*HEADER    DNA BINDING PROTEIN                     31-OCT-19   6TAZ              
*TITLE     TIMELESS COUPLES G QUADRUPLEX DETECTION WITH PROCESSING BY DDX11      
*TITLE    2 DURING DNA REPLICATION                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROTEIN TIMELESS HOMOLOG;                                  
*COMPND   3 CHAIN: B;                                                            
*COMPND   4 SYNONYM: HTIM;                                                       
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: TIMELESS, TIM, TIM1, TIMELESS1;                                
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    DNA-BINDING PROTEIN, 3-HELIX BUNDLE, TANDEM REPEAT, DNA BINDING       
*KEYWDS   2 PROTEIN                                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    L.LERNER KOCH,S.HOLZER,M.L.KILKENNY,P.MURAT,S.SVIKOVIC,D.SCHIAVONE,   
*AUTHOR   2 A.BITTLESTON,J.D.MAMAN,D.BRANZEI,K.STOTT,L.PELLEGRINI,E.J.SALE       
*REVDAT   1   01-JUL-20 6TAZ    0                                                
# Restraints file 1: dihedrals.tbl
! T 8   Phi Psi
assign (resid  7 and name C ) (resid  8 and name N)
       (resid  8 and name CA) (resid  8 and name C) 1.0   -95.87    36.41  2
assign (resid  8 and name N) (resid  8 and name CA)
       (resid  8 and name C) (resid  9 and name  N) 1.0   127.33    30.00  2
! W 9   Phi Psi
assign (resid  8 and name C ) (resid  9 and name N)
       (resid  9 and name CA) (resid  9 and name C) 1.0   -90.92    45.28  2
assign (resid  9 and name N) (resid  9 and name CA)
       (resid  9 and name C) (resid  10 and name  N) 1.0   128.25    37.43  2
! S 10  Phi Psi
assign (resid  9 and name C ) (resid  10 and name N)
       (resid  10 and name CA) (resid  10 and name C) 1.0   -90.28    56.57  2
assign (resid  10 and name N) (resid  10 and name CA)
       (resid  10 and name C) (resid  11 and name  N) 1.0   133.51    55.65  2
! P 11  Phi Psi
assign (resid  10 and name C ) (resid  11 and name N)
       (resid  11 and name CA) (resid  11 and name C) 1.0   -52.30    30.00  2
assign (resid  11 and name N) (resid  11 and name CA)
       (resid  11 and name C) (resid  12 and name  N) 1.0   -34.98    30.00  2
! E 12  Phi Psi
assign (resid  11 and name C ) (resid  12 and name N)
       (resid  12 and name CA) (resid  12 and name C) 1.0   -66.49    30.00  2
assign (resid  12 and name N) (resid  12 and name CA)
       (resid  12 and name C) (resid  13 and name  N) 1.0   -34.81    30.00  2
! E 13  Phi Psi
assign (resid  12 and name C ) (resid  13 and name N)
       (resid  13 and name CA) (resid  13 and name C) 1.0   -64.51    30.00  2
assign (resid  13 and name N) (resid  13 and name CA)
       (resid  13 and name C) (resid  14 and name  N) 1.0   -43.53    30.00  2
! E 14  Phi Psi
assign (resid  13 and name C ) (resid  14 and name N)
       (resid  14 and name CA) (resid  14 and name C) 1.0   -65.73    30.00  2
assign (resid  14 and name N) (resid  14 and name CA)
       (resid  14 and name C) (resid  15 and name  N) 1.0   -39.48    30.00  2
! A 15  Phi Psi
assign (resid  14 and name C ) (resid  15 and name N)
       (resid  15 and name CA) (resid  15 and name C) 1.0   -65.40    30.00  2
assign (resid  15 and name N) (resid  15 and name CA)
       (resid  15 and name C) (resid  16 and name  N) 1.0   -40.26    30.00  2
! H 16  Phi Psi
assign (resid  15 and name C ) (resid  16 and name N)
       (resid  16 and name CA) (resid  16 and name C) 1.0   -67.73    35.77  2
assign (resid  16 and name N) (resid  16 and name CA)
       (resid  16 and name C) (resid  17 and name  N) 1.0   -41.06    30.00  2
! L 17  Phi Psi
assign (resid  16 and name C ) (resid  17 and name N)
       (resid  17 and name CA) (resid  17 and name C) 1.0   -63.33    30.00  2
assign (resid  17 and name N) (resid  17 and name CA)
       (resid  17 and name C) (resid  18 and name  N) 1.0   -42.52    30.00  2
! R 18  Phi Psi
assign (resid  17 and name C ) (resid  18 and name N)
       (resid  18 and name CA) (resid  18 and name C) 1.0   -61.53    30.00  2
assign (resid  18 and name N) (resid  18 and name CA)
       (resid  18 and name C) (resid  19 and name  N) 1.0   -42.67    30.00  2
! E 19  Phi Psi
assign (resid  18 and name C ) (resid  19 and name N)
       (resid  19 and name CA) (resid  19 and name C) 1.0   -59.11    30.00  2
assign (resid  19 and name N) (resid  19 and name CA)
       (resid  19 and name C) (resid  20 and name  N) 1.0   -43.73    30.00  2
! L 20  Phi Psi
assign (resid  19 and name C ) (resid  20 and name N)
       (resid  20 and name CA) (resid  20 and name C) 1.0   -65.47    30.00  2
assign (resid  20 and name N) (resid  20 and name CA)
       (resid  20 and name C) (resid  21 and name  N) 1.0   -37.35    30.00  2
! Y 21  Phi Psi
assign (resid  20 and name C ) (resid  21 and name N)
       (resid  21 and name CA) (resid  21 and name C) 1.0   -61.12    30.00  2
assign (resid  21 and name N) (resid  21 and name CA)
       (resid  21 and name C) (resid  22 and name  N) 1.0   -44.65    30.00  2
! L 22  Phi Psi
assign (resid  21 and name C ) (resid  22 and name N)
       (resid  22 and name CA) (resid  22 and name C) 1.0   -62.74    30.00  2
assign (resid  22 and name N) (resid  22 and name CA)
       (resid  22 and name C) (resid  23 and name  N) 1.0   -38.08    30.00  2
! A 23  Phi Psi
assign (resid  22 and name C ) (resid  23 and name N)
       (resid  23 and name CA) (resid  23 and name C) 1.0   -70.36    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   -36.61    30.00  2
! N 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   -97.95    49.46  2
assign (resid  24 and name N) (resid  24 and name CA)
       (resid  24 and name C) (resid  25 and name  N) 1.0    -7.34    44.52  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   -64.30    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   -33.93    30.00  2
! D 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   -95.33    33.17  2
assign (resid  26 and name N) (resid  26 and name CA)
       (resid  26 and name C) (resid  27 and name  N) 1.0    -2.42    30.00  2
! V 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   -79.31    33.28  2
assign (resid  27 and name N) (resid  27 and name CA)
       (resid  27 and name C) (resid  28 and name  N) 1.0   128.49    30.00  2
! E 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   -69.82    51.41  2
assign (resid  28 and name N) (resid  28 and name CA)
       (resid  28 and name C) (resid  29 and name  N) 1.0   142.97    34.68  2
! G 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    72.68    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    10.54    44.23  2
! Q 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  -104.62    56.24  2
assign (resid  30 and name N) (resid  30 and name CA)
       (resid  30 and name C) (resid  31 and name  N) 1.0   143.48    30.00  2
! D 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   -79.78    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   115.74    30.00  2
! V 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   -58.45    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   -34.21    30.37  2
! V 33  Phi Psi
assign (resid  32 and name C ) (resid  33 and name N)
       (resid  33 and name CA) (resid  33 and name C) 1.0   -60.37    30.00  2
assign (resid  33 and name N) (resid  33 and name CA)
       (resid  33 and name C) (resid  34 and name  N) 1.0   -39.15    30.00  2
! E 34  Phi Psi
assign (resid  33 and name C ) (resid  34 and name N)
       (resid  34 and name CA) (resid  34 and name C) 1.0   -63.91    30.00  2
assign (resid  34 and name N) (resid  34 and name CA)
       (resid  34 and name C) (resid  35 and name  N) 1.0   -41.07    30.00  2
! A 35  Phi Psi
assign (resid  34 and name C ) (resid  35 and name N)
       (resid  35 and name CA) (resid  35 and name C) 1.0   -63.78    30.00  2
assign (resid  35 and name N) (resid  35 and name CA)
       (resid  35 and name C) (resid  36 and name  N) 1.0   -38.25    30.00  2
! I 36  Phi Psi
assign (resid  35 and name C ) (resid  36 and name N)
       (resid  36 and name CA) (resid  36 and name C) 1.0   -64.39    30.00  2
assign (resid  36 and name N) (resid  36 and name CA)
       (resid  36 and name C) (resid  37 and name  N) 1.0   -43.46    30.00  2
! L 37  Phi Psi
assign (resid  36 and name C ) (resid  37 and name N)
       (resid  37 and name CA) (resid  37 and name C) 1.0   -61.72    30.00  2
assign (resid  37 and name N) (resid  37 and name CA)
       (resid  37 and name C) (resid  38 and name  N) 1.0   -39.67    30.00  2
! A 38  Phi Psi
assign (resid  37 and name C ) (resid  38 and name N)
       (resid  38 and name CA) (resid  38 and name C) 1.0   -68.48    30.00  2
assign (resid  38 and name N) (resid  38 and name CA)
       (resid  38 and name C) (resid  39 and name  N) 1.0   -32.19    30.00  2
! H 39  Phi Psi
assign (resid  38 and name C ) (resid  39 and name N)
       (resid  39 and name CA) (resid  39 and name C) 1.0   -96.00    30.00  2
assign (resid  39 and name N) (resid  39 and name CA)
       (resid  39 and name C) (resid  40 and name  N) 1.0    -9.02    30.00  2
! T 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   -85.51    30.00  2
assign (resid  42 and name N) (resid  42 and name CA)
       (resid  42 and name C) (resid  43 and name  N) 1.0   -23.68    32.67  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  -125.44    30.86  2
assign (resid  43 and name N) (resid  43 and name CA)
       (resid  43 and name C) (resid  44 and name  N) 1.0   112.99    68.32  2
! P 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   -64.28    30.00  2
assign (resid  44 and name N) (resid  44 and name CA)
       (resid  44 and name C) (resid  45 and name  N) 1.0   141.54    30.00  2
! R 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  -121.25    34.88  2
assign (resid  45 and name N) (resid  45 and name CA)
       (resid  45 and name C) (resid  46 and name  N) 1.0   155.49    30.00  2
! T 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   -93.79    33.68  2
assign (resid  46 and name N) (resid  46 and name CA)
       (resid  46 and name C) (resid  47 and name  N) 1.0   166.66    30.00  2
! R 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   -60.36    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   -41.77    30.00  2
! K 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   -61.18    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   -39.68    30.00  2
! Q 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   -65.35    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   -41.47    30.00  2
! I 50  Phi Psi
assign (resid  49 and name C ) (resid  50 and name N)
       (resid  50 and name CA) (resid  50 and name C) 1.0   -60.56    30.00  2
assign (resid  50 and name N) (resid  50 and name CA)
       (resid  50 and name C) (resid  51 and name  N) 1.0   -47.44    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   -57.41    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   -48.26    30.00  2
! H 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   -59.44    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   -40.65    30.00  2
! H 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   -64.55    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   -43.34    30.00  2
! L 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   -63.35    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   -40.71    30.00  2
! V 55  Phi Psi
assign (resid  54 and name C ) (resid  55 and name N)
       (resid  55 and name CA) (resid  55 and name C) 1.0   -67.56    30.00  2
assign (resid  55 and name N) (resid  55 and name CA)
       (resid  55 and name C) (resid  56 and name  N) 1.0   -38.39    30.00  2
! Q 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   -65.98    30.00  2
assign (resid  56 and name N) (resid  56 and name CA)
       (resid  56 and name C) (resid  57 and name  N) 1.0   -38.94    30.00  2
! M 57  Phi Psi
assign (resid  56 and name C ) (resid  57 and name N)
       (resid  57 and name CA) (resid  57 and name C) 1.0   -88.41    30.00  2
assign (resid  57 and name N) (resid  57 and name CA)
       (resid  57 and name C) (resid  58 and name  N) 1.0    -4.96    30.00  2
! G 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    88.13    30.00  2
assign (resid  58 and name N) (resid  58 and name CA)
       (resid  58 and name C) (resid  59 and name  N) 1.0    17.71    30.00  2
! A 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  -112.90    56.70  2
assign (resid  60 and name N) (resid  60 and name CA)
       (resid  60 and name C) (resid  61 and name  N) 1.0   149.85    30.00  2
! D 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   -81.48    31.50  2
assign (resid  61 and name N) (resid  61 and name CA)
       (resid  61 and name C) (resid  62 and name  N) 1.0   -25.84    30.00  2
! V 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   -56.71    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   -35.20    30.00  2
! K 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   -62.47    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   -30.09    30.00  2
! D 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   -68.36    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   -28.17    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  -101.23    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    -1.63    30.00  2
! L 75  Phi Psi
assign (resid  74 and name C ) (resid  75 and name N)
       (resid  75 and name CA) (resid  75 and name C) 1.0  -100.64    40.45  2
assign (resid  75 and name N) (resid  75 and name CA)
       (resid  75 and name C) (resid  76 and name  N) 1.0   122.40    30.00  2
! W 76  Phi Psi
assign (resid  75 and name C ) (resid  76 and name N)
       (resid  76 and name CA) (resid  76 and name C) 1.0  -108.95    31.06  2
assign (resid  76 and name N) (resid  76 and name CA)
       (resid  76 and name C) (resid  77 and name  N) 1.0   130.31    30.00  2
! T 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  -106.69    51.86  2
assign (resid  77 and name N) (resid  77 and name CA)
       (resid  77 and name C) (resid  78 and name  N) 1.0   165.50    30.00  2
! G 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   -60.55    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   -38.04    30.00  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   -63.87    30.00  2
assign (resid  79 and name N) (resid  79 and name CA)
       (resid  79 and name C) (resid  80 and name  N) 1.0   -41.56    30.00  2
! Q 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   -66.50    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   -39.00    30.00  2
! E 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   -65.31    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   -39.98    30.00  2
! L 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   -64.00    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   -40.95    30.00  2
! E 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   -63.19    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   -38.87    30.00  2
! L 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   -65.78    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   -39.36    30.00  2
! Q 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   -62.36    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   -41.37    30.00  2
! R 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   -62.66    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   -43.50    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   -63.99    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   -43.26    30.00  2
! F 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   -57.99    30.00  2
assign (resid  88 and name N) (resid  88 and name CA)
       (resid  88 and name C) (resid  89 and name  N) 1.0   -47.08    30.00  2
! E 89  Phi Psi
assign (resid  88 and name C ) (resid  89 and name N)
       (resid  89 and name CA) (resid  89 and name C) 1.0   -59.76    30.00  2
assign (resid  89 and name N) (resid  89 and name CA)
       (resid  89 and name C) (resid  90 and name  N) 1.0   -36.82    30.00  2
! E 90  Phi Psi
assign (resid  89 and name C ) (resid  90 and name N)
       (resid  90 and name CA) (resid  90 and name C) 1.0   -69.35    30.00  2
