  TYR  88           2HD      TYR  88   0.268   9.125  -5.813
  636    HE1  TYR  88           1HE      TYR  88   1.640   6.698  -1.761
  637    HE2  TYR  88           2HE      TYR  88   0.393  10.308  -3.662
  638    HH   TYR  88           HH       TYR  88   1.862   8.927  -0.886
  639    H    SER  89           H        SER  89  -0.663   2.984  -7.018
  640    HA   SER  89           HA       SER  89   0.273   2.929  -9.646
  641    HB2  SER  89           2HB      SER  89  -1.451   1.178  -7.975
  642    HB3  SER  89           1HB      SER  89  -1.526   0.936  -9.721
  643    HG   SER  89           HG       SER  89   0.798   0.761  -9.655
  644    H    VAL  90           H        VAL  90  -0.499   4.724 -10.776
  645    HA   VAL  90           HA       VAL  90  -2.972   4.317 -12.139
  646    HB   VAL  90           HB       VAL  90  -3.842   5.334 -10.072
  647   HG11  VAL  90          1HG1      VAL  90  -3.060   7.229  -9.126
  648   HG12  VAL  90          2HG1      VAL  90  -2.691   7.981 -10.679
  649   HG13  VAL  90          3HG1      VAL  90  -1.585   6.793  -9.990
  650   HG21  VAL  90          3HG2      VAL  90  -4.656   5.843 -12.526
  651   HG22  VAL  90          1HG2      VAL  90  -4.137   7.478 -12.116
  652   HG23  VAL  90          2HG2      VAL  90  -5.364   6.669 -11.139
  653    H    ASP  91           H        ASP  91  -0.447   4.449 -13.120
  654    HA   ASP  91           HA       ASP  91  -0.509   6.961 -14.638
  655    HB2  ASP  91           2HB      ASP  91   1.737   5.834 -13.049
  656    HB3  ASP  91           1HB      ASP  91   2.139   6.537 -14.614
  657    H    GLU  92           H        GLU  92  -1.579   5.664 -16.243
  658    HA   GLU  92           HA       GLU  92   0.309   4.415 -18.042
  659    HB2  GLU  92           2HB      GLU  92  -1.990   2.862 -16.846
  660    HB3  GLU  92           1HB      GLU  92  -1.121   2.360 -18.290
  661    HG2  GLU  92           2HG      GLU  92   0.062   2.719 -15.546
  662    HG3  GLU  92           1HG      GLU  92  -0.323   1.184 -16.323
  663    H    SER  93           H        SER  93  -1.151   3.436 -19.975
  664    HA   SER  93           HA       SER  93  -2.901   5.662 -20.755
  665    HB2  SER  93           2HB      SER  93  -0.760   4.686 -22.089
  666    HB3  SER  93           1HB      SER  93  -2.037   3.698 -22.798
  667    HG   SER  93           HG       SER  93  -2.141   6.527 -22.613
  Start of MODEL   21
    1    H1   MET   1           1HT      MET   1 -24.450  11.875 -14.240
    2    H2   MET   1           2HT      MET   1 -25.423  11.243 -12.976
    3    H3   MET   1           3HT      MET   1 -25.596  10.647 -14.575
    4    HA   MET   1           HA       MET   1 -23.073  10.465 -13.098
    5    HB2  MET   1           2HB      MET   1 -23.748   8.229 -12.404
    6    HB3  MET   1           1HB      MET   1 -24.879   9.422 -11.780
    7    HG2  MET   1           2HG      MET   1 -26.133   8.799 -14.051
    8    HG3  MET   1           1HG      MET   1 -25.279   7.282 -13.774
    9    HE1  MET   1           2HE      MET   1 -27.723   9.767 -12.936
   10    HE2  MET   1           3HE      MET   1 -27.776   9.708 -11.175
   11    HE3  MET   1           1HE      MET   1 -28.995   8.855 -12.122
   12    H    GLY   2           H        GLY   2 -21.594  10.137 -14.625
   13    HA2  GLY   2           2HA      GLY   2 -22.380   8.705 -17.074
   14    HA3  GLY   2           1HA      GLY   2 -20.992   9.773 -16.920
   15    H    SER   3           H        SER   3 -21.732   7.387 -14.489
   16    HA   SER   3           HA       SER   3 -20.609   5.553 -13.749
   17    HB2  SER   3           2HB      SER   3 -19.751   5.184 -16.626
   18    HB3  SER   3           1HB      SER   3 -19.872   3.942 -15.379
   19    HG   SER   3           HG       SER   3 -21.947   5.332 -16.695
   20    H    SER   4           H        SER   4 -19.267   8.131 -13.802
   21    HA   SER   4           HA       SER   4 -16.464   7.293 -14.122
   22    HB2  SER   4           2HB      SER   4 -16.215   9.937 -13.804
   23    HB3  SER   4           1HB      SER   4 -16.546   9.211 -15.377
   24    HG   SER   4           HG       SER   4 -18.331  10.502 -13.611
   25    H    HIS   5           H        HIS   5 -16.782   6.136 -12.046
   26    HA   HIS   5           HA       HIS   5 -16.408   5.919  -9.813
   27    HB2  HIS   5           2HB      HIS   5 -14.997   8.433 -10.527
   28    HB3  HIS   5           1HB      HIS   5 -15.256   8.126  -8.814
   29    HD1  HIS   5           1HD      HIS   5 -12.426   8.134 -10.110
   30    HD2  HIS   5           2HD      HIS   5 -14.719   4.738  -9.426
   31    HE1  HIS   5           1HE      HIS   5 -10.789   6.229  -9.998
   32    HE2  HIS   5           2HE      HIS   5 -12.191   4.197  -9.497
   33    H    HIS   6           H        HIS   6 -18.941   7.006 -10.744
   34    HA   HIS   6           HA       HIS   6 -19.759   9.038  -8.888
   35    HB2  HIS   6           2HB      HIS   6 -21.040   7.460 -11.049
   36    HB3  HIS   6           1HB      HIS   6 -22.102   8.074  -9.788
   37    HD1  HIS   6           1HD      HIS   6 -19.527   9.370 -12.259
   38    HD2  HIS   6           2HD      HIS   6 -22.846  10.668 -10.123
   39    HE1  HIS   6           1HE      HIS   6 -19.983  11.702 -13.080
   40    HE2  HIS   6           2HE      HIS   6 -21.943  12.498 -11.712
   41    H    HIS   7           H        HIS   7 -20.041   5.534  -9.109
   42    HA   HIS   7           HA       HIS   7 -20.652   3.946  -7.599
   43    HB2  HIS   7           2HB      HIS   7 -19.033   5.620  -6.238
   44    HB3  HIS   7           1HB      HIS   7 -20.501   5.785  -5.280
   45    HD1  HIS   7           1HD      HIS   7 -19.363   4.570  -3.285
   46    HD2  HIS   7           2HD      HIS   7 -19.694   2.273  -6.732
   47    HE1  HIS   7           1HE      HIS   7 -18.881   2.209  -2.568
   48    HE2  HIS   7           2HE      HIS   7 -19.001   0.850  -4.686
   49    H    HIS   8           H        HIS   8 -22.723   3.384  -7.785
   50    HA   HIS   8           HA       HIS   8 -24.685   4.678  -6.091
   51    HB2  HIS   8           2HB      HIS   8 -26.305   4.815  -8.077
   52    HB3  HIS   8           1HB      HIS   8 -25.062   6.056  -7.962
   53    HD1  HIS   8           1HD      HIS   8 -26.251   3.273 -10.096
   54    HD2  HIS   8           2HD      HIS   8 -23.002   5.856  -9.911