assign (resid  90 and name N) (resid  90 and name CA)
       (resid  90 and name C) (resid  91 and name  N) 1.0   -40.41    30.00  2
! F 91  Phi Psi
assign (resid  90 and name C ) (resid  91 and name N)
       (resid  91 and name CA) (resid  91 and name C) 1.0   -87.28    42.44  2
assign (resid  91 and name N) (resid  91 and name CA)
       (resid  91 and name C) (resid  92 and name  N) 1.0   -11.79    40.58  2
! R 92  Phi Psi
assign (resid  91 and name C ) (resid  92 and name N)
       (resid  92 and name CA) (resid  92 and name C) 1.0   -61.31    30.00  2
assign (resid  92 and name N) (resid  92 and name CA)
       (resid  92 and name C) (resid  93 and name  N) 1.0   -33.28    30.00  2
! D 93  Phi Psi
assign (resid  92 and name C ) (resid  93 and name N)
       (resid  93 and name CA) (resid  93 and name C) 1.0   -96.70    37.58  2
assign (resid  93 and name N) (resid  93 and name CA)
       (resid  93 and name C) (resid  94 and name  N) 1.0    -1.61    45.62  2
! D 95  Phi Psi
assign (resid  94 and name C ) (resid  95 and name N)
       (resid  95 and name CA) (resid  95 and name C) 1.0   -68.53    41.53  2
assign (resid  95 and name N) (resid  95 and name CA)
       (resid  95 and name C) (resid  96 and name  N) 1.0   -28.25    30.00  2
! V 97  Phi Psi
assign (resid  96 and name C ) (resid  97 and name N)
       (resid  97 and name CA) (resid  97 and name C) 1.0   -56.60    30.00  2
assign (resid  97 and name N) (resid  97 and name CA)
       (resid  97 and name C) (resid  98 and name  N) 1.0   -31.42    31.55  2
! L 98  Phi Psi
assign (resid  97 and name C ) (resid  98 and name N)
       (resid  98 and name CA) (resid  98 and name C) 1.0   -62.54    30.00  2
assign (resid  98 and name N) (resid  98 and name CA)
       (resid  98 and name C) (resid  99 and name  N) 1.0   -40.74    30.00  2
! G 99  Phi Psi
assign (resid  98 and name C ) (resid  99 and name N)
       (resid  99 and name CA) (resid  99 and name C) 1.0   -62.79    30.00  2
assign (resid  99 and name N) (resid  99 and name CA)
       (resid  99 and name C) (resid  100 and name  N) 1.0   -42.17    30.00  2
! H 100 Phi Psi
assign (resid  99 and name C ) (resid  100 and name N)
       (resid  100 and name CA) (resid  100 and name C) 1.0   -67.22    30.00  2
assign (resid  100 and name N) (resid  100 and name CA)
       (resid  100 and name C) (resid  101 and name  N) 1.0   -38.58    30.00  2
! I 101 Phi Psi
assign (resid  100 and name C ) (resid  101 and name N)
       (resid  101 and name CA) (resid  101 and name C) 1.0   -63.51    30.00  2
assign (resid  101 and name N) (resid  101 and name CA)
       (resid  101 and name C) (resid  102 and name  N) 1.0   -44.05    30.00  2
! M 102 Phi Psi
assign (resid  101 and name C ) (resid  102 and name N)
       (resid  102 and name CA) (resid  102 and name C) 1.0   -63.60    30.00  2
assign (resid  102 and name N) (resid  102 and name CA)
       (resid  102 and name C) (resid  103 and name  N) 1.0   -35.34    30.00  2
! K 103 Phi Psi
assign (resid  102 and name C ) (resid  103 and name N)
       (resid  103 and name CA) (resid  103 and name C) 1.0   -72.57    30.00  2
assign (resid  103 and name N) (resid  103 and name CA)
       (resid  103 and name C) (resid  104 and name  N) 1.0   -30.85    30.00  2
! N 104 Phi Psi
assign (resid  103 and name C ) (resid  104 and name N)
       (resid  104 and name CA) (resid  104 and name C) 1.0   -97.22    30.00  2
assign (resid  104 and name N) (resid  104 and name CA)
       (resid  104 and name C) (resid  105 and name  N) 1.0   -12.98    31.29  2
! T 106 Phi Psi
assign (resid  105 and name C ) (resid  106 and name N)
       (resid  106 and name CA) (resid  106 and name C) 1.0   -71.40    35.54  2
assign (resid  106 and name N) (resid  106 and name CA)
       (resid  106 and name C) (resid  107 and name  N) 1.0   -23.46    30.00  2
! R 109 Phi Psi
assign (resid  108 and name C ) (resid  109 and name N)
       (resid  109 and name CA) (resid  109 and name C) 1.0  -115.39    41.67  2
assign (resid  109 and name N) (resid  109 and name CA)
       (resid  109 and name C) (resid  110 and name  N) 1.0   151.65    30.00  2
! S 110 Phi Psi
assign (resid  109 and name C ) (resid  110 and name N)
       (resid  110 and name CA) (resid  110 and name C) 1.0   -76.68    30.00  2
assign (resid  110 and name N) (resid  110 and name CA)
       (resid  110 and name C) (resid  111 and name  N) 1.0   157.84    30.00  2
! R 111 Phi Psi
assign (resid  110 and name C ) (resid  111 and name N)
       (resid  111 and name CA) (resid  111 and name C) 1.0   -56.93    30.00  2
assign (resid  111 and name N) (resid  111 and name CA)
       (resid  111 and name C) (resid  112 and name  N) 1.0   -43.06    30.00  2
! A 112 Phi Psi
assign (resid  111 and name C ) (resid  112 and name N)
       (resid  112 and name CA) (resid  112 and name C) 1.0   -58.52    30.00  2
assign (resid  112 and name N) (resid  112 and name CA)
       (resid  112 and name C) (resid  113 and name  N) 1.0   -39.89    30.00  2
! R 113 Phi Psi
assign (resid  112 and name C ) (resid  113 and name N)
       (resid  113 and name CA) (resid  113 and name C) 1.0   -66.36    30.00  2
assign (resid  113 and name N) (resid  113 and name CA)
       (resid  113 and name C) (resid  114 and name  N) 1.0   -40.16    30.00  2
! I 114 Phi Psi
assign (resid  113 and name C ) (resid  114 and name N)
       (resid  114 and name CA) (resid  114 and name C) 1.0   -62.90    30.00  2
assign (resid  114 and name N) (resid  114 and name CA)
       (resid  114 and name C) (resid  115 and name  N) 1.0   -45.27    30.00  2
! V 115 Phi Psi
assign (resid  114 and name C ) (resid  115 and name N)
       (resid  115 and name CA) (resid  115 and name C) 1.0   -61.00    30.00  2
assign (resid  115 and name N) (resid  115 and name CA)
       (resid  115 and name C) (resid  116 and name  N) 1.0   -43.66    30.00  2
! D 116 Phi Psi
assign (resid  115 and name C ) (resid  116 and name N)
       (resid  116 and name CA) (resid  116 and name C) 1.0   -63.28    30.00  2
assign (resid  116 and name N) (resid  116 and name CA)
       (resid  116 and name C) (resid  117 and name  N) 1.0   -36.21    30.00  2
! K 117 Phi Psi
assign (resid  116 and name C ) (resid  117 and name N)
       (resid  117 and name CA) (resid  117 and name C) 1.0   -67.23    30.00  2
assign (resid  117 and name N) (resid  117 and name CA)
       (resid  117 and name C) (resid  118 and name  N) 1.0   -36.68    30.00  2
! L 118 Phi Psi
assign (resid  117 and name C ) (resid  118 and name N)
       (resid  118 and name CA) (resid  118 and name C) 1.0   -60.80    30.00  2
assign (resid  118 and name N) (resid  118 and name CA)
       (resid  118 and name C) (resid  119 and name  N) 1.0   -43.91    30.00  2
! L 119 Phi Psi
assign (resid  118 and name C ) (resid  119 and name N)
       (resid  119 and name CA) (resid  119 and name C) 1.0   -65.76    30.00  2
assign (resid  119 and name N) (resid  119 and name CA)
       (resid  119 and name C) (resid  120 and name  N) 1.0   -38.88    30.00  2
! A 120 Phi Psi
assign (resid  119 and name C ) (resid  120 and name N)
       (resid  120 and name CA) (resid  120 and name C) 1.0   -63.51    30.00  2
assign (resid  120 and name N) (resid  120 and name CA)
       (resid  120 and name C) (resid  121 and name  N) 1.0   -34.09    30.00  2
! L 121 Phi Psi
assign (resid  120 and name C ) (resid  121 and name N)
       (resid  121 and name CA) (resid  121 and name C) 1.0   -83.39    30.00  2
assign (resid  121 and name N) (resid  121 and name CA)
       (resid  121 and name C) (resid  122 and name  N) 1.0    -3.92    30.00  2
! G 122 Phi Psi
assign (resid  121 and name C ) (resid  122 and name N)
       (resid  122 and name CA) (resid  122 and name C) 1.0    83.92    30.00  2
assign (resid  122 and name N) (resid  122 and name CA)
       (resid  122 and name C) (resid  123 and name  N) 1.0    14.24    30.00  2
! L 123 Phi Psi
assign (resid  122 and name C ) (resid  123 and name N)
       (resid  123 and name CA) (resid  123 and name C) 1.0   -84.92    30.11  2
assign (resid  123 and name N) (resid  123 and name CA)
       (resid  123 and name C) (resid  124 and name  N) 1.0   -16.27    35.95  2
! A 125 Phi Psi
assign (resid  124 and name C ) (resid  125 and name N)
       (resid  125 and name CA) (resid  125 and name C) 1.0   -96.18    30.00  2
assign (resid  125 and name N) (resid  125 and name CA)
       (resid  125 and name C) (resid  126 and name  N) 1.0   -27.82    30.00  2
! E 126 Phi Psi
assign (resid  125 and name C ) (resid  126 and name N)
       (resid  126 and name CA) (resid  126 and name C) 1.0  -138.79    50.50  2
assign (resid  126 and name N) (resid  126 and name CA)
       (resid  126 and name C) (resid  127 and name  N) 1.0   159.71    30.00  2
! R 127 Phi Psi
assign (resid  126 and name C ) (resid  127 and name N)
       (resid  127 and name CA) (resid  127 and name C) 1.0   -57.63    30.00  2
assign (resid  127 and name N) (resid  127 and name CA)
       (resid  127 and name C) (resid  128 and name  N) 1.0   -42.82    30.00  2
! R 128 Phi Psi
assign (resid  127 and name C ) (resid  128 and name N)
       (resid  128 and name CA) (resid  128 and name C) 1.0   -65.72    30.00  2
assign (resid  128 and name N) (resid  128 and name CA)
       (resid  128 and name C) (resid  129 and name  N) 1.0   -21.34    41.49  2
! E 129 Phi Psi
assign (resid  128 and name C ) (resid  129 and name N)
       (resid  129 and name CA) (resid  129 and name C) 1.0   -69.36    30.00  2
assign (resid  129 and name N) (resid  129 and name CA)
       (resid  129 and name C) (resid  130 and name  N) 1.0   -28.31    30.00  2
! L 130 Phi Psi
assign (resid  129 and name C ) (resid  130 and name N)
       (resid  130 and name CA) (resid  130 and name C) 1.0   -90.13    30.00  2
assign (resid  130 and name N) (resid  130 and name CA)
       (resid  130 and name C) (resid  131 and name  N) 1.0    -8.14    30.83  2
# Restraints file 2: unambig.tbl
 ASSI {    1}
   (( segid "    " and resid 131  and name H   ))
   (  segid "    " and resid 130  and name HD1%)
      4.000     2.000     2.000 peak     1 spectrum    1 weight  0.10000E+01 volume  0.12550E-02 ppm1      7.421 ppm2      0.941 CV     1
 ASSI {    5}
   (( segid "    " and resid 102  and name H   ))
   (( segid "    " and resid 102  and name HA  ))
      3.000     1.100     1.100 peak     5 spectrum    1 weight  0.10000E+01 volume  0.13768E-02 ppm1      8.595 ppm2      4.037 CV     1
 ASSI {    7}
   (( segid "    " and resid 102  and name H   ))
   (( segid "    " and resid 102  and name HG3 ))
      4.200     2.200     1.800 peak     7 spectrum    1 weight  0.10000E+01 volume  0.12197E-02 ppm1      8.598 ppm2      2.590 CV     1
 ASSI {    8}
   (( segid "    " and resid 102  and name H   ))
   (( segid "    " and resid 102  and name HB2 ))
      2.900     1.100     1.100 peak     8 spectrum    1 weight  0.10000E+01 volume  0.25329E-02 ppm1      8.594 ppm2      2.154 CV     1
 OR {    8}
   (( segid "    " and resid 102  and name H   ))
   (  segid "    " and resid 102  and name HE% )
 OR {    8}
   (( segid "    " and resid 102  and name H   ))
   (( segid "    " and resid 102  and name HB3 ))
 ASSI {    9}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 4    and name HA  ))
      2.800     1.000     1.000 peak     9 spectrum    1 weight  0.10000E+01 volume  0.32181E-02 ppm1      8.256 ppm2      4.328 CV     1
 ASSI {   10}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 4    and name HB2 ))
      2.600     0.800     0.800 peak    10 spectrum    1 weight  0.10000E+01 volume  0.30630E-02 ppm1      8.257 ppm2      1.793 CV     1
 ASSI {   11}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 4    and name HG3 ))
      3.100     1.200     1.200 peak    11 spectrum    1 weight  0.10000E+01 volume  0.29095E-02 ppm1      8.259 ppm2      1.698 CV     1
 OR {   11}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 4    and name HG2 ))
 ASSI {   12}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 3    and name HB3 ))
      3.600     1.600     1.600 peak    12 spectrum    1 weight  0.10000E+01 volume  0.73999E-03 ppm1      8.255 ppm2      3.939 CV     1
 ASSI {   13}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 4    and name HD3 ))
      4.600     2.700     1.400 peak    13 spectrum    1 weight  0.10000E+01 volume  0.47733E-03 ppm1      8.262 ppm2      3.234 CV     1
 OR {   13}
   (( segid "    " and resid 4    and name H   ))
   (( segid "    " and resid 4    and name HD2 ))
 ASSI {   16}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 5    and name HB2 ))
      2.300     0.700     0.700 peak    16 spectrum    1 weight  0.10000E+01 volume  0.52252E-02 ppm1      8.153 ppm2      1.745 CV     1
 ASSI {   18}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 6    and name HA  ))
      3.000     1.100     1.100 peak    18 spectrum    1 weight  0.10000E+01 volume  0.20871E-02 ppm1      8.345 ppm2      4.571 CV     1
 ASSI {   20}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 5    and name HA  ))
      2.000     0.500     0.500 peak    20 spectrum    1 weight  0.10000E+01 volume  0.16597E-01 ppm1      8.345 ppm2      4.313 CV     1
 ASSI {   21}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 8    and name HA  ))
      3.300     3.300     2.700 peak    21 spectrum    1 weight  0.10000E+01 volume  0.17583E-02 ppm1      8.345 ppm2      4.213 CV     1
 OR {   21}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 8    and name HB  ))
 ASSI {   22}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 5    and name HB3 ))
      3.200     1.300     1.300 peak    22 spectrum    1 weight  0.10000E+01 volume  0.25187E-02 ppm1      8.346 ppm2      1.831 CV     1
 ASSI {   23}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 5    and name HG3 ))
      3.200     1.300     1.300 peak    23 spectrum    1 weight  0.10000E+01 volume  0.23554E-02 ppm1      8.346 ppm2      1.641 CV     1
 OR {   23}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 5    and name HG2 ))
 ASSI {   24}
   (( segid "    " and resid 6    and name H   ))
   (  segid "    " and resid 6    and name HB% )
      2.300     0.700     0.700 peak    24 spectrum    1 weight  0.10000E+01 volume  0.91589E-02 ppm1      8.344 ppm2      1.339 CV     1
 ASSI {   25}
   (( segid "    " and resid 6    and name H   ))
   (  segid "    " and resid 8    and name HG2%)
      2.800     2.800     3.200 peak    25 spectrum    1 weight  0.10000E+01 volume  0.46093E-02 ppm1      8.345 ppm2      1.268 CV     1
 ASSI {   26}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 7    and name HD2 ))
      5.000     3.100     1.000 peak    26 spectrum    1 weight  0.10000E+01 volume  0.67800E-03 ppm1      8.342 ppm2      3.821 CV     1
 ASSI {   27}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 7    and name HD3 ))
      4.400     2.400     1.600 peak    27 spectrum    1 weight  0.10000E+01 volume  0.10247E-02 ppm1      8.343 ppm2      3.553 CV     1
 ASSI {   29}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 5    and name HB2 ))
      3.500     1.600     1.600 peak    29 spectrum    1 weight  0.10000E+01 volume  0.29428E-02 ppm1      8.345 ppm2      1.743 CV     1
 ASSI {   30}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 5    and name H   ))
      4.500     2.600     1.500 peak    30 spectrum    1 weight  0.10000E+01 volume  0.62539E-03 ppm1      8.344 ppm2      8.145 CV     1
 ASSI {   31}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 5    and name HD3 ))
      2.500     2.500     3.500 peak    31 spectrum    1 weight  0.10000E+01 volume  0.63277E-03 ppm1      8.342 ppm2      3.197 CV     1
 OR {   31}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 5    and name HD2 ))
 ASSI {   32}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 7    and name HA  ))
      2.100     0.500     0.500 peak    32 spectrum    1 weight  0.10000E+01 volume  0.12232E-01 ppm1      8.350 ppm2      4.463 CV     1
 ASSI {   33}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 8    and name HA  ))
      2.600     0.800     0.800 peak    33 spectrum    1 weight  0.10000E+01 volume  0.63143E-02 ppm1      8.350 ppm2      4.228 CV     1
 OR {   33}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 8    and name HB  ))