   55    HE1  HIS   8           1HE      HIS   8 -25.101   3.066 -12.324
   56    HE2  HIS   8           2HE      HIS   8 -23.088   4.574 -12.156
   57    H    HIS   9           H        HIS   9 -24.336   2.343  -8.764
   58    HA   HIS   9           HA       HIS   9 -24.994   0.100  -7.219
   59    HB2  HIS   9           2HB      HIS   9 -27.233   1.151  -7.150
   60    HB3  HIS   9           1HB      HIS   9 -27.285   1.126  -8.910
   61    HD1  HIS   9           1HD      HIS   9 -25.833  -1.881  -7.355
   62    HD2  HIS   9           2HD      HIS   9 -29.576  -0.580  -8.606
   63    HE1  HIS   9           1HE      HIS   9 -27.266  -3.945  -7.451
   64    HE2  HIS   9           2HE      HIS   9 -29.502  -3.146  -8.291
   65    H    HIS  10           H        HIS  10 -23.043  -0.225  -8.585
   66    HA   HIS  10           HA       HIS  10 -23.573  -2.013 -10.678
   67    HB2  HIS  10           2HB      HIS  10 -23.922   0.486 -11.625
   68    HB3  HIS  10           1HB      HIS  10 -22.192   0.313 -11.889
   69    HD1  HIS  10           1HD      HIS  10 -21.472  -1.020 -13.886
   70    HD2  HIS  10           2HD      HIS  10 -25.507  -1.504 -13.017
   71    HE1  HIS  10           1HE      HIS  10 -22.421  -2.331 -15.810
   72    HE2  HIS  10           2HE      HIS  10 -24.881  -2.537 -15.304
   73    H    SER  11           H        SER  11 -21.839  -3.295 -10.984
   74    HA   SER  11           HA       SER  11 -19.758  -4.174 -10.725
   75    HB2  SER  11           2HB      SER  11 -19.110  -1.259 -11.107
   76    HB3  SER  11           1HB      SER  11 -17.836  -2.445 -10.821
   77    HG   SER  11           HG       SER  11 -19.778  -2.758 -12.854
   78    H    SER  12           H        SER  12 -19.436  -5.102  -8.812
   79    HA   SER  12           HA       SER  12 -18.085  -3.730  -6.721
   80    HB2  SER  12           2HB      SER  12 -19.889  -4.135  -4.981
   81    HB3  SER  12           1HB      SER  12 -20.211  -2.827  -6.119
   82    HG   SER  12           HG       SER  12 -21.460  -4.396  -7.330
   83    H    GLY  13           H        GLY  13 -16.776  -5.187  -5.843
   84    HA2  GLY  13           2HA      GLY  13 -17.075  -7.974  -6.398
   85    HA3  GLY  13           1HA      GLY  13 -15.829  -7.242  -5.400
   86    H    LEU  14           H        LEU  14 -15.895  -8.655  -3.706
   87    HA   LEU  14           HA       LEU  14 -18.468  -8.968  -2.316
   88    HB2  LEU  14           2HB      LEU  14 -16.786 -10.912  -3.102
   89    HB3  LEU  14           1HB      LEU  14 -16.122 -10.587  -1.512
   90    HG   LEU  14           HG       LEU  14 -18.956 -11.422  -2.126
   91   HD11  LEU  14          1HD1      LEU  14 -18.302 -13.422  -0.793
   92   HD12  LEU  14          2HD1      LEU  14 -16.637 -12.842  -0.831
   93   HD13  LEU  14          3HD1      LEU  14 -17.457 -13.272  -2.333
   94   HD21  LEU  14          3HD2      LEU  14 -17.701 -11.008   0.579
   95   HD22  LEU  14          1HD2      LEU  14 -19.386 -11.376   0.211
   96   HD23  LEU  14          2HD2      LEU  14 -18.713  -9.803  -0.221
   97    H    VAL  15           H        VAL  15 -16.973  -6.557  -2.089
   98    HA   VAL  15           HA       VAL  15 -16.186  -6.697   0.748
   99    HB   VAL  15           HB       VAL  15 -14.229  -6.260  -0.667
  100   HG11  VAL  15          1HG1      VAL  15 -15.190  -5.228  -2.581
  101   HG12  VAL  15          2HG1      VAL  15 -14.104  -4.047  -1.847
  102   HG13  VAL  15          3HG1      VAL  15 -15.847  -3.904  -1.617
  103   HG21  VAL  15          3HG2      VAL  15 -13.509  -4.130   0.418
  104   HG22  VAL  15          1HG2      VAL  15 -14.194  -5.315   1.533
  105   HG23  VAL  15          2HG2      VAL  15 -15.159  -3.934   1.010
  106    HA   PRO  16           HA       PRO  16 -19.509  -3.908   1.640
  107    HB2  PRO  16           2HB      PRO  16 -17.547  -2.664   3.509
  108    HB3  PRO  16           1HB      PRO  16 -19.190  -3.237   3.820
  109    HG2  PRO  16           2HG      PRO  16 -17.089  -4.653   4.628
  110    HG3  PRO  16           1HG      PRO  16 -18.528  -5.456   3.976
  111    HD2  PRO  16           2HD      PRO  16 -15.874  -4.981   2.696
  112    HD3  PRO  16           1HD      PRO  16 -16.973  -6.368   2.540
  113    H    ARG  17           H        ARG  17 -20.167  -1.860   1.088
  114    HA   ARG  17           HA       ARG  17 -18.153  -0.192  -0.254
  115    HB2  ARG  17           2HB      ARG  17 -21.145  -0.006  -0.578
  116    HB3  ARG  17           1HB      ARG  17 -19.905   0.688  -1.614
  117    HG2  ARG  17           2HG      ARG  17 -19.244  -1.517  -2.356
  118    HG3  ARG  17           1HG      ARG  17 -20.403  -2.261  -1.254
  119    HD2  ARG  17           2HD      ARG  17 -20.947  -0.611  -3.705
  120    HD3  ARG  17           1HD      ARG  17 -21.435  -2.270  -3.373
  121    HE   ARG  17           HE       ARG  17 -23.192  -1.485  -2.085
  122   HH11  ARG  17          1HH1      ARG  17 -21.146   1.168  -3.078
  123   HH12  ARG  17          2HH1      ARG  17 -22.293   2.383  -2.620
  124   HH21  ARG  17          1HH2      ARG  17 -24.693   0.113  -1.483
  125   HH22  ARG  17          2HH2      ARG  17 -24.304   1.784  -1.715
  126    H    GLY  18           H        GLY  18 -18.267   2.115  -0.025
  127    HA2  GLY  18           2HA      GLY  18 -19.581   3.926   1.183
  128    HA3  GLY  18           1HA      GLY  18 -19.363   2.909   2.598
  129    H    SER  19           H        SER  19 -17.049   3.688   0.027
  130    HA   SER  19           HA       SER  19 -14.975   4.621   0.083
  131    HB2  SER  19           2HB      SER  19 -16.260   6.162   2.344
  132    HB3  SER  19           1HB      SER  19 -14.652   6.521   1.718
  133    HG   SER  19           HG       SER  19 -15.720   6.739  -0.379
  134    H    HIS  20           H        HIS  20 -15.485   2.176   1.577
  135    HA   HIS  20           HA       HIS  20 -13.354   2.401   3.602
  136    HB2  HIS  20           2HB      HIS  20 -15.888   1.702   4.174
  137    HB3  HIS  20           1HB      HIS  20 -15.244   0.118   3.752
  138    HD1  HIS  20           1HD      HIS  20 -14.287  -1.106   5.666
  139    HD2  HIS  20           2HD      HIS  20 -14.088   3.007   6.218
  140    HE1  HIS  20           1HE      HIS  20 -13.300  -0.783   7.956
  141    HE2  HIS  20           2HE      HIS  20 -13.110   1.713   8.234
  142    H    MET  21           H        MET  21 -12.959   1.937   0.799