 ASSI {   35}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 7    and name HB3 ))
      3.100     1.200     1.200 peak    35 spectrum    1 weight  0.10000E+01 volume  0.21516E-02 ppm1      8.349 ppm2      2.239 CV     1
 ASSI {   36}
   (( segid "    " and resid 8    and name H   ))
   (  segid "    " and resid 8    and name HG2%)
      2.700     0.900     0.900 peak    36 spectrum    1 weight  0.10000E+01 volume  0.33698E-02 ppm1      8.348 ppm2      1.253 CV     1
 ASSI {   37}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 9    and name H   ))
      3.700     1.700     1.700 peak    37 spectrum    1 weight  0.10000E+01 volume  0.12148E-02 ppm1      8.350 ppm2      8.689 CV     1
 ASSI {   38}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 9    and name HA  ))
      2.800     1.000     1.000 peak    38 spectrum    1 weight  0.10000E+01 volume  0.19211E-02 ppm1      8.689 ppm2      4.473 CV     1
 ASSI {   39}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 8    and name HA  ))
      2.100     0.500     0.500 peak    39 spectrum    1 weight  0.10000E+01 volume  0.10962E-01 ppm1      8.689 ppm2      4.234 CV     1
 OR {   39}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 8    and name HB  ))
 ASSI {   40}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 9    and name HB3 ))
      2.700     0.900     0.900 peak    40 spectrum    1 weight  0.10000E+01 volume  0.42539E-02 ppm1      8.689 ppm2      2.889 CV     1
 OR {   40}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 9    and name HB2 ))
 ASSI {   42}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 9    and name HE1 ))
      4.700     2.800     1.300 peak    42 spectrum    1 weight  0.10000E+01 volume  0.62612E-03 ppm1      8.684 ppm2      0.101 CV     1
 ASSI {   44}
   (( segid "    " and resid 9    and name H   ))
   (( segid "    " and resid 9    and name HD1 ))
      2.000     0.500     0.500 peak    44 spectrum    1 weight  0.10000E+01 volume  0.32605E-02 ppm1      8.688 ppm2      6.981 CV     1
 ASSI {   45}
   (( segid "    " and resid 9    and name HE1 ))
   (( segid "    " and resid 8    and name HA  ))
      4.200     2.200     1.800 peak    45 spectrum    1 weight  0.10000E+01 volume  0.81429E-03 ppm1      9.901 ppm2      4.230 CV     1
 ASSI {   51}
   (( segid "    " and resid 9    and name HE1 ))
   (( segid "    " and resid 53   and name H   ))
      4.700     2.800     1.300 peak    51 spectrum    1 weight  0.10000E+01 volume  0.57252E-03 ppm1      9.901 ppm2      8.143 CV     1
 ASSI {   52}
   (( segid "    " and resid 9    and name HE1 ))
   (( segid "    " and resid 9    and name HD1 ))
      2.000     0.500     0.500 peak    52 spectrum    1 weight  0.10000E+01 volume  0.15668E-01 ppm1      9.901 ppm2      6.968 CV     1
 OR {   52}
   (( segid "    " and resid 9    and name HE1 ))
   (( segid "    " and resid 9    and name HZ2 ))
 ASSI {   53}
   (( segid "    " and resid 9    and name HE1 ))
   (( segid "    " and resid 9    and name HH2 ))
      4.000     2.000     2.000 peak    53 spectrum    1 weight  0.10000E+01 volume  0.12391E-02 ppm1      9.898 ppm2      6.729 CV     1
 ASSI {   54}
   (( segid "    " and resid 9    and name HE1 ))
   (( segid "    " and resid 53   and name HD2 ))
      3.100     1.200     1.200 peak    54 spectrum    1 weight  0.10000E+01 volume  0.54236E-03 ppm1      9.904 ppm2      5.783 CV     1
 ASSI {   55}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 9    and name HA  ))
      2.300     0.700     0.700 peak    55 spectrum    1 weight  0.10000E+01 volume  0.70709E-02 ppm1      8.814 ppm2      4.491 CV     1
 ASSI {   56}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 13   and name HA  ))
      4.000     2.000     2.000 peak    56 spectrum    1 weight  0.10000E+01 volume  0.96614E-03 ppm1      8.813 ppm2      4.243 CV     1
 ASSI {   57}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 10   and name HB3 ))
      2.900     1.100     1.100 peak    57 spectrum    1 weight  0.10000E+01 volume  0.27447E-02 ppm1      8.814 ppm2      4.060 CV     1
 ASSI {   58}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 9    and name HB2 ))
      3.100     1.200     1.200 peak    58 spectrum    1 weight  0.10000E+01 volume  0.19050E-02 ppm1      8.813 ppm2      2.889 CV     1
 OR {   58}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 9    and name HB3 ))
 ASSI {   59}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 13   and name HB3 ))
      3.000     1.100     1.100 peak    59 spectrum    1 weight  0.10000E+01 volume  0.42607E-02 ppm1      8.814 ppm2      2.402 CV     1
 OR {   59}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 13   and name HB2 ))
 OR {   59}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 13   and name HG2 ))
 ASSI {   61}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 13   and name H   ))
      3.600     1.600     1.600 peak    61 spectrum    1 weight  0.10000E+01 volume  0.66529E-03 ppm1      8.820 ppm2      8.037 CV     1
 ASSI {   62}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 9    and name HE3 ))
      4.600     2.600     1.400 peak    62 spectrum    1 weight  0.10000E+01 volume  0.89600E-03 ppm1      8.816 ppm2      7.072 CV     1
 ASSI {   63}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 10   and name HA  ))
      3.000     1.100     1.100 peak    63 spectrum    1 weight  0.10000E+01 volume  0.16889E-02 ppm1      8.815 ppm2      4.931 CV     1
 ASSI {   65}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 12   and name HA  ))
      2.700     0.900     0.900 peak    65 spectrum    1 weight  0.10000E+01 volume  0.37176E-02 ppm1      8.972 ppm2      4.138 CV     1
 ASSI {   68}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 12   and name HB2 ))
      2.500     0.800     0.800 peak    68 spectrum    1 weight  0.10000E+01 volume  0.46870E-02 ppm1      8.972 ppm2      2.122 CV     1
 ASSI {   69}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 12   and name HB3 ))
      2.800     1.000     1.000 peak    69 spectrum    1 weight  0.10000E+01 volume  0.47588E-02 ppm1      8.973 ppm2      2.010 CV     1
 ASSI {   70}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 14   and name H   ))
      3.800     1.800     1.800 peak    70 spectrum    1 weight  0.10000E+01 volume  0.50998E-03 ppm1      8.974 ppm2      8.724 CV     1
 ASSI {   71}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 13   and name H   ))
      2.800     1.000     1.000 peak    71 spectrum    1 weight  0.10000E+01 volume  0.24080E-02 ppm1      8.972 ppm2      8.040 CV     1
 ASSI {   72}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 13   and name HA  ))
      3.100     1.200     1.200 peak    72 spectrum    1 weight  0.10000E+01 volume  0.15023E-02 ppm1      8.042 ppm2      4.256 CV     1
 ASSI {   73}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 12   and name HA  ))
      3.700     1.700     1.700 peak    73 spectrum    1 weight  0.10000E+01 volume  0.88681E-03 ppm1      8.043 ppm2      4.148 CV     1
 ASSI {   74}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 13   and name HB2 ))
      2.500     0.800     0.800 peak    74 spectrum    1 weight  0.10000E+01 volume  0.48534E-02 ppm1      8.043 ppm2      2.407 CV     1
 OR {   74}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 13   and name HB3 ))
 OR {   74}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 13   and name HG3 ))
 OR {   74}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 13   and name HG2 ))
 ASSI {   75}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 12   and name HB2 ))
      3.400     1.400     1.400 peak    75 spectrum    1 weight  0.10000E+01 volume  0.18951E-02 ppm1      8.041 ppm2      2.142 CV     1
 ASSI {   76}
   (( segid "    " and resid 13   and name H   ))
   (( segid "    " and resid 12   and name HB3 ))
      2.700     0.900     0.900 peak    76 spectrum    1 weight  0.10000E+01 volume  0.20877E-02 ppm1      8.046 ppm2      2.018 CV     1
 ASSI {   79}
   (( segid "    " and resid 14   and name H   ))
   (  segid "    " and resid 15   and name HB% )
      5.000     3.100     1.000 peak    79 spectrum    1 weight  0.10000E+01 volume  0.50127E-03 ppm1      8.714 ppm2      1.587 CV     1
 ASSI {   80}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 11   and name HA  ))
      3.600     1.600     1.600 peak    80 spectrum    1 weight  0.10000E+01 volume  0.12310E-02 ppm1      8.720 ppm2      4.520 CV     1
 ASSI {   82}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 14   and name HA  ))
      2.800     1.000     1.000 peak    82 spectrum    1 weight  0.10000E+01 volume  0.19720E-02 ppm1      8.723 ppm2      3.990 CV     1
 ASSI {   85}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 14   and name HB3 ))
      2.800     1.000     1.000 peak    85 spectrum    1 weight  0.10000E+01 volume  0.34498E-02 ppm1      8.723 ppm2      2.101 CV     1
 OR {   85}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 14   and name HG3 ))
 ASSI {   87}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 13   and name H   ))
      2.600     0.800     0.800 peak    87 spectrum    1 weight  0.10000E+01 volume  0.25613E-02 ppm1      8.721 ppm2      8.040 CV     1
 ASSI {   88}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 11   and name HA  ))
      4.100     2.100     1.900 peak    88 spectrum    1 weight  0.10000E+01 volume  0.55611E-03 ppm1      8.274 ppm2      4.538 CV     1
 ASSI {   90}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 14   and name HA  ))
      3.100     1.200     1.200 peak    90 spectrum    1 weight  0.10000E+01 volume  0.17225E-02 ppm1      8.276 ppm2      3.994 CV     1
 ASSI {   91}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 16   and name HB2 ))
      4.200     2.200     1.800 peak    91 spectrum    1 weight  0.10000E+01 volume  0.12941E-02 ppm1      8.274 ppm2      3.362 CV     1
 OR {   91}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 16   and name HB3 ))
 ASSI {   94}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 14   and name HB3 ))
      3.100     1.200     1.200 peak    94 spectrum    1 weight  0.10000E+01 volume  0.31631E-02 ppm1      8.276 ppm2      2.088 CV     1
 ASSI {   95}
   (( segid "    " and resid 15   and name H   ))
   (  segid "    " and resid 15   and name HB% )
      2.200     0.600     0.600 peak    95 spectrum    1 weight  0.10000E+01 volume  0.10261E-01 ppm1      8.277 ppm2      1.572 CV     1
 ASSI {   96}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 16   and name H   ))
      2.300     0.700     0.700 peak    96 spectrum    1 weight  0.10000E+01 volume  0.52648E-02 ppm1      8.277 ppm2      7.991 CV     1
 ASSI {   97}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 12   and name H   ))
      4.200     2.200     1.800 peak    97 spectrum    1 weight  0.10000E+01 volume  0.41074E-03 ppm1      8.276 ppm2      8.981 CV     1
 ASSI {   98}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 14   and name H   ))
      2.400     0.700     0.700 peak    98 spectrum    1 weight  0.10000E+01 volume  0.47295E-02 ppm1      8.276 ppm2      8.727 CV     1
 ASSI {   99}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 16   and name HA  ))
      2.700     0.900     0.900 peak    99 spectrum    1 weight  0.10000E+01 volume  0.21020E-02 ppm1      7.987 ppm2      4.740 CV     1
 ASSI {  101}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 19   and name HA  ))
      4.700     2.800     1.300 peak   101 spectrum    1 weight  0.10000E+01 volume  0.71000E-03 ppm1      7.991 ppm2      4.036 CV     1
 ASSI {  102}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 16   and name HB2 ))
      2.500     0.800     0.800 peak   102 spectrum    1 weight  0.10000E+01 volume  0.47551E-02 ppm1      7.986 ppm2      3.368 CV     1
 OR {  102}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 16   and name HB3 ))
 ASSI {  104}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 19   and name HB2 ))
      3.800     1.800     1.800 peak   104 spectrum    1 weight  0.10000E+01 volume  0.12243E-02 ppm1      7.991 ppm2      2.309 CV     1
 ASSI {  105}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 14   and name HB3 ))
      4.100     2.100     1.900 peak   105 spectrum    1 weight  0.10000E+01 volume  0.10769E-02 ppm1      7.988 ppm2      2.120 CV     1
 OR {  105}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 14   and name HG3 ))
 ASSI {  106}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 17   and name HB2 ))
      4.600     2.600     1.400 peak   106 spectrum    1 weight  0.10000E+01 volume  0.73167E-03 ppm1      7.983 ppm2      1.787 CV     1
 ASSI {  107}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 18   and name HG2 ))
      3.400     1.500     1.500 peak   107 spectrum    1 weight  0.10000E+01 volume  0.17110E-02 ppm1      7.984 ppm2      1.653 CV     1
 ASSI {  109}
   (( segid "    " and resid 16   and name H   ))
   (  segid "    " and resid 17   and name HD1%)
      4.900     3.000     1.100 peak   109 spectrum    1 weight  0.10000E+01 volume  0.81093E-03 ppm1      8.000 ppm2      1.050 CV     1
 ASSI {  112}
   (( segid "    " and resid 16   and name H   ))
   (  segid "    " and resid 57   and name HE% )
      3.900     1.900     1.900 peak   112 spectrum    1 weight  0.10000E+01 volume  0.70275E-03 ppm1      7.987 ppm2      1.986 CV     1
 ASSI {  117}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 16   and name HB2 ))
      2.900     1.000     1.000 peak   117 spectrum    1 weight  0.10000E+01 volume  0.23557E-02 ppm1      8.774 ppm2      3.369 CV     1
 OR {  117}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 16   and name HB3 ))
 ASSI {  118}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 17   and name HB3 ))
      2.600     0.800     0.800 peak   118 spectrum    1 weight  0.10000E+01 volume  0.23798E-02 ppm1      8.775 ppm2      2.218 CV     1
 ASSI {  119}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 17   and name HB2 ))
      2.600     0.800     0.800 peak   119 spectrum    1 weight  0.10000E+01 volume  0.25815E-02 ppm1      8.775 ppm2      1.780 CV     1
 ASSI {  120}
   (( segid "    " and resid 17   and name H   ))
   (  segid "    " and resid 15   and name HB% )
      4.300     2.300     1.700 peak   120 spectrum    1 weight  0.10000E+01 volume  0.11294E-02 ppm1      8.775 ppm2      1.546 CV     1
 ASSI {  121}
   (( segid "    " and resid 17   and name H   ))
   (  segid "    " and resid 17   and name HD1%)
      3.800     1.800     1.800 peak   121 spectrum    1 weight  0.10000E+01 volume  0.19280E-02 ppm1      8.775 ppm2      1.051 CV     1
 ASSI {  123}
   (( segid "    " and resid 17   and name H   ))
   (  segid "    " and resid 59   and name HD1%)
      4.600     2.600     1.400 peak   123 spectrum    1 weight  0.10000E+01 volume  0.10053E-02 ppm1      8.770 ppm2      0.829 CV     1
 ASSI {  124}
   (( segid "    " and resid 17   and name H   ))
   (  segid "    " and resid 17   and name HD2%)
      4.300     2.300     1.700 peak   124 spectrum    1 weight  0.10000E+01 volume  0.12064E-02 ppm1      8.778 ppm2      0.743 CV     1
 ASSI {  126}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 16   and name H   ))
      2.500     0.800     0.800 peak   126 spectrum    1 weight  0.10000E+01 volume  0.30139E-02 ppm1      8.776 ppm2      7.990 CV     1
 ASSI {  127}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 15   and name HA  ))
      3.800     1.800     1.800 peak   127 spectrum    1 weight  0.10000E+01 volume  0.10433E-02 ppm1      8.313 ppm2      4.205 CV     1
 ASSI {  129}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 18   and name HA  ))
      2.600     0.800     0.800 peak   129 spectrum    1 weight  0.10000E+01 volume  0.22621E-02 ppm1      8.316 ppm2      3.801 CV     1
 ASSI {  130}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 18   and name HD3 ))
      4.100     2.100     1.900 peak   130 spectrum    1 weight  0.10000E+01 volume  0.12992E-02 ppm1      8.315 ppm2      3.323 CV     1
 OR {  130}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 18   and name HD2 ))
 ASSI {  134}
   (( segid "    " and resid 18   and name H   ))
   (  segid "    " and resid 59   and name HD1%)
      3.800     1.800     1.800 peak   134 spectrum    1 weight  0.10000E+01 volume  0.13686E-02 ppm1      8.315 ppm2      0.828 CV     1