  143    HA   MET  21           HA       MET  21 -11.875  -0.801   0.900
  144    HB2  MET  21           2HB      MET  21 -12.172  -0.880  -1.572
  145    HB3  MET  21           1HB      MET  21 -13.687  -0.786  -0.685
  146    HG2  MET  21           2HG      MET  21 -13.859   1.580  -1.179
  147    HG3  MET  21           1HG      MET  21 -12.304   1.538  -2.007
  148    HE1  MET  21           3HE      MET  21 -12.043   0.330  -4.611
  149    HE2  MET  21           1HE      MET  21 -12.379   2.008  -4.188
  150    HE3  MET  21           2HE      MET  21 -13.302   1.220  -5.468
  151    H    SER  22           H        SER  22 -11.483   2.459  -0.427
  152    HA   SER  22           HA       SER  22  -8.741   1.889  -1.168
  153    HB2  SER  22           2HB      SER  22 -10.590   4.203  -1.617
  154    HB3  SER  22           1HB      SER  22  -8.852   4.413  -1.834
  155    HG   SER  22           HG       SER  22 -10.334   3.645  -3.675
  156    H    ASP  23           H        ASP  23 -10.080   2.443   1.637
  157    HA   ASP  23           HA       ASP  23  -8.519   4.566   2.697
  158    HB2  ASP  23           2HB      ASP  23 -10.016   2.367   4.096
  159    HB3  ASP  23           1HB      ASP  23  -9.338   3.784   4.896
  160    H    GLU  24           H        GLU  24  -7.883   1.427   1.960
  161    HA   GLU  24           HA       GLU  24  -6.002   0.733   3.922
  162    HB2  GLU  24           2HB      GLU  24  -6.247  -0.226   1.081
  163    HB3  GLU  24           1HB      GLU  24  -5.210  -0.969   2.292
  164    HG2  GLU  24           2HG      GLU  24  -6.984  -1.848   3.469
  165    HG3  GLU  24           1HG      GLU  24  -8.127  -0.668   2.832
  166    H    LYS  25           H        LYS  25  -5.897   2.883   1.428
  167    HA   LYS  25           HA       LYS  25  -2.997   2.920   1.182
  168    HB2  LYS  25           2HB      LYS  25  -4.958   3.398  -0.646
  169    HB3  LYS  25           1HB      LYS  25  -4.570   5.037  -0.144
  170    HG2  LYS  25           2HG      LYS  25  -2.443   3.099  -0.988
  171    HG3  LYS  25           1HG      LYS  25  -3.326   4.089  -2.151
  172    HD2  LYS  25           2HD      LYS  25  -1.706   5.113   0.181
  173    HD3  LYS  25           1HD      LYS  25  -1.217   5.146  -1.514
  174    HE2  LYS  25           2HE      LYS  25  -3.664   6.369  -1.592
  175    HE3  LYS  25           1HE      LYS  25  -3.029   6.909  -0.038
  176    HZ1  LYS  25           3HZ      LYS  25  -1.744   7.225  -2.696
  177    HZ2  LYS  25           1HZ      LYS  25  -0.989   7.602  -1.229
  178    HZ3  LYS  25           2HZ      LYS  25  -2.369   8.453  -1.713
  179    H    THR  26           H        THR  26  -5.587   4.643   2.722
  180    HA   THR  26           HA       THR  26  -4.171   7.035   3.262
  181    HB   THR  26           HB       THR  26  -6.074   6.782   5.276
  182    HG1  THR  26           1HG      THR  26  -7.316   5.239   4.592
  183   HG21  THR  26          3HG2      THR  26  -7.319   7.892   2.986
  184   HG22  THR  26          1HG2      THR  26  -5.625   8.390   2.991
  185   HG23  THR  26          2HG2      THR  26  -6.649   8.718   4.392
  186    H    GLN  27           H        GLN  27  -4.314   3.926   4.809
  187    HA   GLN  27           HA       GLN  27  -3.335   4.634   7.344
  188    HB2  GLN  27           2HB      GLN  27  -4.191   2.338   6.405
  189    HB3  GLN  27           1HB      GLN  27  -2.498   2.084   6.004
  190    HG2  GLN  27           2HG      GLN  27  -3.154   2.952   8.761
  191    HG3  GLN  27           1HG      GLN  27  -3.535   1.294   8.298
  192   HE21  GLN  27          1HE2      GLN  27  -1.871  -0.128   7.812
  193   HE22  GLN  27          2HE2      GLN  27  -0.226   0.197   8.231
  194    H    LEU  28           H        LEU  28  -1.853   4.470   4.245
  195    HA   LEU  28           HA       LEU  28   0.847   4.482   5.261
  196    HB2  LEU  28           2HB      LEU  28   0.159   3.270   3.182
  197    HB3  LEU  28           1HB      LEU  28  -0.122   4.836   2.446
  198    HG   LEU  28           HG       LEU  28   2.569   4.512   3.590
  199   HD11  LEU  28          1HD1      LEU  28   3.367   2.809   2.355
  200   HD12  LEU  28          2HD1      LEU  28   2.294   3.146   0.997
  201   HD13  LEU  28          3HD1      LEU  28   1.692   2.260   2.398
  202   HD21  LEU  28          3HD2      LEU  28   3.028   5.324   1.155
  203   HD22  LEU  28          1HD2      LEU  28   2.324   6.428   2.336
  204   HD23  LEU  28          2HD2      LEU  28   1.293   5.643   1.140
  205    H    ILE  29           H        ILE  29  -1.515   6.662   4.676
  206    HA   ILE  29           HA       ILE  29  -0.116   8.882   3.707
  207    HB   ILE  29           HB       ILE  29  -2.620   8.753   5.329
  208   HG12  ILE  29          2HG1      ILE  29  -2.529   7.669   3.035
  209   HG13  ILE  29          1HG1      ILE  29  -3.816   8.839   3.307
  210   HG21  ILE  29          1HG2      ILE  29  -1.373  11.096   3.903
  211   HG22  ILE  29          2HG2      ILE  29  -1.780  10.960   5.613
  212   HG23  ILE  29          3HG2      ILE  29  -3.062  11.056   4.407
  213   HD11  ILE  29          3HD1      ILE  29  -3.161  10.002   1.571
  214   HD12  ILE  29          1HD1      ILE  29  -1.937   8.775   1.244
  215   HD13  ILE  29          2HD1      ILE  29  -1.537  10.171   2.246
  216    H    GLU  30           H        GLU  30  -0.082   7.417   6.582
  217    HA   GLU  30           HA       GLU  30   0.599   9.652   8.223
  218    HB2  GLU  30           2HB      GLU  30  -0.559   7.729   9.210
  219    HB3  GLU  30           1HB      GLU  30   0.818   6.706   8.824
  220    HG2  GLU  30           2HG      GLU  30   2.187   7.772  10.411
  221    HG3  GLU  30           1HG      GLU  30   1.055   9.109  10.605
  222    H    ALA  31           H        ALA  31   2.199   8.286   5.887
  223    HA   ALA  31           HA       ALA  31   4.825   8.194   7.155
  224    HB1  ALA  31           1HB      ALA  31   4.322   7.755   4.233
  225    HB2  ALA  31           2HB      ALA  31   3.974   6.499   5.420
  226    HB3  ALA  31           3HB      ALA  31   5.616   7.116   5.247
  227    H    PHE  32           H        PHE  32   2.927  10.174   4.992
  228    HA   PHE  32           HA       PHE  32   4.947  11.754   3.881
  229    HB2  PHE  32           2HB      PHE  32   2.027  12.068   4.342
  230    HB3  PHE  32           1HB      PHE  32   2.943  13.527   3.983
  231    HD1  PHE  32           2HD      PHE  32   4.888  12.705   2.040
  232    HD2  PHE  32           1HD      PHE  32   0.838  11.473   2.469
  233    HE1  PHE  32           2HE      PHE  32   4.800  12.171  -0.360
  234    HE2  PHE  32           1HE      PHE  32   0.743  10.935   0.070
  235    HZ   PHE  32           HZ       PHE  32   2.726  11.285  -1.349
  236    H    TYR  33           H        TYR  33   3.434  11.840   7.026
  237    HA   TYR  33           HA       TYR  33   4.818  14.333   7.692
  238    HB2  TYR  33           2HB      TYR  33   2.802  12.753   9.304
  239    HB3  TYR  33           1HB      TYR  33   3.457  14.330   9.730
  240    HD1  TYR  33           1HD      TYR  33   1.598  12.627   6.975
  241    HD2  TYR  33           2HD      TYR  33   2.276  16.232   9.132
  242    HE1  TYR  33           1HE      TYR  33  -0.221  13.711   5.724
  243    HE2  TYR  33           2HE      TYR  33   0.459  17.325   7.888
  244    HH   TYR  33           HH       TYR  33  -1.658  16.541   6.649
  245    H    ASN  34           H        ASN  34   6.343  11.944   7.278
  246    HA   ASN  34           HA       ASN  34   8.025  12.027   9.521
  247    HB2  ASN  34           2HB      ASN  34   5.917  10.589  10.246
  248    HB3  ASN  34           1HB      ASN  34   6.779   9.319   9.386
  249   HD21  ASN  34          1HD2      ASN  34   9.246   9.387   9.962
  250   HD22  ASN  34          2HD2      ASN  34   9.575   9.407  11.658
  251    H    PHE  35           H        PHE  35   8.271  12.189   6.719
  252    HA   PHE  35           HA       PHE  35  10.457  10.410   6.310
  253    HB2  PHE  35           2HB      PHE  35   8.238   9.095   5.772
  254    HB3  PHE  35           1HB      PHE  35   8.307  10.007   4.269
  255    HD1  PHE  35           2HD      PHE  35  10.978  10.062   3.428
  256    HD2  PHE  35           1HD      PHE  35   8.958   6.944   5.505
  257    HE1  PHE  35           2HE      PHE  35  12.570   8.423   2.510
  258    HE2  PHE  35           1HE      PHE  35  10.546   5.302   4.591
  259    HZ   PHE  35           HZ       PHE  35  12.354   6.041   3.091
  260    H    ASP  36           H        ASP  36  11.179  12.696   6.175
  261    HA   ASP  36           HA       ASP  36  11.623  13.431   3.474
  262    HB2  ASP  36           2HB      ASP  36  10.546  15.727   3.678
  263    HB3  ASP  36           1HB      ASP  36   9.444  14.370   3.457
  264    H    GLY  37           H        GLY  37  13.703  13.090   4.599
  265    HA2  GLY  37           2HA      GLY  37  14.506  15.259   6.390
  266    HA3  GLY  37           1HA      GLY  37  15.433  13.807   6.036
  267    H    ASP  38           H        ASP  38  15.448  13.869   3.263
  268    HA   ASP  38           HA       ASP  38  16.232  16.405   2.239
  269    HB2  ASP  38           2HB      ASP  38  18.659  15.745   1.872
  270    HB3  ASP  38           1HB      ASP  38  18.220  16.180   3.521
  271    H    TYR  39           H        TYR  39  14.583  15.393   0.827
  272    HA   TYR  39           HA       TYR  39  13.972  14.448  -1.147
  273    HB2  TYR  39           2HB      TYR  39  16.898  14.876  -1.456
  274    HB3  TYR  39           1HB      TYR  39  16.117  13.817  -2.626
  275    HD1  TYR  39           1HD      TYR  39  15.282  17.077  -0.981
  276    HD2  TYR  39           2HD      TYR  39  15.588  14.864  -4.602
  277    HE1  TYR  39           1HE      TYR  39  14.518  19.045  -2.241
  278    HE2  TYR  39           2HE      TYR  39  14.826  16.827  -5.873
  279    HH   TYR  39           HH       TYR  39  14.814  19.335  -5.556
  280    H    ASP  40           H        ASP  40  13.054  12.513  -1.001
  281    HA   ASP  40           HA       ASP  40  14.699  10.203  -0.245
  282    HB2  ASP  40           2HB      ASP  40  12.434   9.089   0.070
  283    HB3  ASP  40           1HB      ASP  40  12.815  10.394   1.188
  284    H    GLY  41           H        GLY  41  15.575   9.296  -2.008
  285    HA2  GLY  41           2HA      GLY  41  13.825   8.879  -4.352
  286    HA3  GLY  41           1HA      GLY  41  15.572   9.041  -4.439
  287    H    PHE  42           H        PHE  42  15.809   7.307  -1.977
  288    HA   PHE  42           HA       PHE  42  14.849   4.731  -2.887
  289    HB2  PHE  42           2HB      PHE  42  16.986   5.159  -4.153
  290    HB3  PHE  42           1HB      PHE  42  17.825   5.171  -2.606
  291    HD1  PHE  42           1HD      PHE  42  17.455   3.063  -1.111
  292    HD2  PHE  42           2HD      PHE  42  16.796   3.181  -5.313
  293    HE1  PHE  42           1HE      PHE  42  17.682   0.615  -1.212
  294    HE2  PHE  42           2HE      PHE  42  17.020   0.733  -5.422
  295    HZ   PHE  42           HZ       PHE  42  17.462  -0.553  -3.368
  296    H    VAL  43           H        VAL  43  14.253   3.609  -1.164
  297    HA   VAL  43           HA       VAL  43  15.650   4.088   1.386
  298    HB   VAL  43           HB       VAL  43  13.424   5.097   1.466
  299   HG11  VAL  43          1HG1      VAL  43  12.452   3.508  -0.246
  300   HG12  VAL  43          2HG1      VAL  43  11.418   3.898   1.128
  301   HG13  VAL  43          3HG1      VAL  43  12.262   2.352   1.073
  302   HG21  VAL  43          3HG2      VAL  43  14.329   4.148   3.515
  303   HG22  VAL  43          1HG2      VAL  43  13.632   2.576   3.116
  304   HG23  VAL  43          2HG2      VAL  43  12.577   3.946   3.463
  305    H    SER  44           H        SER  44  16.722   2.334   1.988
  306    HA   SER  44           HA       SER  44  16.219  -0.242   0.880
  307    HB2  SER  44           2HB      SER  44  17.901  -0.895   2.788
  308    HB3  SER  44           1HB      SER  44  18.461   0.051   1.409
  309    HG   SER  44           HG       SER  44  18.277   0.744   4.050
  310    H    VAL  45           H        VAL  45  15.498  -2.120   1.927
  311    HA   VAL  45           HA       VAL  45  13.230  -1.893   3.510
  312    HB   VAL  45           HB       VAL  45  15.088  -4.266   3.313
  313   HG11  VAL  45          1HG1      VAL  45  13.250  -5.620   4.018
  314   HG12  VAL  45          2HG1      VAL  45  12.174  -4.226   4.056
  315   HG13  VAL  45          3HG1      VAL  45  13.494  -4.352   5.216
  316   HG21  VAL  45          3HG2      VAL  45  13.700  -5.045   1.522
  317   HG22  VAL  45          1HG2      VAL  45  14.231  -3.408   1.142