 ASSI {  135}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 19   and name H   ))
      2.400     0.700     0.700 peak   135 spectrum    1 weight  0.10000E+01 volume  0.33072E-02 ppm1      8.314 ppm2      7.991 CV     1
 ASSI {  136}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 17   and name H   ))
      2.600     0.900     0.900 peak   136 spectrum    1 weight  0.10000E+01 volume  0.19199E-02 ppm1      8.315 ppm2      8.772 CV     1
 ASSI {  137}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 16   and name HA  ))
      3.700     1.700     1.700 peak   137 spectrum    1 weight  0.10000E+01 volume  0.56037E-03 ppm1      7.991 ppm2      4.726 CV     1
 ASSI {  138}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 15   and name HA  ))
      4.300     2.300     1.700 peak   138 spectrum    1 weight  0.10000E+01 volume  0.73603E-03 ppm1      7.991 ppm2      4.200 CV     1
 ASSI {  139}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 19   and name HA  ))
      2.700     0.900     0.900 peak   139 spectrum    1 weight  0.10000E+01 volume  0.29070E-02 ppm1      7.992 ppm2      4.028 CV     1
 ASSI {  140}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 18   and name HA  ))
      3.400     1.400     1.400 peak   140 spectrum    1 weight  0.10000E+01 volume  0.74869E-03 ppm1      7.991 ppm2      3.814 CV     1
 ASSI {  141}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 19   and name HB2 ))
      2.300     0.600     0.600 peak   141 spectrum    1 weight  0.10000E+01 volume  0.51275E-02 ppm1      7.991 ppm2      2.280 CV     1
 OR {  141}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 19   and name HB3 ))
 ASSI {  143}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 18   and name HG2 ))
      2.800     0.900     0.900 peak   143 spectrum    1 weight  0.10000E+01 volume  0.17157E-02 ppm1      7.989 ppm2      1.673 CV     1
 OR {  143}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 18   and name HG3 ))
 ASSI {  147}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 19   and name HG2 ))
      4.000     2.000     2.000 peak   147 spectrum    1 weight  0.10000E+01 volume  0.19713E-02 ppm1      7.991 ppm2      2.464 CV     1
 ASSI {  148}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 20   and name H   ))
      2.600     0.900     0.900 peak   148 spectrum    1 weight  0.10000E+01 volume  0.19007E-02 ppm1      7.991 ppm2      8.677 CV     1
 ASSI {  151}
   (( segid "    " and resid 20   and name H   ))
   (( segid "    " and resid 20   and name HB2 ))
      2.400     0.700     0.700 peak   151 spectrum    1 weight  0.10000E+01 volume  0.19827E-02 ppm1      8.674 ppm2      1.138 CV     1
 ASSI {  152}
   (( segid "    " and resid 20   and name H   ))
   (  segid "    " and resid 20   and name HD1%)
      3.800     1.800     1.800 peak   152 spectrum    1 weight  0.10000E+01 volume  0.31168E-02 ppm1      8.672 ppm2      0.680 CV     1
 ASSI {  158}
   (( segid "    " and resid 21   and name H   ))
   (( segid "    " and resid 18   and name HA  ))
      3.200     1.300     1.300 peak   158 spectrum    1 weight  0.10000E+01 volume  0.72997E-03 ppm1      8.936 ppm2      3.806 CV     1
 ASSI {  159}
   (( segid "    " and resid 21   and name H   ))
   (( segid "    " and resid 21   and name HB3 ))
      2.400     0.700     0.700 peak   159 spectrum    1 weight  0.10000E+01 volume  0.27839E-02 ppm1      8.942 ppm2      3.041 CV     1
 OR {  159}
   (( segid "    " and resid 21   and name H   ))
   (( segid "    " and resid 21   and name HB2 ))
 ASSI {  162}
   (( segid "    " and resid 21   and name H   ))
   (  segid "    " and resid 20   and name HD1%)
      4.300     2.300     1.700 peak   162 spectrum    1 weight  0.10000E+01 volume  0.74547E-03 ppm1      8.940 ppm2      0.658 CV     1
 ASSI {  163}
   (( segid "    " and resid 21   and name H   ))
   (  segid "    " and resid 20   and name HD2%)
      4.800     2.800     1.200 peak   163 spectrum    1 weight  0.10000E+01 volume  0.74102E-03 ppm1      8.943 ppm2      0.611 CV     1
 ASSI {  164}
   (( segid "    " and resid 21   and name H   ))
   (( segid "    " and resid 20   and name H   ))
      2.700     0.900     0.900 peak   164 spectrum    1 weight  0.10000E+01 volume  0.16459E-02 ppm1      8.943 ppm2      8.675 CV     1
 ASSI {  165}
   (( segid "    " and resid 21   and name H   ))
   (( segid "    " and resid 22   and name H   ))
      2.900     1.000     1.000 peak   165 spectrum    1 weight  0.10000E+01 volume  0.16369E-02 ppm1      8.941 ppm2      8.561 CV     1
 ASSI {  166}
   (( segid "    " and resid 21   and name H   ))
   (  segid "    " and resid 21   and name HD% )
      4.200     2.200     1.800 peak   166 spectrum    1 weight  0.10000E+01 volume  0.11282E-02 ppm1      8.938 ppm2      6.907 CV     1
 ASSI {  168}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 22   and name HA  ))
      2.900     1.100     1.100 peak   168 spectrum    1 weight  0.10000E+01 volume  0.85014E-03 ppm1      8.561 ppm2      3.711 CV     1
 ASSI {  169}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 21   and name HB2 ))
      2.500     0.800     0.800 peak   169 spectrum    1 weight  0.10000E+01 volume  0.13888E-02 ppm1      8.557 ppm2      3.043 CV     1
 OR {  169}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 21   and name HB3 ))
 ASSI {  170}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 22   and name HG  ))
      2.300     0.700     0.700 peak   170 spectrum    1 weight  0.10000E+01 volume  0.19693E-02 ppm1      8.558 ppm2      2.052 CV     1
 ASSI {  171}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 22   and name HB2 ))
      3.000     1.100     1.100 peak   171 spectrum    1 weight  0.10000E+01 volume  0.19496E-02 ppm1      8.558 ppm2      1.947 CV     1
 ASSI {  173}
   (( segid "    " and resid 22   and name H   ))
   (  segid "    " and resid 22   and name HD2%)
      2.800     1.000     1.000 peak   173 spectrum    1 weight  0.10000E+01 volume  0.30092E-02 ppm1      8.557 ppm2      0.948 CV     1
 OR {  173}
   (( segid "    " and resid 22   and name H   ))
   (  segid "    " and resid 22   and name HD1%)
 ASSI {  175}
   (( segid "    " and resid 22   and name H   ))
   (  segid "    " and resid 21   and name HD% )
      3.400     1.400     1.400 peak   175 spectrum    1 weight  0.10000E+01 volume  0.76915E-03 ppm1      8.563 ppm2      6.901 CV     1
 ASSI {  178}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 23   and name HA  ))
      2.600     0.900     0.900 peak   178 spectrum    1 weight  0.10000E+01 volume  0.50197E-02 ppm1      7.846 ppm2      4.241 CV     1
 ASSI {  179}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 22   and name HA  ))
      3.200     1.300     1.300 peak   179 spectrum    1 weight  0.10000E+01 volume  0.10394E-02 ppm1      7.848 ppm2      3.732 CV     1
 ASSI {  180}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 24   and name HB2 ))
      4.100     2.100     1.900 peak   180 spectrum    1 weight  0.10000E+01 volume  0.97946E-03 ppm1      7.847 ppm2      2.477 CV     1
 ASSI {  181}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 22   and name HG  ))
      3.600     1.600     1.600 peak   181 spectrum    1 weight  0.10000E+01 volume  0.14707E-02 ppm1      7.849 ppm2      2.051 CV     1
 ASSI {  182}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 22   and name HB2 ))
      2.700     0.900     0.900 peak   182 spectrum    1 weight  0.10000E+01 volume  0.22300E-02 ppm1      7.848 ppm2      1.937 CV     1
 ASSI {  183}
   (( segid "    " and resid 23   and name H   ))
   (  segid "    " and resid 23   and name HB% )
      2.300     0.600     0.600 peak   183 spectrum    1 weight  0.10000E+01 volume  0.11226E-01 ppm1      7.846 ppm2      1.438 CV     1
 ASSI {  184}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 25   and name HG2 ))
      3.800     1.800     1.800 peak   184 spectrum    1 weight  0.10000E+01 volume  0.99832E-03 ppm1      7.850 ppm2      1.170 CV     1
 OR {  184}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 25   and name HB3 ))
 OR {  184}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 25   and name HG3 ))
 ASSI {  186}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 24   and name HD22))
      4.900     3.000     1.100 peak   186 spectrum    1 weight  0.10000E+01 volume  0.87836E-03 ppm1      7.840 ppm2      7.493 CV     1
 ASSI {  187}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 24   and name H   ))
      2.500     0.800     0.800 peak   187 spectrum    1 weight  0.10000E+01 volume  0.42719E-02 ppm1      7.846 ppm2      7.283 CV     1
 ASSI {  188}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 21   and name H   ))
      3.500     1.500     1.500 peak   188 spectrum    1 weight  0.10000E+01 volume  0.73951E-03 ppm1      7.842 ppm2      8.942 CV     1
 ASSI {  189}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 22   and name H   ))
      2.400     0.700     0.700 peak   189 spectrum    1 weight  0.10000E+01 volume  0.33338E-02 ppm1      7.846 ppm2      8.559 CV     1
 ASSI {  190}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 23   and name HA  ))
      3.600     1.600     1.600 peak   190 spectrum    1 weight  0.10000E+01 volume  0.11263E-02 ppm1      7.280 ppm2      4.242 CV     1
 ASSI {  192}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 25   and name HA  ))
      4.100     2.100     1.900 peak   192 spectrum    1 weight  0.10000E+01 volume  0.69077E-03 ppm1      7.277 ppm2      3.860 CV     1
 ASSI {  193}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 24   and name HB2 ))
      2.500     0.800     0.800 peak   193 spectrum    1 weight  0.10000E+01 volume  0.32010E-02 ppm1      7.282 ppm2      2.517 CV     1
 ASSI {  195}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 25   and name HG2 ))
      3.900     1.900     1.900 peak   195 spectrum    1 weight  0.10000E+01 volume  0.10195E-02 ppm1      7.284 ppm2      1.235 CV     1
 ASSI {  196}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 25   and name HB3 ))
      3.500     1.500     1.500 peak   196 spectrum    1 weight  0.10000E+01 volume  0.18591E-02 ppm1      7.281 ppm2      1.125 CV     1
 OR {  196}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 25   and name HG3 ))
 ASSI {  197}
   (( segid "    " and resid 24   and name H   ))
   (  segid "    " and resid 32   and name HG2%)
      3.000     1.100     1.100 peak   197 spectrum    1 weight  0.10000E+01 volume  0.22872E-02 ppm1      7.280 ppm2      1.046 CV     1
 ASSI {  198}
   (( segid "    " and resid 24   and name H   ))
   (  segid "    " and resid 21   and name HD% )
      4.800     2.800     1.200 peak   198 spectrum    1 weight  0.10000E+01 volume  0.26940E-03 ppm1      7.286 ppm2      6.922 CV     1
 ASSI {  199}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 24   and name HA  ))
      3.100     1.200     1.200 peak   199 spectrum    1 weight  0.10000E+01 volume  0.14640E-02 ppm1      7.281 ppm2      4.932 CV     1
 ASSI {  200}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 30   and name HE21))
      6.000     6.000     0.000 peak   200 spectrum    1 weight  0.10000E+01 volume  0.69849E-04 ppm1      7.276 ppm2      7.037 CV     1
 ASSI {  202}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 25   and name H   ))
      2.300     0.700     0.700 peak   202 spectrum    1 weight  0.10000E+01 volume  0.49392E-02 ppm1      7.281 ppm2      8.054 CV     1
 ASSI {  204}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 24   and name HD22))
      4.300     2.300     1.700 peak   204 spectrum    1 weight  0.10000E+01 volume  0.13009E-02 ppm1      7.284 ppm2      7.486 CV     1
 ASSI {  207}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 25   and name HB2 ))
      3.500     1.500     1.500 peak   207 spectrum    1 weight  0.10000E+01 volume  0.20844E-02 ppm1      8.047 ppm2      1.438 CV     1
 ASSI {  208}
   (( segid "    " and resid 25   and name H   ))
   (  segid "    " and resid 32   and name HG2%)
      3.000     1.100     1.100 peak   208 spectrum    1 weight  0.10000E+01 volume  0.29776E-02 ppm1      8.044 ppm2      1.038 CV     1
 ASSI {  209}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 25   and name HA  ))
      3.000     1.100     1.100 peak   209 spectrum    1 weight  0.10000E+01 volume  0.15861E-02 ppm1      8.046 ppm2      3.854 CV     1
 ASSI {  210}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 22   and name HA  ))
      3.900     1.900     1.900 peak   210 spectrum    1 weight  0.10000E+01 volume  0.57300E-03 ppm1      8.041 ppm2      3.746 CV     1
 ASSI {  211}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 25   and name HD3 ))
      3.900     1.900     1.900 peak   211 spectrum    1 weight  0.10000E+01 volume  0.23080E-02 ppm1      8.045 ppm2      1.336 CV     1
 OR {  211}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 25   and name HD2 ))
 ASSI {  212}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 25   and name HB3 ))
      2.700     0.900     0.900 peak   212 spectrum    1 weight  0.10000E+01 volume  0.35855E-02 ppm1      8.044 ppm2      1.144 CV     1
 OR {  212}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 25   and name HG3 ))
 ASSI {  220}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 26   and name HB2 ))
      3.000     1.100     1.100 peak   220 spectrum    1 weight  0.10000E+01 volume  0.19952E-02 ppm1      8.544 ppm2      2.904 CV     1
 ASSI {  221}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 26   and name HB3 ))
      3.200     1.200     1.200 peak   221 spectrum    1 weight  0.10000E+01 volume  0.22856E-02 ppm1      8.543 ppm2      2.488 CV     1
 ASSI {  222}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 25   and name HG2 ))
      3.100     1.200     1.200 peak   222 spectrum    1 weight  0.10000E+01 volume  0.19375E-02 ppm1      8.544 ppm2      1.238 CV     1
 ASSI {  223}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 25   and name HG3 ))
      2.900     1.000     1.000 peak   223 spectrum    1 weight  0.10000E+01 volume  0.24705E-02 ppm1      8.541 ppm2      1.141 CV     1
 OR {  223}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 25   and name HB3 ))
 ASSI {  224}
   (( segid "    " and resid 26   and name H   ))
   (  segid "    " and resid 32   and name HG2%)
      3.400     1.500     1.500 peak   224 spectrum    1 weight  0.10000E+01 volume  0.24284E-02 ppm1      8.543 ppm2      1.064 CV     1
 ASSI {  225}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 25   and name H   ))
      3.000     1.100     1.100 peak   225 spectrum    1 weight  0.10000E+01 volume  0.11492E-02 ppm1      8.537 ppm2      8.043 CV     1
 ASSI {  227}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 26   and name HA  ))
      2.800     1.000     1.000 peak   227 spectrum    1 weight  0.10000E+01 volume  0.36168E-02 ppm1      8.542 ppm2      4.820 CV     1
 ASSI {  228}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 27   and name HA  ))
      2.800     1.000     1.000 peak   228 spectrum    1 weight  0.10000E+01 volume  0.26241E-02 ppm1      7.313 ppm2      3.889 CV     1
 ASSI {  229}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 26   and name HB2 ))
      4.300     2.300     1.700 peak   229 spectrum    1 weight  0.10000E+01 volume  0.60740E-03 ppm1      7.313 ppm2      2.899 CV     1
 ASSI {  230}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 27   and name HB  ))
      2.800     1.000     1.000 peak   230 spectrum    1 weight  0.10000E+01 volume  0.34881E-02 ppm1      7.312 ppm2      2.112 CV     1
 ASSI {  232}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 24   and name HB3 ))
      4.600     2.700     1.400 peak   232 spectrum    1 weight  0.10000E+01 volume  0.63641E-03 ppm1      7.317 ppm2      2.543 CV     1
 OR {  232}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 24   and name HB2 ))
 ASSI {  234}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 24   and name HA  ))
      3.700     1.700     1.700 peak   234 spectrum    1 weight  0.10000E+01 volume  0.82388E-03 ppm1      7.328 ppm2      4.918 CV     1
 ASSI {  235}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 26   and name HA  ))