  318   HG23  VAL  45          2HG2      VAL  45  12.592  -3.689   1.730
  319    H    GLU  46           H        GLU  46  16.478  -2.945   4.529
  320    HA   GLU  46           HA       GLU  46  16.060  -3.305   7.210
  321    HB2  GLU  46           2HB      GLU  46  18.526  -1.939   6.147
  322    HB3  GLU  46           1HB      GLU  46  18.394  -3.013   7.532
  323    HG2  GLU  46           2HG      GLU  46  17.481  -4.470   5.312
  324    HG3  GLU  46           1HG      GLU  46  18.947  -3.637   4.798
  325    H    GLU  47           H        GLU  47  16.286  -0.299   5.461
  326    HA   GLU  47           HA       GLU  47  16.372   1.296   7.888
  327    HB2  GLU  47           2HB      GLU  47  17.463   1.809   5.545
  328    HB3  GLU  47           1HB      GLU  47  15.870   2.457   5.176
  329    HG2  GLU  47           2HG      GLU  47  17.480   3.307   7.567
  330    HG3  GLU  47           1HG      GLU  47  17.566   4.111   6.001
  331    H    PHE  48           H        PHE  48  14.091   0.191   5.505
  332    HA   PHE  48           HA       PHE  48  11.982   1.987   6.117
  333    HB2  PHE  48           2HB      PHE  48  12.453  -0.004   4.228
  334    HB3  PHE  48           1HB      PHE  48  11.101  -0.621   5.171
  335    HD1  PHE  48           2HD      PHE  48   9.660   1.851   5.835
  336    HD2  PHE  48           1HD      PHE  48  11.541   0.639   2.214
  337    HE1  PHE  48           2HE      PHE  48   8.125   3.291   4.560
  338    HE2  PHE  48           1HE      PHE  48  10.008   2.078   0.933
  339    HZ   PHE  48           HZ       PHE  48   8.297   3.406   2.106
  340    H    ARG  49           H        ARG  49  12.962  -1.150   7.370
  341    HA   ARG  49           HA       ARG  49  10.691  -1.841   8.812
  342    HB2  ARG  49           2HB      ARG  49  13.592  -2.333   9.509
  343    HB3  ARG  49           1HB      ARG  49  12.227  -3.151  10.259
  344    HG2  ARG  49           2HG      ARG  49  11.597  -3.968   7.965
  345    HG3  ARG  49           1HG      ARG  49  13.149  -3.342   7.405
  346    HD2  ARG  49           2HD      ARG  49  13.965  -4.769   9.532
  347    HD3  ARG  49           1HD      ARG  49  12.538  -5.698   9.076
  348    HE   ARG  49           HE       ARG  49  15.023  -5.525   7.648
  349   HH11  ARG  49          1HH1      ARG  49  11.606  -6.172   7.365
  350   HH12  ARG  49          2HH1      ARG  49  11.780  -7.134   5.936
  351   HH21  ARG  49          1HH2      ARG  49  15.254  -6.792   5.769
  352   HH22  ARG  49          2HH2      ARG  49  13.851  -7.487   5.030
  353    H    GLY  50           H        GLY  50  13.522   0.018   9.929
  354    HA2  GLY  50           2HA      GLY  50  12.646   0.511  12.530
  355    HA3  GLY  50           1HA      GLY  50  13.747   1.543  11.629
  356    H    ILE  51           H        ILE  51  11.547   1.866   9.551
  357    HA   ILE  51           HA       ILE  51  10.294   4.148  10.848
  358    HB   ILE  51           HB       ILE  51  10.015   3.298   7.968
  359   HG12  ILE  51          2HG1      ILE  51  12.010   5.247   9.135
  360   HG13  ILE  51          1HG1      ILE  51  12.402   3.609   8.628
  361   HG21  ILE  51          1HG2      ILE  51   8.888   5.206   7.620
  362   HG22  ILE  51          2HG2      ILE  51   9.930   6.134   8.698
  363   HG23  ILE  51          3HG2      ILE  51   8.614   5.168   9.362
  364   HD11  ILE  51          3HD1      ILE  51  11.625   5.959   6.951
  365   HD12  ILE  51          1HD1      ILE  51  11.481   4.308   6.344
  366   HD13  ILE  51          2HD1      ILE  51  13.055   4.932   6.839
  367    H    ILE  52           H        ILE  52   9.477   0.969   9.721
  368    HA   ILE  52           HA       ILE  52   6.612   1.495   9.900
  369    HB   ILE  52           HB       ILE  52   8.074  -1.048   9.173
  370   HG12  ILE  52          2HG1      ILE  52   8.355   0.849   7.570
  371   HG13  ILE  52          1HG1      ILE  52   7.516  -0.537   6.882
  372   HG21  ILE  52          1HG2      ILE  52   5.937  -1.629  10.038
  373   HG22  ILE  52          2HG2      ILE  52   5.830  -1.723   8.281
  374   HG23  ILE  52          3HG2      ILE  52   5.149  -0.338   9.133
  375   HD11  ILE  52          3HD1      ILE  52   5.762   0.709   6.375
  376   HD12  ILE  52          1HD1      ILE  52   6.692   2.121   6.877
  377   HD13  ILE  52          2HD1      ILE  52   5.635   1.304   8.031
  378    H    ARG  53           H        ARG  53   9.182  -0.043  11.678
  379    HA   ARG  53           HA       ARG  53   7.746  -1.749  13.336
  380    HB2  ARG  53           2HB      ARG  53  10.352  -1.123  13.096
  381    HB3  ARG  53           1HB      ARG  53   9.979  -0.244  14.572
  382    HG2  ARG  53           2HG      ARG  53   9.765  -2.118  15.792
  383    HG3  ARG  53           1HG      ARG  53   8.993  -3.011  14.479
  384    HD2  ARG  53           2HD      ARG  53  11.921  -2.331  14.462
  385    HD3  ARG  53           1HD      ARG  53  11.299  -3.798  15.219
  386    HE   ARG  53           HE       ARG  53  11.688  -3.358  12.446
  387   HH11  ARG  53          1HH1      ARG  53   9.538  -4.919  14.710
  388   HH12  ARG  53          2HH1      ARG  53   9.023  -6.126  13.581
  389   HH21  ARG  53          1HH2      ARG  53  11.013  -4.945  10.959
  390   HH22  ARG  53          2HH2      ARG  53   9.861  -6.142  11.451
  391    H    ASP  54           H        ASP  54   8.706   1.623  14.009
  392    HA   ASP  54           HA       ASP  54   6.585   1.713  16.050
  393    HB2  ASP  54           2HB      ASP  54   9.127   3.331  15.816
  394    HB3  ASP  54           1HB      ASP  54   7.877   3.612  17.026
  395    H    GLY  55           H        GLY  55   6.650   2.362  12.989
  396    HA2  GLY  55           2HA      GLY  55   5.668   5.132  13.195
  397    HA3  GLY  55           1HA      GLY  55   6.209   4.358  11.715
  398    H    LEU  56           H        LEU  56   4.830   2.878  10.657
  399    HA   LEU  56           HA       LEU  56   2.004   3.343  11.269
  400    HB2  LEU  56           2HB      LEU  56   3.310   2.249   8.777
  401    HB3  LEU  56           1HB      LEU  56   1.593   2.538   8.975
  402    HG   LEU  56           HG       LEU  56   2.169   4.978   9.359
  403   HD11  LEU  56          1HD1      LEU  56   4.849   3.864   8.765
  404   HD12  LEU  56          2HD1      LEU  56   4.382   5.206   9.811