      3.000     1.200     1.200 peak   235 spectrum    1 weight  0.10000E+01 volume  0.18919E-02 ppm1      7.313 ppm2      4.821 CV     1
 ASSI {  236}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 26   and name H   ))
      2.500     0.800     0.800 peak   236 spectrum    1 weight  0.10000E+01 volume  0.33880E-02 ppm1      7.312 ppm2      8.546 CV     1
 ASSI {  238}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 27   and name HA  ))
      2.300     0.600     0.600 peak   238 spectrum    1 weight  0.10000E+01 volume  0.78177E-02 ppm1      8.629 ppm2      3.893 CV     1
 ASSI {  239}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 28   and name HG2 ))
      3.800     1.800     1.800 peak   239 spectrum    1 weight  0.10000E+01 volume  0.17391E-02 ppm1      8.626 ppm2      2.309 CV     1
 ASSI {  243}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 27   and name H   ))
      4.400     2.400     1.600 peak   243 spectrum    1 weight  0.10000E+01 volume  0.83294E-03 ppm1      8.628 ppm2      7.305 CV     1
 ASSI {  244}
   (( segid "    " and resid 28   and name H   ))
   (( segid "    " and resid 29   and name H   ))
      4.400     2.400     1.600 peak   244 spectrum    1 weight  0.10000E+01 volume  0.60866E-03 ppm1      8.627 ppm2      8.838 CV     1
 ASSI {  245}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 28   and name HA  ))
      2.300     0.700     0.700 peak   245 spectrum    1 weight  0.10000E+01 volume  0.48629E-02 ppm1      8.851 ppm2      4.147 CV     1
 ASSI {  247}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 29   and name HA3 ))
      3.400     1.400     1.400 peak   247 spectrum    1 weight  0.10000E+01 volume  0.19560E-02 ppm1      8.852 ppm2      3.753 CV     1
 ASSI {  248}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 28   and name HG2 ))
      4.200     2.200     1.800 peak   248 spectrum    1 weight  0.10000E+01 volume  0.90209E-03 ppm1      8.852 ppm2      2.264 CV     1
 ASSI {  249}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 28   and name HB2 ))
      3.600     1.700     1.700 peak   249 spectrum    1 weight  0.10000E+01 volume  0.15598E-02 ppm1      8.851 ppm2      1.982 CV     1
 OR {  249}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 28   and name HB3 ))
 ASSI {  250}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 30   and name H   ))
      3.000     1.100     1.100 peak   250 spectrum    1 weight  0.10000E+01 volume  0.14869E-02 ppm1      8.851 ppm2      7.496 CV     1
 ASSI {  252}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 30   and name HA  ))
      3.000     1.200     1.200 peak   252 spectrum    1 weight  0.10000E+01 volume  0.15540E-02 ppm1      7.495 ppm2      4.579 CV     1
 ASSI {  254}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 29   and name HA3 ))
      4.000     2.000     2.000 peak   254 spectrum    1 weight  0.10000E+01 volume  0.11304E-02 ppm1      7.498 ppm2      3.757 CV     1
 ASSI {  255}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 30   and name HB2 ))
      2.800     1.000     1.000 peak   255 spectrum    1 weight  0.10000E+01 volume  0.38542E-02 ppm1      7.495 ppm2      2.053 CV     1
 ASSI {  256}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 30   and name HB3 ))
      2.800     1.000     1.000 peak   256 spectrum    1 weight  0.10000E+01 volume  0.27890E-02 ppm1      7.495 ppm2      1.859 CV     1
 ASSI {  258}
   (( segid "    " and resid 30   and name HE21))
   (( segid "    " and resid 24   and name HB2 ))
      3.300     1.400     1.400 peak   258 spectrum    1 weight  0.10000E+01 volume  0.16075E-02 ppm1      7.038 ppm2      2.507 CV     1
 ASSI {  259}
   (( segid "    " and resid 30   and name HE21))
   (( segid "    " and resid 30   and name HG2 ))
      2.200     0.600     0.600 peak   259 spectrum    1 weight  0.10000E+01 volume  0.40815E-02 ppm1      7.038 ppm2      2.142 CV     1
 ASSI {  261}
   (( segid "    " and resid 30   and name HE21))
   (  segid "    " and resid 35   and name HB% )
      2.700     0.900     0.900 peak   261 spectrum    1 weight  0.10000E+01 volume  0.16247E-02 ppm1      7.036 ppm2      1.413 CV     1
 ASSI {  262}
   (( segid "    " and resid 30   and name HE21))
   (  segid "    " and resid 27   and name HG1%)
      2.800     1.000     1.000 peak   262 spectrum    1 weight  0.10000E+01 volume  0.26507E-02 ppm1      7.038 ppm2      0.972 CV     1
 ASSI {  263}
   (( segid "    " and resid 30   and name HE21))
   (( segid "    " and resid 24   and name HA  ))
      4.700     2.700     1.300 peak   263 spectrum    1 weight  0.10000E+01 volume  0.61100E-03 ppm1      7.034 ppm2      4.929 CV     1
 ASSI {  265}
   (( segid "    " and resid 30   and name HE22))
   (( segid "    " and resid 32   and name HA  ))
      4.300     2.300     1.700 peak   265 spectrum    1 weight  0.10000E+01 volume  0.11504E-02 ppm1      7.760 ppm2      3.964 CV     1
 ASSI {  266}
   (( segid "    " and resid 30   and name HE22))
   (( segid "    " and resid 24   and name HB2 ))
      3.400     1.500     1.500 peak   266 spectrum    1 weight  0.10000E+01 volume  0.21811E-02 ppm1      7.761 ppm2      2.504 CV     1
 ASSI {  267}
   (( segid "    " and resid 30   and name HE22))
   (( segid "    " and resid 30   and name HG2 ))
      2.900     1.000     1.000 peak   267 spectrum    1 weight  0.10000E+01 volume  0.76716E-02 ppm1      7.759 ppm2      2.143 CV     1
 ASSI {  268}
   (( segid "    " and resid 30   and name HE22))
   (( segid "    " and resid 30   and name HB3 ))
      3.700     1.700     1.700 peak   268 spectrum    1 weight  0.10000E+01 volume  0.14246E-02 ppm1      7.760 ppm2      1.851 CV     1
 ASSI {  269}
   (( segid "    " and resid 30   and name HE22))
   (  segid "    " and resid 35   and name HB% )
      3.300     1.300     1.300 peak   269 spectrum    1 weight  0.10000E+01 volume  0.21970E-02 ppm1      7.758 ppm2      1.411 CV     1
 ASSI {  270}
   (( segid "    " and resid 30   and name HE22))
   (  segid "    " and resid 27   and name HG1%)
      2.900     1.100     1.100 peak   270 spectrum    1 weight  0.10000E+01 volume  0.33484E-02 ppm1      7.759 ppm2      0.970 CV     1
 ASSI {  271}
   (( segid "    " and resid 30   and name HE22))
   (  segid "    " and resid 27   and name HG2%)
      2.900     1.100     1.100 peak   271 spectrum    1 weight  0.10000E+01 volume  0.36081E-02 ppm1      7.759 ppm2      0.917 CV     1
 ASSI {  272}
   (( segid "    " and resid 30   and name HE22))
   (( segid "    " and resid 24   and name H   ))
      4.000     2.000     2.000 peak   272 spectrum    1 weight  0.10000E+01 volume  0.11837E-02 ppm1      7.761 ppm2      7.303 CV     1
 ASSI {  273}
   (( segid "    " and resid 30   and name HE22))
   (( segid "    " and resid 30   and name HE21))
      1.400     0.200     0.800 peak   273 spectrum    1 weight  0.10000E+01 volume  0.42748E-01 ppm1      7.759 ppm2      7.036 CV     1
 ASSI {  274}
   (( segid "    " and resid 30   and name HE22))
   (( segid "    " and resid 24   and name HA  ))
      4.300     2.300     1.700 peak   274 spectrum    1 weight  0.10000E+01 volume  0.77288E-03 ppm1      7.758 ppm2      4.921 CV     1
 ASSI {  275}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 30   and name HA  ))
      2.700     0.900     0.900 peak   275 spectrum    1 weight  0.10000E+01 volume  0.22252E-02 ppm1      8.872 ppm2      4.582 CV     1
 ASSI {  276}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 31   and name HB3 ))
      3.900     1.900     1.900 peak   276 spectrum    1 weight  0.10000E+01 volume  0.13493E-02 ppm1      8.870 ppm2      2.856 CV     1
 ASSI {  277}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 31   and name HB2 ))
      2.600     0.900     0.900 peak   277 spectrum    1 weight  0.10000E+01 volume  0.16060E-02 ppm1      8.872 ppm2      2.677 CV     1
 ASSI {  278}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 30   and name HG2 ))
      3.100     1.200     1.200 peak   278 spectrum    1 weight  0.10000E+01 volume  0.13807E-02 ppm1      8.872 ppm2      2.134 CV     1
 ASSI {  279}
   (( segid "    " and resid 31   and name H   ))
   (( segid "    " and resid 30   and name HB3 ))
      4.300     2.300     1.700 peak   279 spectrum    1 weight  0.10000E+01 volume  0.66999E-03 ppm1      8.872 ppm2      1.868 CV     1
 ASSI {  280}
   (( segid "    " and resid 32   and name H   ))
   (( segid "    " and resid 32   and name HA  ))
      3.200     1.300     1.300 peak   280 spectrum    1 weight  0.10000E+01 volume  0.11179E-02 ppm1      9.096 ppm2      3.971 CV     1
 ASSI {  281}
   (( segid "    " and resid 32   and name H   ))
   (( segid "    " and resid 32   and name HB  ))
      2.900     1.000     1.000 peak   281 spectrum    1 weight  0.10000E+01 volume  0.14194E-02 ppm1      9.099 ppm2      2.363 CV     1
 ASSI {  283}
   (( segid "    " and resid 32   and name H   ))
   (  segid "    " and resid 32   and name HG2%)
      4.500     2.500     1.500 peak   283 spectrum    1 weight  0.10000E+01 volume  0.84078E-03 ppm1      9.098 ppm2      1.045 CV     1
 ASSI {  287}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 33   and name HA  ))
      2.900     1.100     1.100 peak   287 spectrum    1 weight  0.10000E+01 volume  0.80884E-03 ppm1      7.981 ppm2      3.583 CV     1
 ASSI {  289}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 36   and name HG13))
      3.800     1.800     1.800 peak   289 spectrum    1 weight  0.10000E+01 volume  0.11841E-02 ppm1      7.977 ppm2      2.141 CV     1
 OR {  289}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 36   and name HB  ))
 ASSI {  290}
   (( segid "    " and resid 33   and name H   ))
   (  segid "    " and resid 35   and name HB% )
      3.600     1.600     1.600 peak   290 spectrum    1 weight  0.10000E+01 volume  0.13644E-02 ppm1      7.979 ppm2      1.388 CV     1
 ASSI {  293}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 32   and name H   ))
      3.300     1.400     1.400 peak   293 spectrum    1 weight  0.10000E+01 volume  0.82828E-03 ppm1      7.984 ppm2      9.097 CV     1
 ASSI {  294}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 34   and name HA  ))
      2.900     1.000     1.000 peak   294 spectrum    1 weight  0.10000E+01 volume  0.13965E-02 ppm1      8.011 ppm2      3.978 CV     1
 ASSI {  295}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 33   and name HA  ))
      3.500     1.500     1.500 peak   295 spectrum    1 weight  0.10000E+01 volume  0.44046E-03 ppm1      8.018 ppm2      3.588 CV     1
 ASSI {  296}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 34   and name HG2 ))
      3.400     1.500     1.500 peak   296 spectrum    1 weight  0.10000E+01 volume  0.21789E-02 ppm1      8.008 ppm2      2.395 CV     1
 ASSI {  297}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 34   and name HB2 ))
      2.400     0.700     0.700 peak   297 spectrum    1 weight  0.10000E+01 volume  0.36772E-02 ppm1      8.008 ppm2      2.228 CV     1
 OR {  297}
   (( segid "    " and resid 34   and name H   ))
   (( segid "    " and resid 34   and name HG3 ))
 ASSI {  298}
   (( segid "    " and resid 34   and name H   ))
   (  segid "    " and resid 35   and name HB% )
      4.400     2.400     1.600 peak   298 spectrum    1 weight  0.10000E+01 volume  0.73355E-03 ppm1      8.010 ppm2      1.393 CV     1
 ASSI {  299}
   (( segid "    " and resid 34   and name H   ))
   (  segid "    " and resid 33   and name HG1%)
      2.700     0.900     0.900 peak   299 spectrum    1 weight  0.10000E+01 volume  0.20752E-02 ppm1      8.010 ppm2      0.946 CV     1
 OR {  299}
   (( segid "    " and resid 34   and name H   ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI {  301}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 131  and name HA  ))
      2.300     0.600     0.600 peak   301 spectrum    1 weight  0.10000E+01 volume  0.73384E-02 ppm1      7.874 ppm2      4.757 CV     1
 ASSI {  302}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 132  and name HA  ))
      2.600     0.800     0.800 peak   302 spectrum    1 weight  0.10000E+01 volume  0.47334E-02 ppm1      7.873 ppm2      4.374 CV     1
 ASSI {  303}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 35   and name HA  ))
      2.600     0.800     0.800 peak   303 spectrum    1 weight  0.10000E+01 volume  0.41214E-02 ppm1      7.876 ppm2      4.191 CV     1
 ASSI {  305}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 33   and name HA  ))
      3.700     1.700     1.700 peak   305 spectrum    1 weight  0.10000E+01 volume  0.60993E-03 ppm1      7.874 ppm2      3.587 CV     1
 ASSI {  306}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 131  and name HB3 ))
      3.400     1.400     1.400 peak   306 spectrum    1 weight  0.10000E+01 volume  0.20436E-02 ppm1      7.871 ppm2      3.289 CV     1
 ASSI {  308}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 34   and name HG2 ))
      3.800     1.800     1.800 peak   308 spectrum    1 weight  0.10000E+01 volume  0.17556E-02 ppm1      7.876 ppm2      2.387 CV     1
 ASSI {  309}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 36   and name HG13))
      2.900     1.100     1.100 peak   309 spectrum    1 weight  0.10000E+01 volume  0.48719E-02 ppm1      7.876 ppm2      2.137 CV     1
 OR {  309}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 36   and name HB  ))
 ASSI {  310}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 132  and name HB2 ))
      2.200     0.600     0.600 peak   310 spectrum    1 weight  0.10000E+01 volume  0.99552E-02 ppm1      7.873 ppm2      1.846 CV     1
 OR {  310}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 132  and name HB3 ))
 ASSI {  311}
   (( segid "    " and resid 35   and name H   ))
   (  segid "    " and resid 35   and name HB% )
      2.200     0.600     0.600 peak   311 spectrum    1 weight  0.10000E+01 volume  0.94783E-02 ppm1      7.876 ppm2      1.421 CV     1
 ASSI {  313}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 38   and name H   ))
      4.500     2.500     1.500 peak   313 spectrum    1 weight  0.10000E+01 volume  0.36611E-03 ppm1      7.877 ppm2      7.598 CV     1
 ASSI {  316}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 37   and name H   ))
      4.000     2.000     2.000 peak   316 spectrum    1 weight  0.10000E+01 volume  0.77364E-03 ppm1      7.872 ppm2      8.591 CV     1
 ASSI {  317}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 133  and name H   ))
      3.400     1.500     1.500 peak   317 spectrum    1 weight  0.10000E+01 volume  0.17283E-02 ppm1      7.873 ppm2      8.490 CV     1
 ASSI {  318}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 36   and name H   ))
      2.300     0.600     0.600 peak   318 spectrum    1 weight  0.10000E+01 volume  0.47193E-02 ppm1      7.877 ppm2      8.099 CV     1
 ASSI {  319}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 34   and name H   ))
      2.100     0.600     0.600 peak   319 spectrum    1 weight  0.10000E+01 volume  0.76658E-02 ppm1      7.875 ppm2      7.990 CV     1
 ASSI {  320}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 35   and name HA  ))
      4.000     2.000     2.000 peak   320 spectrum    1 weight  0.10000E+01 volume  0.39089E-03 ppm1      8.106 ppm2      4.194 CV     1
 ASSI {  322}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 36   and name HA  ))
      2.800     1.000     1.000 peak   322 spectrum    1 weight  0.10000E+01 volume  0.14208E-02 ppm1      8.114 ppm2      3.657 CV     1
 ASSI {  323}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 33   and name HA  ))
      2.900     1.000     1.000 peak   323 spectrum    1 weight  0.10000E+01 volume  0.13785E-02 ppm1      8.103 ppm2      3.603 CV     1
 ASSI {  324}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 36   and name HB  ))
      2.200     0.600     0.600 peak   324 spectrum    1 weight  0.10000E+01 volume  0.38656E-02 ppm1      8.111 ppm2      2.107 CV     1
 OR {  324}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 36   and name HG13))
 ASSI {  325}
   (( segid "    " and resid 36   and name H   ))
   (  segid "    " and resid 35   and name HB% )
      3.200     1.300     1.300 peak   325 spectrum    1 weight  0.10000E+01 volume  0.15690E-02 ppm1      8.105 ppm2      1.406 CV     1
 ASSI {  326}
   (( segid "    " and resid 36   and name H   ))