  405   HD13  LEU  56          3HD1      LEU  56   4.442   5.430   8.063
  406   HD21  LEU  56          3HD2      LEU  56   3.102   4.301   6.638
  407   HD22  LEU  56          1HD2      LEU  56   1.823   5.396   7.163
  408   HD23  LEU  56          2HD2      LEU  56   1.534   3.657   7.120
  409    HA   PRO  57           HA       PRO  57   1.583  -0.854  12.652
  410    HB2  PRO  57           2HB      PRO  57  -1.101  -1.041  12.676
  411    HB3  PRO  57           1HB      PRO  57  -0.226  -0.042  13.843
  412    HG2  PRO  57           2HG      PRO  57  -1.652   0.775  11.340
  413    HG3  PRO  57           1HG      PRO  57  -1.654   1.553  12.932
  414    HD2  PRO  57           2HD      PRO  57  -0.115   2.402  10.839
  415    HD3  PRO  57           1HD      PRO  57   0.329   2.637  12.541
  416    H    MET  58           H        MET  58   2.089  -2.498  11.383
  417    HA   MET  58           HA       MET  58   0.226  -3.379   9.351
  418    HB2  MET  58           2HB      MET  58   2.495  -1.841   8.630
  419    HB3  MET  58           1HB      MET  58   2.833  -3.498   8.152
  420    HG2  MET  58           2HG      MET  58   0.927  -3.583   6.759
  421    HG3  MET  58           1HG      MET  58   0.287  -2.081   7.424
  422    HE1  MET  58           3HE      MET  58   3.081  -2.585   3.916
  423    HE2  MET  58           1HE      MET  58   1.630  -3.487   4.354
  424    HE3  MET  58           2HE      MET  58   3.120  -3.713   5.271
  425    H    THR  59           H        THR  59   0.245  -5.552   9.099
  426    HA   THR  59           HA       THR  59   1.762  -7.107  10.971
  427    HB   THR  59           HB       THR  59   0.607  -8.945   9.291
  428    HG1  THR  59           1HG      THR  59  -1.232  -6.804   9.420
  429   HG21  THR  59          3HG2      THR  59  -0.294  -9.475  11.235
  430   HG22  THR  59          1HG2      THR  59  -1.457  -8.166  11.021
  431   HG23  THR  59          2HG2      THR  59   0.056  -7.869  11.876
  432    H    GLU  60           H        GLU  60   3.332  -8.666  10.532
  433    HA   GLU  60           HA       GLU  60   5.411  -8.139   8.894
  434    HB2  GLU  60           2HB      GLU  60   5.805 -10.675   8.856
  435    HB3  GLU  60           1HB      GLU  60   5.718  -9.892  10.427
  436    HG2  GLU  60           2HG      GLU  60   3.114 -10.604   9.976
  437    HG3  GLU  60           1HG      GLU  60   4.006 -11.932   9.240
  438    H    ALA  61           H        ALA  61   2.752 -10.299   8.052
  439    HA   ALA  61           HA       ALA  61   3.433 -11.076   5.536
  440    HB1  ALA  61           1HB      ALA  61   1.390 -11.958   5.544
  441    HB2  ALA  61           2HB      ALA  61   0.629 -10.370   5.641
  442    HB3  ALA  61           3HB      ALA  61   1.159 -11.186   7.113
  443    H    GLU  62           H        GLU  62   1.575  -8.135   6.342
  444    HA   GLU  62           HA       GLU  62   1.349  -7.139   3.745
  445    HB2  GLU  62           2HB      GLU  62   1.810  -5.104   5.840
  446    HB3  GLU  62           1HB      GLU  62   0.501  -5.244   4.677
  447    HG2  GLU  62           2HG      GLU  62  -0.203  -7.261   6.198
  448    HG3  GLU  62           1HG      GLU  62   0.761  -6.400   7.395
  449    H    ILE  63           H        ILE  63   3.698  -6.118   6.217
  450    HA   ILE  63           HA       ILE  63   5.332  -4.611   4.502
  451    HB   ILE  63           HB       ILE  63   6.442  -6.094   6.871
  452   HG12  ILE  63          2HG1      ILE  63   5.610  -3.656   7.860
  453   HG13  ILE  63          1HG1      ILE  63   4.260  -4.148   6.840
  454   HG21  ILE  63          1HG2      ILE  63   7.661  -4.435   5.173
  455   HG22  ILE  63          2HG2      ILE  63   8.078  -4.524   6.884
  456   HG23  ILE  63          3HG2      ILE  63   7.014  -3.245   6.301
  457   HD11  ILE  63          3HD1      ILE  63   4.811  -6.448   8.172
  458   HD12  ILE  63          1HD1      ILE  63   3.587  -5.270   8.634
  459   HD13  ILE  63          2HD1      ILE  63   5.179  -5.222   9.390
  460    H    THR  64           H        THR  64   6.013  -7.838   5.834
  461    HA   THR  64           HA       THR  64   8.267  -8.446   4.372
  462    HB   THR  64           HB       THR  64   6.057 -10.261   5.314
  463    HG1  THR  64           1HG      THR  64   7.059  -9.220   7.006
  464   HG21  THR  64          3HG2      THR  64   8.831 -10.980   4.418
  465   HG22  THR  64          1HG2      THR  64   7.304 -11.505   3.706
  466   HG23  THR  64          2HG2      THR  64   7.758 -12.050   5.321
  467    H    GLU  65           H        GLU  65   4.888  -9.243   3.536
  468    HA   GLU  65           HA       GLU  65   5.550 -10.371   1.036
  469    HB2  GLU  65           2HB      GLU  65   3.380 -10.705   2.307
  470    HB3  GLU  65           1HB      GLU  65   2.909  -9.117   1.715
  471    HG2  GLU  65           2HG      GLU  65   2.523  -9.857  -0.380
  472    HG3  GLU  65           1HG      GLU  65   3.826 -11.044  -0.318
  473    H    PHE  66           H        PHE  66   5.460  -7.276   2.125
  474    HA   PHE  66           HA       PHE  66   5.096  -6.100  -0.502
  475    HB2  PHE  66           2HB      PHE  66   5.094  -5.011   2.279
  476    HB3  PHE  66           1HB      PHE  66   5.512  -3.930   0.958
  477    HD1  PHE  66           2HD      PHE  66   3.097  -6.674   0.576
  478    HD2  PHE  66           1HD      PHE  66   3.620  -2.501   1.236
  479    HE1  PHE  66           2HE      PHE  66   0.709  -6.304   0.116
  480    HE2  PHE  66           1HE      PHE  66   1.233  -2.127   0.778
  481    HZ   PHE  66           HZ       PHE  66  -0.226  -4.029   0.216
  482    H    PHE  67           H        PHE  67   7.548  -6.894   1.805
  483    HA   PHE  67           HA       PHE  67   9.562  -5.173   0.657
  484    HB2  PHE  67           2HB      PHE  67   9.502  -7.257   2.805
  485    HB3  PHE  67           1HB      PHE  67  11.053  -6.777   2.128
  486    HD1  PHE  67           2HD      PHE  67  10.050  -3.803   1.687
  487    HD2  PHE  67           1HD      PHE  67  10.100  -6.484   4.998
  488    HE1  PHE  67           2HE      PHE  67  10.107  -1.894   3.235
  489    HE2  PHE  67           1HE      PHE  67  10.159  -4.574   6.545
  490    HZ   PHE  67           HZ       PHE  67  10.165  -2.277   5.664
  491    H    GLU  68           H        GLU  68   8.446  -8.441   0.230
  492    HA   GLU  68           HA       GLU  68  10.757  -9.212  -1.343
  493    HB2  GLU  68           2HB      GLU  68   9.432 -11.332  -1.684
  494    HB3  GLU  68           1HB      GLU  68   9.830 -10.952  -0.014
  495    HG2  GLU  68           2HG      GLU  68   7.696 -10.928   0.567
  496    HG3  GLU  68           1HG      GLU  68   7.295  -9.803  -0.729
  497    H    ALA  69           H        ALA  69   7.493  -8.084  -1.833
  498    HA   ALA  69           HA       ALA  69   7.401  -8.736  -4.611
  499    HB1  ALA  69           1HB      ALA  69   5.675  -6.838  -3.062
  500    HB2  ALA  69           2HB      ALA  69   5.372  -8.568  -3.231
  501    HB3  ALA  69           3HB      ALA  69   5.311  -7.519  -4.648
  502    H    ALA  70           H        ALA  70   8.894  -6.406  -2.879
  503    HA   ALA  70           HA       ALA  70   8.898  -4.422  -5.032
  504    HB1  ALA  70           1HB      ALA  70   8.501  -3.324  -3.026
  505    HB2  ALA  70           2HB      ALA  70  10.231  -3.085  -3.269
  506    HB3  ALA  70           3HB      ALA  70   9.661  -4.312  -2.138
  507    H    ASP  71           H        ASP  71  10.949  -6.707  -3.380
  508    HA   ASP  71           HA       ASP  71  13.137  -6.006  -5.223
  509    HB2  ASP  71           2HB      ASP  71  13.404  -5.536  -2.652
  510    HB3  ASP  71           1HB      ASP  71  13.696  -7.270  -2.567
  511    HA   PRO  72           HA       PRO  72  12.316 -10.238  -6.513
  512    HB2  PRO  72           2HB      PRO  72  14.313 -10.346  -8.380
  513    HB3  PRO  72           1HB      PRO  72  12.734  -9.607  -8.674
  514    HG2  PRO  72           2HG      PRO  72  15.331  -8.308  -7.953
  515    HG3  PRO  72           1HG      PRO  72  14.111  -7.795  -9.133
  516    HD2  PRO  72           2HD      PRO  72  14.305  -6.664  -6.696
  517    HD3  PRO  72           1HD      PRO  72  12.743  -6.880  -7.512
  518    H    ASN  73           H        ASN  73  15.702  -9.152  -6.192
  519    HA   ASN  73           HA       ASN  73  16.696 -11.734  -5.559
  520    HB2  ASN  73           2HB      ASN  73  18.725 -10.390  -4.746
  521    HB3  ASN  73           1HB      ASN  73  18.282 -10.228  -6.442
  522   HD21  ASN  73          1HD2      ASN  73  19.344  -8.242  -6.564
  523   HD22  ASN  73          2HD2      ASN  73  18.669  -6.807  -5.882
  524    H    ASN  74           H        ASN  74  15.466  -9.074  -3.653
  525    HA   ASN  74           HA       ASN  74  14.725  -9.004  -1.499
  526    HB2  ASN  74           2HB      ASN  74  15.686 -11.834  -1.087
  527    HB3  ASN  74           1HB      ASN  74  14.419 -10.975  -0.218
  528   HD21  ASN  74          1HD2      ASN  74  12.437 -10.547  -1.311
  529   HD22  ASN  74          2HD2      ASN  74  11.922 -11.560  -2.611
  530    H    THR  75           H        THR  75  17.022  -7.822  -2.002
  531    HA   THR  75           HA       THR  75  18.985  -8.753  -0.049
  532    HB   THR  75           HB       THR  75  20.559  -7.314  -1.091
  533    HG1  THR  75           1HG      THR  75  19.691  -5.426  -1.504
  534   HG21  THR  75          3HG2      THR  75  20.032  -7.672  -3.639
  535   HG22  THR  75          1HG2      THR  75  18.805  -8.760  -2.991
  536   HG23  THR  75          2HG2      THR  75  20.504  -9.015  -2.596
  537    H    GLY  76           H        GLY  76  16.427  -7.587   0.752
  538    HA2  GLY  76           2HA      GLY  76  15.620  -6.104   2.301
  539    HA3  GLY  76           1HA      GLY  76  17.284  -5.945   2.846
  540    H    PHE  77           H        PHE  77  16.426  -5.159  -0.427
  541    HA   PHE  77           HA       PHE  77  16.545  -2.296   0.241
  542    HB2  PHE  77           2HB      PHE  77  18.203  -3.863  -1.651
  543    HB3  PHE  77           1HB      PHE  77  17.630  -2.303  -2.235
  544    HD1  PHE  77           2HD      PHE  77  18.971  -3.609   1.001
  545    HD2  PHE  77           1HD      PHE  77  19.190  -0.645  -2.046
  546    HE1  PHE  77           2HE      PHE  77  20.787  -2.490   2.226
  547    HE2  PHE  77           1HE      PHE  77  21.008   0.479  -0.826
  548    HZ   PHE  77           HZ       PHE  77  21.808  -0.443   1.312
  549    H    ILE  78           H        ILE  78  14.983  -1.077  -0.624
  550    HA   ILE  78           HA       ILE  78  13.147  -2.361  -2.528
  551    HB   ILE  78           HB       ILE  78  12.716  -0.008  -0.683
  552   HG12  ILE  78          2HG1      ILE  78  11.526  -2.782  -0.701
  553   HG13  ILE  78          1HG1      ILE  78  12.685  -2.159   0.472
  554   HG21  ILE  78          1HG2      ILE  78  10.788  -1.278  -2.623
  555   HG22  ILE  78          2HG2      ILE  78  11.490   0.335  -2.758
  556   HG23  ILE  78          3HG2      ILE  78  10.385  -0.037  -1.437
  557   HD11  ILE  78          3HD1      ILE  78  10.357  -0.458   0.251
  558   HD12  ILE  78          1HD1      ILE  78  11.073  -1.221   1.674
  559   HD13  ILE  78          2HD1      ILE  78   9.930  -2.118   0.676
  560    H    ASP  79           H        ASP  79  12.309  -1.193  -4.275
  561    HA   ASP  79           HA       ASP  79  14.085   0.922  -5.267
  562    HB2  ASP  79           2HB      ASP  79  13.143  -1.327  -6.543
  563    HB3  ASP  79           1HB      ASP  79  11.988  -0.106  -7.068
  564    H    TYR  80           H        TYR  80  13.303   2.703  -4.230
  565    HA   TYR  80           HA       TYR  80  10.993   3.492  -3.288
  566    HB2  TYR  80           2HB      TYR  80  13.002   4.951  -3.551
  567    HB3  TYR  80           1HB      TYR  80  12.498   5.281  -5.206
  568    HD1  TYR  80           1HD      TYR  80  10.394   6.542  -5.623
  569    HD2  TYR  80           2HD      TYR  80  11.984   6.059  -1.707
  570    HE1  TYR  80           1HE      TYR  80   8.985   8.394  -4.829
  571    HE2  TYR  80           2HE      TYR  80  10.580   7.909  -0.901
  572    HH   TYR  80           HH       TYR  80   8.932  10.017  -3.007
  573    H    LYS  81           H        LYS  81  11.591   3.411  -6.784
  574    HA   LYS  81           HA       LYS  81   9.102   4.520  -7.530
  575    HB2  LYS  81           2HB      LYS  81  11.253   2.996  -8.919
  576    HB3  LYS  81           1HB      LYS  81   9.683   3.091  -9.706
  577    HG2  LYS  81           2HG      LYS  81  10.612   4.939 -10.608
  578    HG3  LYS  81           1HG      LYS  81  10.002   5.670  -9.123
  579    HD2  LYS  81           2HD      LYS  81  12.132   5.597  -8.098