   (  segid "    " and resid 32   and name HG1%)
      4.000     2.000     2.000 peak   326 spectrum    1 weight  0.10000E+01 volume  0.11797E-02 ppm1      8.112 ppm2      1.341 CV     1
 ASSI {  331}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 37   and name H   ))
      2.800     1.000     1.000 peak   331 spectrum    1 weight  0.10000E+01 volume  0.12927E-02 ppm1      8.104 ppm2      8.594 CV     1
 ASSI {  333}
   (( segid "    " and resid 37   and name H   ))
   (( segid "    " and resid 36   and name HB  ))
      2.200     0.600     0.600 peak   333 spectrum    1 weight  0.10000E+01 volume  0.20935E-02 ppm1      8.591 ppm2      2.107 CV     1
 ASSI {  334}
   (( segid "    " and resid 37   and name H   ))
   (( segid "    " and resid 37   and name HG  ))
      2.000     0.500     0.500 peak   334 spectrum    1 weight  0.10000E+01 volume  0.24601E-02 ppm1      8.592 ppm2      1.662 CV     1
 ASSI {  336}
   (( segid "    " and resid 37   and name H   ))
   (  segid "    " and resid 38   and name HB% )
      4.600     2.600     1.400 peak   336 spectrum    1 weight  0.10000E+01 volume  0.74343E-03 ppm1      8.586 ppm2      1.282 CV     1
 ASSI {  338}
   (( segid "    " and resid 37   and name H   ))
   (( segid "    " and resid 33   and name HA  ))
      3.600     1.600     1.600 peak   338 spectrum    1 weight  0.10000E+01 volume  0.77972E-03 ppm1      8.584 ppm2      3.604 CV     1
 ASSI {  343}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 35   and name HA  ))
      3.200     1.300     1.300 peak   343 spectrum    1 weight  0.10000E+01 volume  0.22425E-02 ppm1      7.591 ppm2      4.183 CV     1
 ASSI {  344}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 38   and name HA  ))
      2.500     0.800     0.800 peak   344 spectrum    1 weight  0.10000E+01 volume  0.56701E-02 ppm1      7.592 ppm2      4.081 CV     1
 ASSI {  345}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 34   and name HA  ))
      3.100     1.200     1.200 peak   345 spectrum    1 weight  0.10000E+01 volume  0.30628E-02 ppm1      7.593 ppm2      3.976 CV     1
 ASSI {  346}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 36   and name HA  ))
      3.600     1.600     1.600 peak   346 spectrum    1 weight  0.10000E+01 volume  0.44869E-03 ppm1      7.596 ppm2      3.656 CV     1
 ASSI {  347}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 36   and name HB  ))
      3.800     1.800     1.800 peak   347 spectrum    1 weight  0.10000E+01 volume  0.84297E-03 ppm1      7.592 ppm2      2.101 CV     1
 ASSI {  350}
   (( segid "    " and resid 38   and name H   ))
   (  segid "    " and resid 38   and name HB% )
      2.200     0.600     0.600 peak   350 spectrum    1 weight  0.10000E+01 volume  0.93982E-02 ppm1      7.592 ppm2      1.285 CV     1
 ASSI {  352}
   (( segid "    " and resid 38   and name H   ))
   (  segid "    " and resid 37   and name HD1%)
      2.400     0.700     0.700 peak   352 spectrum    1 weight  0.10000E+01 volume  0.22364E-02 ppm1      7.592 ppm2      0.850 CV     1
 ASSI {  353}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 37   and name H   ))
      2.300     0.700     0.700 peak   353 spectrum    1 weight  0.10000E+01 volume  0.28498E-02 ppm1      7.593 ppm2      8.596 CV     1
 ASSI {  354}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 36   and name H   ))
      3.500     1.500     1.500 peak   354 spectrum    1 weight  0.10000E+01 volume  0.57184E-03 ppm1      7.594 ppm2      8.101 CV     1
 ASSI {  355}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 40   and name H   ))
      3.500     1.500     1.500 peak   355 spectrum    1 weight  0.10000E+01 volume  0.19528E-02 ppm1      7.593 ppm2      7.880 CV     1
 ASSI {  356}
   (( segid "    " and resid 39   and name H   ))
   (( segid "    " and resid 39   and name HA  ))
      3.000     1.100     1.100 peak   356 spectrum    1 weight  0.10000E+01 volume  0.21030E-02 ppm1      7.539 ppm2      4.735 CV     1
 ASSI {  357}
   (( segid "    " and resid 39   and name H   ))
   (( segid "    " and resid 38   and name HA  ))
      3.400     1.400     1.400 peak   357 spectrum    1 weight  0.10000E+01 volume  0.10869E-02 ppm1      7.538 ppm2      4.080 CV     1
 ASSI {  358}
   (( segid "    " and resid 39   and name H   ))
   (( segid "    " and resid 37   and name HA  ))
      3.500     1.500     1.500 peak   358 spectrum    1 weight  0.10000E+01 volume  0.66344E-03 ppm1      7.542 ppm2      3.955 CV     1
 ASSI {  360}
   (( segid "    " and resid 39   and name H   ))
   (( segid "    " and resid 39   and name HB2 ))
      2.700     0.900     0.900 peak   360 spectrum    1 weight  0.10000E+01 volume  0.16143E-02 ppm1      7.540 ppm2      3.471 CV     1
 ASSI {  361}
   (( segid "    " and resid 39   and name H   ))
   (( segid "    " and resid 39   and name HB3 ))
      3.700     1.700     1.700 peak   361 spectrum    1 weight  0.10000E+01 volume  0.19764E-02 ppm1      7.539 ppm2      2.868 CV     1
 ASSI {  362}
   (( segid "    " and resid 39   and name H   ))
   (( segid "    " and resid 40   and name HB2 ))
      4.300     2.300     1.700 peak   362 spectrum    1 weight  0.10000E+01 volume  0.10076E-02 ppm1      7.541 ppm2      1.900 CV     1
 OR {  362}
   (( segid "    " and resid 39   and name H   ))
   (( segid "    " and resid 40   and name HG  ))
 ASSI {  364}
   (( segid "    " and resid 39   and name H   ))
   (  segid "    " and resid 38   and name HB% )
      3.300     1.300     1.300 peak   364 spectrum    1 weight  0.10000E+01 volume  0.20236E-02 ppm1      7.537 ppm2      1.285 CV     1
 ASSI {  366}
   (( segid "    " and resid 39   and name H   ))
   (  segid "    " and resid 37   and name HD1%)
      4.900     3.000     1.100 peak   366 spectrum    1 weight  0.10000E+01 volume  0.59645E-03 ppm1      7.528 ppm2      0.877 CV     1
 ASSI {  367}
   (( segid "    " and resid 39   and name H   ))
   (  segid "    " and resid 20   and name HD1%)
      4.100     2.100     1.900 peak   367 spectrum    1 weight  0.10000E+01 volume  0.10704E-02 ppm1      7.540 ppm2      0.628 CV     1
 OR {  367}
   (( segid "    " and resid 39   and name H   ))
   (  segid "    " and resid 20   and name HD2%)
 ASSI {  368}
   (( segid "    " and resid 39   and name H   ))
   (( segid "    " and resid 39   and name HD2 ))
      2.900     1.100     1.100 peak   368 spectrum    1 weight  0.10000E+01 volume  0.13413E-02 ppm1      7.539 ppm2      7.430 CV     1
 ASSI {  370}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 39   and name HA  ))
      3.200     1.200     1.200 peak   370 spectrum    1 weight  0.10000E+01 volume  0.22515E-02 ppm1      7.878 ppm2      4.741 CV     1
 ASSI {  371}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 40   and name HA  ))
      2.900     1.000     1.000 peak   371 spectrum    1 weight  0.10000E+01 volume  0.19589E-02 ppm1      7.879 ppm2      4.454 CV     1
 ASSI {  372}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 37   and name HA  ))
      3.200     1.300     1.300 peak   372 spectrum    1 weight  0.10000E+01 volume  0.88452E-03 ppm1      7.876 ppm2      3.938 CV     1
 ASSI {  373}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 39   and name HB2 ))
      3.400     1.500     1.500 peak   373 spectrum    1 weight  0.10000E+01 volume  0.10293E-02 ppm1      7.877 ppm2      3.452 CV     1
 ASSI {  374}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 39   and name HB3 ))
      3.800     1.800     1.800 peak   374 spectrum    1 weight  0.10000E+01 volume  0.15508E-02 ppm1      7.878 ppm2      2.860 CV     1
 ASSI {  375}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 40   and name HB2 ))
      2.500     0.800     0.800 peak   375 spectrum    1 weight  0.10000E+01 volume  0.47943E-02 ppm1      7.879 ppm2      1.916 CV     1
 OR {  375}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 40   and name HG  ))
 ASSI {  376}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 40   and name HB3 ))
      2.500     0.800     0.800 peak   376 spectrum    1 weight  0.10000E+01 volume  0.42794E-02 ppm1      7.879 ppm2      1.529 CV     1
 ASSI {  377}
   (( segid "    " and resid 40   and name H   ))
   (  segid "    " and resid 42   and name HG2%)
      3.700     1.700     1.700 peak   377 spectrum    1 weight  0.10000E+01 volume  0.62305E-03 ppm1      7.879 ppm2      1.285 CV     1
 ASSI {  378}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 20   and name HB2 ))
      4.000     2.000     2.000 peak   378 spectrum    1 weight  0.10000E+01 volume  0.59454E-03 ppm1      7.878 ppm2      1.183 CV     1
 ASSI {  379}
   (( segid "    " and resid 40   and name H   ))
   (  segid "    " and resid 40   and name HD2%)
      3.200     1.300     1.300 peak   379 spectrum    1 weight  0.10000E+01 volume  0.35854E-02 ppm1      7.878 ppm2      0.961 CV     1
 OR {  379}
   (( segid "    " and resid 40   and name H   ))
   (  segid "    " and resid 40   and name HD1%)
 ASSI {  380}
   (( segid "    " and resid 40   and name H   ))
   (  segid "    " and resid 20   and name HD2%)
      3.400     1.500     1.500 peak   380 spectrum    1 weight  0.10000E+01 volume  0.15991E-02 ppm1      7.880 ppm2      0.599 CV     1
 ASSI {  381}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 38   and name HA  ))
      4.200     2.200     1.800 peak   381 spectrum    1 weight  0.10000E+01 volume  0.46799E-03 ppm1      7.880 ppm2      4.085 CV     1
 ASSI {  382}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 39   and name H   ))
      2.100     0.500     0.500 peak   382 spectrum    1 weight  0.10000E+01 volume  0.80054E-02 ppm1      7.879 ppm2      7.540 CV     1
 ASSI {  383}
   (( segid "    " and resid 40   and name H   ))
   (( segid "    " and resid 41   and name H   ))
      4.400     2.400     1.600 peak   383 spectrum    1 weight  0.10000E+01 volume  0.64277E-03 ppm1      7.878 ppm2      8.411 CV     1
 ASSI {  384}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 42   and name HB  ))
      4.000     2.000     2.000 peak   384 spectrum    1 weight  0.10000E+01 volume  0.61426E-03 ppm1      8.418 ppm2      4.198 CV     1
 OR {  384}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 42   and name HA  ))
 ASSI {  385}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 40   and name HA  ))
      2.700     0.900     0.900 peak   385 spectrum    1 weight  0.10000E+01 volume  0.25260E-02 ppm1      8.420 ppm2      4.454 CV     1
 ASSI {  386}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 41   and name HB2 ))
      3.200     1.300     1.300 peak   386 spectrum    1 weight  0.10000E+01 volume  0.15203E-02 ppm1      8.422 ppm2      2.823 CV     1
 OR {  386}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 41   and name HB3 ))
 ASSI {  387}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 40   and name HG  ))
      3.800     1.800     1.800 peak   387 spectrum    1 weight  0.10000E+01 volume  0.13682E-02 ppm1      8.420 ppm2      1.914 CV     1
 OR {  387}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 40   and name HB2 ))
 ASSI {  388}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 40   and name HB3 ))
      4.500     2.600     1.500 peak   388 spectrum    1 weight  0.10000E+01 volume  0.58169E-03 ppm1      8.427 ppm2      1.520 CV     1
 ASSI {  389}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 42   and name H   ))
      3.000     1.100     1.100 peak   389 spectrum    1 weight  0.10000E+01 volume  0.13199E-02 ppm1      8.417 ppm2      8.183 CV     1
 ASSI {  390}
   (( segid "    " and resid 41   and name H   ))
   (( segid "    " and resid 43   and name H   ))
      5.000     3.200     1.000 peak   390 spectrum    1 weight  0.10000E+01 volume  0.48028E-03 ppm1      8.427 ppm2      7.987 CV     1
 ASSI {  392}
   (( segid "    " and resid 41   and name HD22))
   (( segid "    " and resid 41   and name HB2 ))
      3.400     1.400     1.400 peak   392 spectrum    1 weight  0.10000E+01 volume  0.40365E-02 ppm1      6.746 ppm2      2.822 CV     1
 OR {  392}
   (( segid "    " and resid 41   and name HD22))
   (( segid "    " and resid 41   and name HB3 ))
 ASSI {  394}
   (( segid "    " and resid 41   and name HD21))
   (( segid "    " and resid 41   and name HB2 ))
      2.600     0.800     0.800 peak   394 spectrum    1 weight  0.10000E+01 volume  0.46719E-02 ppm1      7.462 ppm2      2.824 CV     1
 OR {  394}
   (( segid "    " and resid 41   and name HD21))
   (( segid "    " and resid 41   and name HB3 ))
 ASSI {  395}
   (( segid "    " and resid 41   and name HD21))
   (( segid "    " and resid 41   and name HD22))
      1.500     0.300     0.700 peak   395 spectrum    1 weight  0.10000E+01 volume  0.46051E-01 ppm1      7.463 ppm2      6.746 CV     1
 ASSI {  396}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 42   and name HA  ))
      2.600     0.900     0.900 peak   396 spectrum    1 weight  0.10000E+01 volume  0.45158E-02 ppm1      8.179 ppm2      4.203 CV     1
 OR {  396}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 42   and name HB  ))
 ASSI {  397}
   (( segid "    " and resid 42   and name H   ))
   (  segid "    " and resid 42   and name HG2%)
      2.700     0.900     0.900 peak   397 spectrum    1 weight  0.10000E+01 volume  0.15377E-02 ppm1      8.178 ppm2      1.250 CV     1
 ASSI {  399}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 41   and name HB2 ))
      4.200     2.200     1.800 peak   399 spectrum    1 weight  0.10000E+01 volume  0.59104E-03 ppm1      8.175 ppm2      2.843 CV     1
 OR {  399}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 41   and name HB3 ))
 ASSI {  401}
   (( segid "    " and resid 42   and name H   ))
   (  segid "    " and resid 40   and name HD2%)
      3.800     1.800     1.800 peak   401 spectrum    1 weight  0.10000E+01 volume  0.89328E-03 ppm1      8.179 ppm2      0.976 CV     1
 OR {  401}
   (( segid "    " and resid 42   and name H   ))
   (  segid "    " and resid 40   and name HD1%)
 ASSI {  402}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 43   and name H   ))
      2.500     0.800     0.800 peak   402 spectrum    1 weight  0.10000E+01 volume  0.32004E-02 ppm1      8.179 ppm2      7.984 CV     1
 ASSI {  404}
   (( segid "    " and resid 43   and name H   ))
   (( segid "    " and resid 43   and name HA  ))
      2.600     0.900     0.900 peak   404 spectrum    1 weight  0.10000E+01 volume  0.24896E-02 ppm1      7.980 ppm2      4.387 CV     1
 ASSI {  405}
   (( segid "    " and resid 43   and name H   ))
   (( segid "    " and resid 42   and name HA  ))
      3.000     1.100     1.100 peak   405 spectrum    1 weight  0.10000E+01 volume  0.52658E-02 ppm1      7.981 ppm2      4.203 CV     1
 OR {  405}
   (( segid "    " and resid 43   and name H   ))
   (( segid "    " and resid 42   and name HB  ))
 ASSI {  406}
   (( segid "    " and resid 43   and name H   ))
   (( segid "    " and resid 44   and name HD3 ))
      4.200     2.200     1.800 peak   406 spectrum    1 weight  0.10000E+01 volume  0.69238E-03 ppm1      7.984 ppm2      3.737 CV     1
 ASSI {  408}
   (( segid "    " and resid 43   and name H   ))
   (  segid "    " and resid 43   and name HG2%)
      2.500     0.800     0.800 peak   408 spectrum    1 weight  0.10000E+01 volume  0.52150E-02 ppm1      7.981 ppm2      0.723 CV     1
 OR {  408}
   (( segid "    " and resid 43   and name H   ))
   (  segid "    " and resid 43   and name HG1%)
 ASSI {  409}
   (( segid "    " and resid 43   and name H   ))
   (( segid "    " and resid 44   and name HD2 ))
      4.900     3.000     1.100 peak   409 spectrum    1 weight  0.10000E+01 volume  0.37420E-03 ppm1      7.987 ppm2      3.552 CV     1
 ASSI {  411}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 44   and name HA  ))
      2.100     0.600     0.600 peak   411 spectrum    1 weight  0.10000E+01 volume  0.98298E-02 ppm1      8.108 ppm2      4.382 CV     1
 ASSI {  412}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 44   and name HB3 ))
      3.600     1.600     1.600 peak   412 spectrum    1 weight  0.10000E+01 volume  0.34959E-02 ppm1      8.104 ppm2      2.197 CV     1
 ASSI {  413}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 45   and name HG3 ))
      3.500     1.500     1.500 peak   413 spectrum    1 weight  0.10000E+01 volume  0.13995E-02 ppm1      8.108 ppm2      1.372 CV     1