  580    HD3  LYS  81           1HD      LYS  81  12.772   4.519  -9.340
  581    HE2  LYS  81           2HE      LYS  81  13.165   6.207 -10.789
  582    HE3  LYS  81           1HE      LYS  81  11.719   7.095 -10.306
  583    HZ1  LYS  81           3HZ      LYS  81  12.838   8.243  -8.745
  584    HZ2  LYS  81           1HZ      LYS  81  14.181   7.879  -9.709
  585    HZ3  LYS  81           2HZ      LYS  81  13.849   6.951  -8.334
  586    H    ALA  82           H        ALA  82  10.207   1.125  -7.539
  587    HA   ALA  82           HA       ALA  82   7.807  -0.080  -8.227
  588    HB1  ALA  82           1HB      ALA  82  10.282  -0.991  -7.581
  589    HB2  ALA  82           2HB      ALA  82   8.868  -2.019  -7.805
  590    HB3  ALA  82           3HB      ALA  82   9.348  -1.522  -6.182
  591    H    PHE  83           H        PHE  83   8.792   1.369  -5.241
  592    HA   PHE  83           HA       PHE  83   6.570   0.233  -3.751
  593    HB2  PHE  83           2HB      PHE  83   9.126   1.250  -3.082
  594    HB3  PHE  83           1HB      PHE  83   7.941   2.307  -2.318
  595    HD1  PHE  83           1HD      PHE  83   8.495  -1.339  -2.864
  596    HD2  PHE  83           2HD      PHE  83   7.282   1.741  -0.194
  597    HE1  PHE  83           1HE      PHE  83   8.175  -3.011  -1.092
  598    HE2  PHE  83           2HE      PHE  83   6.959   0.075   1.588
  599    HZ   PHE  83           HZ       PHE  83   7.405  -2.306   1.140
  600    H    ALA  84           H        ALA  84   7.533   3.228  -5.277
  601    HA   ALA  84           HA       ALA  84   5.453   4.818  -4.114
  602    HB1  ALA  84           1HB      ALA  84   6.158   6.538  -5.672
  603    HB2  ALA  84           2HB      ALA  84   7.132   5.365  -6.558
  604    HB3  ALA  84           3HB      ALA  84   7.562   5.798  -4.903
  605    H    ALA  85           H        ALA  85   5.908   3.131  -7.191
  606    HA   ALA  85           HA       ALA  85   3.598   4.060  -8.458
  607    HB1  ALA  85           1HB      ALA  85   4.950   1.417  -8.878
  608    HB2  ALA  85           2HB      ALA  85   5.457   2.935  -9.619
  609    HB3  ALA  85           3HB      ALA  85   3.885   2.240 -10.016
  610    H    MET  86           H        MET  86   3.895   2.086  -5.860
  611    HA   MET  86           HA       MET  86   1.573   0.451  -6.272
  612    HB2  MET  86           2HB      MET  86   3.235   0.957  -3.799
  613    HB3  MET  86           1HB      MET  86   1.935  -0.222  -3.903
  614    HG2  MET  86           2HG      MET  86   4.194  -0.336  -5.846
  615    HG3  MET  86           1HG      MET  86   4.405  -0.963  -4.212
  616    HE1  MET  86           3HE      MET  86   3.801  -2.360  -7.664
  617    HE2  MET  86           1HE      MET  86   3.867  -3.934  -6.870
  618    HE3  MET  86           2HE      MET  86   5.020  -2.675  -6.429
  619    H    LEU  87           H        LEU  87   2.191   3.613  -5.029
  620    HA   LEU  87           HA       LEU  87  -0.406   3.677  -3.739
  621    HB2  LEU  87           2HB      LEU  87   1.734   5.765  -3.665
  622    HB3  LEU  87           1HB      LEU  87   0.281   5.746  -2.684
  623    HG   LEU  87           HG       LEU  87   2.360   3.576  -2.507
  624   HD11  LEU  87          1HD1      LEU  87   2.172   5.964  -0.690
  625   HD12  LEU  87          2HD1      LEU  87   3.302   5.868  -2.041
  626   HD13  LEU  87          3HD1      LEU  87   3.411   4.709  -0.716
  627   HD21  LEU  87          3HD2      LEU  87   0.575   4.432  -0.289
  628   HD22  LEU  87          1HD2      LEU  87   1.230   2.838  -0.664
  629   HD23  LEU  87          2HD2      LEU  87  -0.116   3.481  -1.605
  630    H    TYR  88           H        TYR  88   1.058   4.551  -6.495
  631    HA   TYR  88           HA       TYR  88  -1.229   6.219  -7.268
  632    HB2  TYR  88           2HB      TYR  88   0.141   7.698  -8.572
  633    HB3  TYR  88           1HB      TYR  88   0.795   7.631  -6.942
  634    HD1  TYR  88           2HD      TYR  88   1.322   6.525 -10.432
  635    HD2  TYR  88           1HD      TYR  88   3.006   6.856  -6.540
  636    HE1  TYR  88           2HE      TYR  88   3.536   5.987 -11.352
  637    HE2  TYR  88           1HE      TYR  88   5.226   6.326  -7.450
  638    HH   TYR  88           HH       TYR  88   5.726   4.975 -10.411
  639    H    SER  89           H        SER  89  -0.465   3.333  -7.630
  640    HA   SER  89           HA       SER  89   0.177   2.847 -10.324
  641    HB2  SER  89           2HB      SER  89  -1.340   0.678  -9.648
  642    HB3  SER  89           1HB      SER  89   0.367   0.864  -9.245
  643    HG   SER  89           HG       SER  89  -0.981   0.331  -7.430
  644    H    VAL  90           H        VAL  90  -1.075   4.371 -11.511
  645    HA   VAL  90           HA       VAL  90  -3.411   3.327 -12.650
  646    HB   VAL  90           HB       VAL  90  -4.449   3.959 -10.506
  647   HG11  VAL  90          1HG1      VAL  90  -2.794   6.044 -10.417
  648   HG12  VAL  90          2HG1      VAL  90  -4.332   6.016  -9.553
  649   HG13  VAL  90          3HG1      VAL  90  -4.203   6.850 -11.102
  650   HG21  VAL  90          3HG2      VAL  90  -5.608   5.959 -12.339
  651   HG22  VAL  90          1HG2      VAL  90  -6.372   4.610 -11.498
  652   HG23  VAL  90          2HG2      VAL  90  -5.452   4.320 -12.975
  653    H    ASP  91           H        ASP  91  -1.089   4.324 -13.690
  654    HA   ASP  91           HA       ASP  91  -1.183   7.039 -14.449
  655    HB2  ASP  91           2HB      ASP  91   0.691   5.111 -14.652
  656    HB3  ASP  91           1HB      ASP  91   0.092   5.115 -16.309
  657    H    GLU  92           H        GLU  92  -1.700   7.972 -16.485
  658    HA   GLU  92           HA       GLU  92  -4.002   6.698 -17.740
  659    HB2  GLU  92           2HB      GLU  92  -3.696   9.225 -16.959
  660    HB3  GLU  92           1HB      GLU  92  -3.037   9.388 -18.581
  661    HG2  GLU  92           2HG      GLU  92  -5.570   7.937 -18.473
  662    HG3  GLU  92           1HG      GLU  92  -5.669   9.606 -17.912
  663    H    SER  93           H        SER  93  -4.214   6.981 -20.159
  664    HA   SER  93           HA       SER  93  -1.868   5.842 -21.403
  665    HB2  SER  93           2HB      SER  93  -4.444   6.537 -22.806
  666    HB3  SER  93           1HB      SER  93  -3.271   5.287 -23.224
  667    HG   SER  93           HG       SER  93  -3.878   4.359 -21.095