 ASSI {  414}
   (( segid "    " and resid 45   and name H   ))
   (( segid "    " and resid 43   and name H   ))
      3.100     3.100     2.900 peak   414 spectrum    1 weight  0.10000E+01 volume  0.22675E-02 ppm1      8.106 ppm2      8.004 CV     1
 ASSI {  416}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 46   and name HA  ))
      3.100     1.200     1.200 peak   416 spectrum    1 weight  0.10000E+01 volume  0.13732E-02 ppm1      7.685 ppm2      4.616 CV     1
 ASSI {  417}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 45   and name HD3 ))
      5.300     3.500     0.700 peak   417 spectrum    1 weight  0.10000E+01 volume  0.43900E-03 ppm1      7.686 ppm2      2.852 CV     1
 ASSI {  418}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 49   and name HG2 ))
      2.900     1.100     1.100 peak   418 spectrum    1 weight  0.10000E+01 volume  0.19912E-02 ppm1      7.684 ppm2      2.540 CV     1
 ASSI {  419}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 49   and name HG3 ))
      3.300     1.300     1.300 peak   419 spectrum    1 weight  0.10000E+01 volume  0.16021E-02 ppm1      7.686 ppm2      2.251 CV     1
 ASSI {  420}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 45   and name HB2 ))
      2.600     0.900     0.900 peak   420 spectrum    1 weight  0.10000E+01 volume  0.32945E-02 ppm1      7.684 ppm2      1.656 CV     1
 OR {  420}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 45   and name HB3 ))
 ASSI {  421}
   (( segid "    " and resid 46   and name H   ))
   (  segid "    " and resid 46   and name HG2%)
      2.700     0.900     0.900 peak   421 spectrum    1 weight  0.10000E+01 volume  0.29060E-02 ppm1      7.685 ppm2      1.218 CV     1
 ASSI {  422}
   (( segid "    " and resid 46   and name H   ))
   (  segid "    " and resid 50   and name HD1%)
      4.100     2.100     1.900 peak   422 spectrum    1 weight  0.10000E+01 volume  0.92627E-03 ppm1      7.684 ppm2      0.902 CV     1
 ASSI {  423}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 50   and name H   ))
      4.400     2.400     1.600 peak   423 spectrum    1 weight  0.10000E+01 volume  0.54138E-03 ppm1      7.695 ppm2      8.212 CV     1
 ASSI {  424}
   (( segid "    " and resid 46   and name H   ))
   (( segid "    " and resid 45   and name H   ))
      4.100     2.100     1.900 peak   424 spectrum    1 weight  0.10000E+01 volume  0.70307E-03 ppm1      7.688 ppm2      8.111 CV     1
 ASSI {  425}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 46   and name HB  ))
      3.200     1.300     1.300 peak   425 spectrum    1 weight  0.10000E+01 volume  0.17991E-02 ppm1      9.010 ppm2      4.733 CV     1
 ASSI {  426}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 46   and name HA  ))
      2.800     1.000     1.000 peak   426 spectrum    1 weight  0.10000E+01 volume  0.22887E-02 ppm1      9.010 ppm2      4.612 CV     1
 ASSI {  427}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 47   and name HA  ))
      3.000     1.200     1.200 peak   427 spectrum    1 weight  0.10000E+01 volume  0.11291E-02 ppm1      9.013 ppm2      3.734 CV     1
 ASSI {  428}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 47   and name HB3 ))
      2.800     1.000     1.000 peak   428 spectrum    1 weight  0.10000E+01 volume  0.22403E-02 ppm1      9.010 ppm2      1.867 CV     1
 OR {  428}
   (( segid "    " and resid 47   and name H   ))
   (( segid "    " and resid 47   and name HB2 ))
 ASSI {  431}
   (( segid "    " and resid 47   and name H   ))
   (  segid "    " and resid 37   and name HD2%)
      4.200     2.200     1.800 peak   431 spectrum    1 weight  0.10000E+01 volume  0.12305E-02 ppm1      9.011 ppm2      0.857 CV     1
 OR {  431}
   (( segid "    " and resid 47   and name H   ))
   (  segid "    " and resid 37   and name HD1%)
 ASSI {  434}
   (( segid "    " and resid 48   and name H   ))
   (  segid "    " and resid 51   and name HD1%)
      3.700     1.700     1.700 peak   434 spectrum    1 weight  0.10000E+01 volume  0.86161E-03 ppm1      8.344 ppm2      0.747 CV     1
 ASSI {  435}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 46   and name HA  ))
      4.000     2.000     2.000 peak   435 spectrum    1 weight  0.10000E+01 volume  0.12255E-02 ppm1      8.337 ppm2      4.627 CV     1
 ASSI {  436}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 48   and name HA  ))
      2.600     0.900     0.900 peak   436 spectrum    1 weight  0.10000E+01 volume  0.31326E-02 ppm1      8.338 ppm2      3.889 CV     1
 ASSI {  437}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 47   and name HA  ))
      3.300     1.300     1.300 peak   437 spectrum    1 weight  0.10000E+01 volume  0.12016E-02 ppm1      8.338 ppm2      3.748 CV     1
 ASSI {  441}
   (( segid "    " and resid 48   and name H   ))
   (  segid "    " and resid 37   and name HD2%)
      4.200     2.200     1.800 peak   441 spectrum    1 weight  0.10000E+01 volume  0.89698E-03 ppm1      8.340 ppm2      0.827 CV     1
 ASSI {  444}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 47   and name H   ))
      2.900     1.000     1.000 peak   444 spectrum    1 weight  0.10000E+01 volume  0.15342E-02 ppm1      8.336 ppm2      9.017 CV     1
 ASSI {  445}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 49   and name HA  ))
      2.900     1.000     1.000 peak   445 spectrum    1 weight  0.10000E+01 volume  0.21935E-02 ppm1      7.714 ppm2      4.221 CV     1
 ASSI {  446}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 48   and name HA  ))
      3.500     1.500     1.500 peak   446 spectrum    1 weight  0.10000E+01 volume  0.80076E-03 ppm1      7.715 ppm2      3.892 CV     1
 ASSI {  447}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 49   and name HG2 ))
      2.700     2.700     3.300 peak   447 spectrum    1 weight  0.10000E+01 volume  0.46898E-02 ppm1      7.714 ppm2      2.561 CV     1
 ASSI {  448}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 49   and name HB2 ))
      2.700     0.900     0.900 peak   448 spectrum    1 weight  0.10000E+01 volume  0.25051E-02 ppm1      7.714 ppm2      2.219 CV     1
 OR {  448}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 49   and name HB3 ))
 ASSI {  451}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 48   and name HG2 ))
      3.400     1.400     1.400 peak   451 spectrum    1 weight  0.10000E+01 volume  0.73400E-03 ppm1      7.713 ppm2      1.330 CV     1
 ASSI {  453}
   (( segid "    " and resid 49   and name H   ))
   (  segid "    " and resid 50   and name HD1%)
      3.900     1.900     1.900 peak   453 spectrum    1 weight  0.10000E+01 volume  0.14110E-02 ppm1      7.725 ppm2      0.898 CV     1
 ASSI {  455}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 48   and name H   ))
      2.700     0.900     0.900 peak   455 spectrum    1 weight  0.10000E+01 volume  0.24190E-02 ppm1      7.713 ppm2      8.336 CV     1
 ASSI {  457}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 50   and name HA  ))
      2.800     1.000     1.000 peak   457 spectrum    1 weight  0.10000E+01 volume  0.17381E-02 ppm1      8.204 ppm2      3.774 CV     1
 ASSI {  458}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 49   and name HG2 ))
      3.800     1.800     1.800 peak   458 spectrum    1 weight  0.10000E+01 volume  0.11849E-02 ppm1      8.205 ppm2      2.536 CV     1
 ASSI {  461}
   (( segid "    " and resid 50   and name H   ))
   (  segid "    " and resid 17   and name HD1%)
      3.600     1.700     1.700 peak   461 spectrum    1 weight  0.10000E+01 volume  0.37621E-02 ppm1      8.192 ppm2      1.052 CV     1
 ASSI {  462}
   (( segid "    " and resid 50   and name H   ))
   (  segid "    " and resid 50   and name HD1%)
      2.300     0.700     0.700 peak   462 spectrum    1 weight  0.10000E+01 volume  0.53325E-02 ppm1      8.202 ppm2      0.924 CV     1
 ASSI {  463}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 49   and name H   ))
      2.800     1.000     1.000 peak   463 spectrum    1 weight  0.10000E+01 volume  0.22524E-02 ppm1      8.201 ppm2      7.704 CV     1
 ASSI {  464}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 48   and name HA  ))
      3.600     1.600     1.600 peak   464 spectrum    1 weight  0.10000E+01 volume  0.10933E-02 ppm1      8.213 ppm2      3.893 CV     1
 ASSI {  466}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 51   and name HA  ))
      2.900     1.100     1.100 peak   466 spectrum    1 weight  0.10000E+01 volume  0.15268E-02 ppm1      8.219 ppm2      2.972 CV     1
 ASSI {  467}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 49   and name HG3 ))
      4.300     2.300     1.700 peak   467 spectrum    1 weight  0.10000E+01 volume  0.54148E-03 ppm1      8.213 ppm2      2.269 CV     1
 ASSI {  469}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 51   and name HB  ))
      2.300     0.700     0.700 peak   469 spectrum    1 weight  0.10000E+01 volume  0.33260E-02 ppm1      8.221 ppm2      1.605 CV     1
 ASSI {  470}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 51   and name HG12))
      3.300     1.400     1.400 peak   470 spectrum    1 weight  0.10000E+01 volume  0.29330E-02 ppm1      8.221 ppm2      1.531 CV     1
 ASSI {  472}
   (( segid "    " and resid 51   and name H   ))
   (  segid "    " and resid 50   and name HG2%)
      2.600     0.800     0.800 peak   472 spectrum    1 weight  0.10000E+01 volume  0.31076E-02 ppm1      8.222 ppm2      0.879 CV     1
 ASSI {  474}
   (( segid "    " and resid 51   and name H   ))
   (  segid "    " and resid 51   and name HG2%)
      3.500     1.500     1.500 peak   474 spectrum    1 weight  0.10000E+01 volume  0.27726E-02 ppm1      8.218 ppm2      0.685 CV     1
 ASSI {  476}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 51   and name HG13))
      3.900     1.900     1.900 peak   476 spectrum    1 weight  0.10000E+01 volume  0.83507E-03 ppm1      8.215 ppm2      0.056 CV     1
 ASSI {  477}
   (( segid "    " and resid 52   and name H   ))
   (( segid "    " and resid 49   and name HA  ))
      3.300     1.400     1.400 peak   477 spectrum    1 weight  0.10000E+01 volume  0.13665E-02 ppm1      8.222 ppm2      4.210 CV     1
 ASSI {  478}
   (( segid "    " and resid 52   and name H   ))
   (( segid "    " and resid 52   and name HA  ))
      2.700     0.900     0.900 peak   478 spectrum    1 weight  0.10000E+01 volume  0.36285E-02 ppm1      8.228 ppm2      4.020 CV     1
 ASSI {  480}
   (( segid "    " and resid 52   and name H   ))
   (( segid "    " and resid 52   and name HB2 ))
      2.000     0.500     0.500 peak   480 spectrum    1 weight  0.10000E+01 volume  0.57792E-02 ppm1      8.227 ppm2      3.234 CV     1
 ASSI {  481}
   (( segid "    " and resid 52   and name H   ))
   (( segid "    " and resid 52   and name HB3 ))
      3.000     1.100     1.100 peak   481 spectrum    1 weight  0.10000E+01 volume  0.62217E-02 ppm1      8.228 ppm2      3.168 CV     1
 ASSI {  483}
   (( segid "    " and resid 52   and name H   ))
   (( segid "    " and resid 51   and name HB  ))
      2.700     0.900     0.900 peak   483 spectrum    1 weight  0.10000E+01 volume  0.28383E-02 ppm1      8.226 ppm2      1.622 CV     1
 ASSI {  487}
   (( segid "    " and resid 52   and name H   ))
   (  segid "    " and resid 51   and name HG2%)
      2.900     1.000     1.000 peak   487 spectrum    1 weight  0.10000E+01 volume  0.27738E-02 ppm1      8.228 ppm2      0.680 CV     1
 ASSI {  488}
   (( segid "    " and resid 52   and name H   ))
   (( segid "    " and resid 51   and name HA  ))
      3.000     1.100     1.100 peak   488 spectrum    1 weight  0.10000E+01 volume  0.16900E-02 ppm1      8.230 ppm2      2.987 CV     1
 ASSI {  489}
   (( segid "    " and resid 52   and name H   ))
   (( segid "    " and resid 52   and name HD2 ))
      3.600     1.600     1.600 peak   489 spectrum    1 weight  0.10000E+01 volume  0.58313E-03 ppm1      8.226 ppm2      7.076 CV     1
 ASSI {  492}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 52   and name HB2 ))
      2.600     0.900     0.900 peak   492 spectrum    1 weight  0.10000E+01 volume  0.21550E-02 ppm1      8.138 ppm2      3.227 CV     1
 ASSI {  493}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 52   and name HB3 ))
      2.700     0.900     0.900 peak   493 spectrum    1 weight  0.10000E+01 volume  0.26879E-02 ppm1      8.139 ppm2      3.165 CV     1
 ASSI {  494}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 53   and name HB3 ))
      3.200     1.300     1.300 peak   494 spectrum    1 weight  0.10000E+01 volume  0.32442E-02 ppm1      8.139 ppm2      2.897 CV     1
 ASSI {  495}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 53   and name HB2 ))
      2.400     0.700     0.700 peak   495 spectrum    1 weight  0.10000E+01 volume  0.31117E-02 ppm1      8.138 ppm2      2.208 CV     1
 ASSI {  497}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 56   and name HB3 ))
      4.700     2.700     1.300 peak   497 spectrum    1 weight  0.10000E+01 volume  0.11441E-02 ppm1      8.145 ppm2      1.808 CV     1
 ASSI {  499}
   (( segid "    " and resid 53   and name H   ))
   (  segid "    " and resid 55   and name HG2%)
      3.700     1.700     1.700 peak   499 spectrum    1 weight  0.10000E+01 volume  0.16177E-02 ppm1      8.141 ppm2      0.814 CV     1
 OR {  499}
   (( segid "    " and resid 53   and name H   ))
   (  segid "    " and resid 55   and name HG1%)
 ASSI {  502}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 55   and name H   ))
      4.200     2.200     1.800 peak   502 spectrum    1 weight  0.10000E+01 volume  0.47339E-03 ppm1      8.138 ppm2      7.493 CV     1
 ASSI {  505}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 54   and name HA  ))
      2.800     1.000     1.000 peak   505 spectrum    1 weight  0.10000E+01 volume  0.17132E-02 ppm1      8.302 ppm2      3.685 CV     1
 ASSI {  506}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 51   and name HA  ))
      3.200     1.300     1.300 peak   506 spectrum    1 weight  0.10000E+01 volume  0.13851E-02 ppm1      8.308 ppm2      2.973 CV     1
 ASSI {  508}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 54   and name HB3 ))
      3.400     1.400     1.400 peak   508 spectrum    1 weight  0.10000E+01 volume  0.30268E-02 ppm1      8.305 ppm2      1.938 CV     1
 ASSI {  509}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 54   and name HG  ))
      2.600     0.800     0.800 peak   509 spectrum    1 weight  0.10000E+01 volume  0.31275E-02 ppm1      8.306 ppm2      1.717 CV     1
 ASSI {  512}
   (( segid "    " and resid 54   and name H   ))
   (  segid "    " and resid 54   and name HD2%)
      3.200     1.300     1.300 peak   512 spectrum    1 weight  0.10000E+01 volume  0.42800E-02 ppm1      8.305 ppm2      0.419 CV     1
 OR {  512}
   (( segid "    " and resid 54   and name H   ))
   (  segid "    " and resid 54   and name HD1%)
 ASSI {  513}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 53   and name H   ))
      2.400     0.700     0.700 peak   513 spectrum    1 weight  0.10000E+01 volume  0.33624E-02 ppm1      8.305 ppm2      8.141 CV     1
 ASSI {  514}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 55   and name H   ))
      2.700     0.900     0.900 peak   514 spectrum    1 weight  0.10000E+01 volume  0.18919E-02 ppm1      8.305 ppm2      7.496 CV     1
 ASSI {  515}
   (( segid "    " and resid 55   and name H   ))
   (  segid "    " and resid 54   and name HD2%)
      4.700     2.800     1.300 peak   515 spectrum    1 weight  0.10000E+01 volume  0.63624E-03 ppm1      7.504 ppm2      0.380 CV     1
 ASSI {  517}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 56   and name HA  ))
      4.300     2.300     1.700 peak   517 spectrum    1 weight  0.10000E+01 volume  0.87283E-03 ppm1      7.505 ppm2      3.864 CV     1
 ASSI {  519}
   (( segid "    " and resid 55   and name H   ))
   (  segid "    " and resid 55   and name HG1%)
      2.200     0.600     0.600 peak   519 spectrum    1 weight  0.10000E+01 volume  0.56225E-02 ppm1      7.499 ppm2      0.785 CV     1
 OR {  519}
   (( segid "    " and resid 55   and name H   ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI {  521}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 56   and name H   ))
      2.600     0.800     0.800 peak   521 spectrum    1 weight  0.10000E+01 volume  0.17626E-02 ppm1      7.496 ppm2      8.084 CV     1
 ASSI {  523}
   (( segid "    " and resid 56   and name H   ))
   (( segid "    " and resid 56   and name HA  ))
      2.800     1.000     1.000 peak   523 spectrum    1 weight  0.10000E+01 volume  0.27417E-02 ppm1      8.082 ppm2      3.825 CV     1
 ASSI {  525}
   (( segid "    " and resid 56   and name H   ))
   (( segid "    " and resid 56   and name HB3 ))
      3.200     1.300     1.300 peak   525 spectrum    1 weight  0.10000E+01 volume  0.53333E-02 ppm1      8.091 ppm2      1.849 CV     1
 ASSI {  526}
   (( segid "    " and resid 56   and name H   ))
   (  segid "    " and resid 55   and name HG2%)
      2.800     1.000     1.000 peak   526 spectrum    1 weight  0.10000E+01 volume  0.36073E-02 ppm1      8.087 ppm2      0.818 CV     1
 OR {  526}
   (( segid "    " and resid 56   and name H   ))
   (  segid "    " and resid 55   and name HG1%)
 ASSI {  529}
   (( segid "    " and resid 56   and name HE22))
   (( segid "    " and resid 56   and name HG2 ))
      3.800     1.800     1.800 peak   529 spectrum    1 weight  0.10000E+01 volume  0.15996E-02 ppm1      6.848 ppm2      2.209 CV     1
 ASSI {  530}
   (( segid "    " and resid 56   and name HE22))
   (( segid "    " and resid 56   and name HG3 ))
      3.600     1.600     1.600 peak   530 spectrum    1 weight  0.10000E+01 volume  0.19486E-02 ppm1      6.852 ppm2      2.129 CV     1
 ASSI {  531}
   (( segid "    " and resid 56   and name HE22))
   (( segid "    " and resid 53   and name HE1 ))
      3.500     1.500     1.500 peak   531 spectrum    1 weight  0.10000E+01 volume  0.87643E-03 ppm1      6.850 ppm2      7.953 CV     1
 ASSI {  532}
   (( segid "    " and resid 56   and name HE22))
   (( segid "    " and resid 52   and name HE1 ))
      2.500     2.500     3.500 peak   532 spectrum    1 weight  0.10000E+01 volume  0.67831E-03 ppm1      6.851 ppm2      7.843 CV     1
 ASSI {  533}
   (( segid "    " and resid 56   and name HE22))
   (( segid "    " and resid 56   and name HE21))
      1.300     0.200     0.900 peak   533 spectrum    1 weight  0.10000E+01 volume  0.45794E-01 ppm1      6.851 ppm2      7.407 CV     1
 ASSI {  534}
   (( segid "    " and resid 56   and name HE21))
   (( segid "    " and resid 56   and name HG2 ))
      3.000     1.100     1.100 peak   534 spectrum    1 weight  0.10000E+01 volume  0.23873E-02 ppm1      7.404 ppm2      2.204 CV     1
 ASSI {  535}
   (( segid "    " and resid 56   and name HE21))
   (( segid "    " and resid 56   and name HG3 ))
      2.200     0.600     0.600 peak   535 spectrum    1 weight  0.10000E+01 volume  0.34099E-02 ppm1      7.406 ppm2      2.128 CV     1
 ASSI {  537}
   (( segid "    " and resid 56   and name HE21))
   (( segid "    " and resid 53   and name HE1 ))
      4.400     2.400     1.600 peak   537 spectrum    1 weight  0.10000E+01 volume  0.80988E-03 ppm1      7.399 ppm2      7.965 CV     1
 ASSI {  538}
   (( segid "    " and resid 56   and name HE21))
   (( segid "    " and resid 52   and name HE1 ))
      4.400     2.400     1.600 peak   538 spectrum    1 weight  0.10000E+01 volume  0.78198E-03 ppm1      7.406 ppm2      7.836 CV     1
 ASSI {  540}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 56   and name HA  ))
      3.100     1.200     1.200 peak   540 spectrum    1 weight  0.10000E+01 volume  0.20676E-02 ppm1      7.869 ppm2      3.832 CV     1
 ASSI {  542}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 57   and name HB2 ))
      2.600     0.800     0.800 peak   542 spectrum    1 weight  0.10000E+01 volume  0.52790E-02 ppm1      7.870 ppm2      2.152 CV     1
 OR {  542}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 57   and name HG3 ))
 ASSI {  543}
   (( segid "    " and resid 57   and name H   ))
   (  segid "    " and resid 57   and name HE% )
      3.200     1.300     1.300 peak   543 spectrum    1 weight  0.10000E+01 volume  0.41582E-02 ppm1      7.869 ppm2      1.989 CV     1
 OR {  543}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 57   and name HG2 ))
 ASSI {  545}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 59   and name HG  ))
      4.200     2.200     1.800 peak   545 spectrum    1 weight  0.10000E+01 volume  0.96538E-03 ppm1      7.866 ppm2      1.474 CV     1
 ASSI {  547}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 59   and name H   ))
      3.500     1.500     1.500 peak   547 spectrum    1 weight  0.10000E+01 volume  0.73873E-03 ppm1      7.869 ppm2      7.670 CV     1
 ASSI {  548}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 55   and name H   ))
      4.200     2.300     1.800 peak   548 spectrum    1 weight  0.10000E+01 volume  0.46417E-03 ppm1      7.876 ppm2      7.494 CV     1
 ASSI {  549}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 56   and name H   ))
      2.500     0.800     0.800 peak   549 spectrum    1 weight  0.10000E+01 volume  0.27415E-02 ppm1      7.870 ppm2      8.079 CV     1
 ASSI {  550}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 58   and name HA3 ))
      2.800     1.000     1.000 peak   550 spectrum    1 weight  0.10000E+01 volume  0.55122E-02 ppm1      7.925 ppm2      4.077 CV     1
 ASSI {  552}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 54   and name HA  ))
      3.900     1.900     1.900 peak   552 spectrum    1 weight  0.10000E+01 volume  0.99701E-03 ppm1      7.925 ppm2      3.715 CV     1
 ASSI {  553}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 57   and name HB2 ))
      3.900     1.900     1.900 peak   553 spectrum    1 weight  0.10000E+01 volume  0.12567E-02 ppm1      7.925 ppm2      2.135 CV     1
 OR {  553}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 57   and name HG3 ))
 ASSI {  555}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 59   and name HB3 ))
      4.900     3.100     1.100 peak   555 spectrum    1 weight  0.10000E+01 volume  0.92872E-03 ppm1      7.927 ppm2      1.340 CV     1
 ASSI {  557}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 59   and name H   ))
      2.600     0.900     0.900 peak   557 spectrum    1 weight  0.10000E+01 volume  0.27982E-02 ppm1      7.924 ppm2      7.670 CV     1
 ASSI {  558}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 60   and name H   ))
      3.600     1.600     1.600 peak   558 spectrum    1 weight  0.10000E+01 volume  0.99275E-03 ppm1      7.926 ppm2      7.071 CV     1
 ASSI {  559}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 56   and name HA  ))
      2.300     2.300     3.700 peak   559 spectrum    1 weight  0.10000E+01 volume  0.10937E-02 ppm1      7.674 ppm2      3.834 CV     1
 ASSI {  560}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 59   and name HA  ))
      2.700     0.900     0.900 peak   560 spectrum    1 weight  0.10000E+01 volume  0.28551E-02 ppm1      7.669 ppm2      4.201 CV     1
 ASSI {  561}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 58   and name HA3 ))
      2.900     1.000     1.000 peak   561 spectrum    1 weight  0.10000E+01 volume  0.28608E-02 ppm1      7.670 ppm2      4.083 CV     1
 ASSI {  563}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 57   and name HG3 ))
      4.000     2.000     2.000 peak   563 spectrum    1 weight  0.10000E+01 volume  0.10822E-02 ppm1      7.670 ppm2      2.146 CV     1
 OR {  563}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 57   and name HB2 ))
 ASSI {  564}
   (( segid "    " and resid 59   and name H   ))
   (  segid "    " and resid 57   and name HE% )
      3.800     1.800     1.800 peak   564 spectrum    1 weight  0.10000E+01 volume  0.88065E-03 ppm1      7.668 ppm2      1.989 CV     1
 OR {  564}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 57   and name HG2 ))
 ASSI {  565}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 57   and name HB3 ))
      2.900     2.900     3.100 peak   565 spectrum    1 weight  0.10000E+01 volume  0.13602E-02 ppm1      7.670 ppm2      1.696 CV     1
 ASSI {  566}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 59   and name HG  ))
      2.700     0.900     0.900 peak   566 spectrum    1 weight  0.10000E+01 volume  0.33243E-02 ppm1      7.669 ppm2      1.462 CV     1
 ASSI {  567}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 59   and name HB3 ))
      3.200     1.300     1.300 peak   567 spectrum    1 weight  0.10000E+01 volume  0.42890E-02 ppm1      7.668 ppm2      1.369 CV     1
 ASSI {  568}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 59   and name HB2 ))
      2.200     0.600     0.600 peak   568 spectrum    1 weight  0.10000E+01 volume  0.36409E-02 ppm1      7.669 ppm2      1.267 CV     1
 ASSI {  569}
   (( segid "    " and resid 59   and name H   ))
   (  segid "    " and resid 59   and name HD1%)
      3.600     1.600     1.600 peak   569 spectrum    1 weight  0.10000E+01 volume  0.34435E-02 ppm1      7.669 ppm2      0.837 CV     1
 ASSI {  570}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 60   and name H   ))
      2.300     0.700     0.700 peak   570 spectrum    1 weight  0.10000E+01 volume  0.53985E-02 ppm1      7.668 ppm2      7.069 CV     1
 ASSI {  572}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 59   and name HA  ))
      3.200     1.200     1.200 peak   572 spectrum    1 weight  0.10000E+01 volume  0.13132E-02 ppm1      7.071 ppm2      4.197 CV     1
 ASSI {  573}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 60   and name HA  ))
      2.900     1.000     1.000 peak   573 spectrum    1 weight  0.10000E+01 volume  0.24084E-02 ppm1      7.067 ppm2      4.539 CV     1
 ASSI {  574}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 58   and name HA3 ))
      4.100     2.100     1.900 peak   574 spectrum    1 weight  0.10000E+01 volume  0.10368E-02 ppm1      7.067 ppm2      4.069 CV     1
 ASSI {  575}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 55   and name HA  ))
      2.500     0.800     0.800 peak   575 spectrum    1 weight  0.10000E+01 volume  0.34180E-02 ppm1      7.068 ppm2      3.970 CV     1
 ASSI {  577}
   (( segid "    " and resid 60   and name H   ))
   (  segid "    " and resid 55   and name HG1%)
      3.500     1.600     1.600 peak   577 spectrum    1 weight  0.10000E+01 volume  0.26483E-02 ppm1      7.068 ppm2      0.807 CV     1
 OR {  577}
   (( segid "    " and resid 60   and name H   ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI {  578}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 61   and name H   ))
      4.100     2.100     1.900 peak   578 spectrum    1 weight  0.10000E+01 volume  0.91244E-03 ppm1      7.067 ppm2      8.645 CV     1
 ASSI {  581}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 55   and name H   ))
      4.300     2.300     1.700 peak   581 spectrum    1 weight  0.10000E+01 volume  0.42420E-03 ppm1      7.073 ppm2      7.498 CV     1
 ASSI {  583}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 61   and name HB3 ))
      2.500     0.800     0.800 peak   583 spectrum    1 weight  0.10000E+01 volume  0.53603E-02 ppm1      8.647 ppm2      2.710 CV     1
 OR {  583}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 61   and name HB2 ))
 ASSI {  584}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 65   and name HB3 ))
      3.700     1.700     1.700 peak   584 spectrum    1 weight  0.10000E+01 volume  0.11560E-02 ppm1      8.653 ppm2      2.391 CV     1
 ASSI {  589}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 62   and name HB2 ))
      2.700     2.700     3.300 peak   589 spectrum    1 weight  0.10000E+01 volume  0.23462E-02 ppm1      7.869 ppm2      4.001 CV     1
 ASSI {  590}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 62   and name HB3 ))
      3.200     1.300     1.300 peak   590 spectrum    1 weight  0.10000E+01 volume  0.24800E-02 ppm1      7.867 ppm2      3.771 CV     1
 ASSI {  591}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 61   and name HB2 ))
      2.600     0.900     0.900 peak   591 spectrum    1 weight  0.10000E+01 volume  0.45107E-02 ppm1      7.868 ppm2      2.704 CV     1
 OR {  591}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 61   and name HB3 ))
 ASSI {  592}
   (( segid "    " and resid 62   and name H   ))
   (  segid "    " and resid 55   and name HG1%)
      2.900     1.100     1.100 peak   592 spectrum    1 weight  0.10000E+01 volume  0.26791E-02 ppm1      7.867 ppm2      0.796 CV     1
 OR {  592}
   (( segid "    " and resid 62   and name H   ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI {  593}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 65   and name HB3 ))
      3.700     1.700     1.700 peak   593 spectrum    1 weight  0.10000E+01 volume  0.11969E-02 ppm1      7.865 ppm2      2.408 CV     1
 ASSI {  595}
   (( segid "    " and resid 62   and name H   ))
   (  segid "    " and resid 66   and name HE% )
      4.100     2.100     1.900 peak   595 spectrum    1 weight  0.10000E+01 volume  0.38783E-03 ppm1      7.865 ppm2      7.075 CV     1
 ASSI {  596}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 65   and name H   ))
      3.300     1.400     1.400 peak   596 spectrum    1 weight  0.10000E+01 volume  0.80105E-03 ppm1      7.867 ppm2      7.693 CV     1
 ASSI {  597}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 61   and name H   ))
      2.300     0.700     0.700 peak   597 spectrum    1 weight  0.10000E+01 volume  0.65823E-02 ppm1      7.867 ppm2      8.649 CV     1
 ASSI {  598}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 64   and name H   ))
      4.200     2.200     1.800 peak   598 spectrum    1 weight  0.10000E+01 volume  0.39089E-03 ppm1      7.866 ppm2      8.284 CV     1
 ASSI {  600}
   (( segid "    " and resid 63   and name H   ))
   (( segid "    " and resid 63   and name HB  ))
      2.600     0.800     0.800 peak   600 spectrum    1 weight  0.10000E+01 volume  0.33810E-02 ppm1      8.669 ppm2      2.222 CV     1
 ASSI {  601}
   (( segid "    " and resid 63   and name H   ))
   (  segid "    " and resid 63   and name HG1%)
      2.200     0.600     0.600 peak   601 spectrum    1 weight  0.10000E+01 volume  0.69764E-02 ppm1      8.668 ppm2      0.950 CV     1
 ASSI {  603}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 64   and name HA  ))
      2.400     0.700     0.700 peak   603 spectrum    1 weight  0.10000E+01 volume  0.49443E-02 ppm1      8.291 ppm2      4.108 CV     1
 ASSI {  606}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 64   and name HB2 ))
      2.200     0.600     0.600 peak   606 spectrum    1 weight  0.10000E+01 volume  0.59058E-02 ppm1      8.291 ppm2      1.808 CV     1
 ASSI {  607}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 64   and name HB3 ))
      2.900     1.100     1.100 peak   607 spectrum    1 weight  0.10000E+01 volume  0.72149E-02 ppm1      8.291 ppm2      1.751 CV     1
 ASSI {  608}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 64   and name HG3 ))
      2.500     0.800     0.800 peak   608 spectrum    1 weight  0.10000E+01 volume  0.52381E-02 ppm1      8.292 ppm2      1.443 CV     1
 OR {  608}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 64   and name HG2 ))
 ASSI {  610}
   (( segid "    " and resid 64   and name H   ))
   (  segid "    " and resid 51   and name HG2%)
      4.400     2.400     1.600 peak   610 spectrum    1 weight  0.10000E+01 volume  0.69214E-03 ppm1      8.288 ppm2      0.682 CV     1
 ASSI {  611}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 62   and name HA  ))
      3.800     1.800     1.800 peak   611 spectrum    1 weight  0.10000E+01 volume  0.99583E-03 ppm1      8.288 ppm2      4.584 CV     1
 ASSI {  612}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 62   and name HB3 ))
      3.000     1.100     1.100 peak   612 spectrum    1 weight  0.10000E+01 volume  0.13132E-02 ppm1      8.291 ppm2      3.771 CV     1
 ASSI {  614}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 65   and name HB3 ))
      4.000     2.000     2.000 peak   614 spectrum    1 weight  0.10000E+01 volume  0.13675E-02 ppm1      8.292 ppm2      2.399 CV     1
 ASSI {  619}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 63   and name H   ))
      2.500     0.800     0.800 peak   619 spectrum    1 weight  0.10000E+01 volume  0.34304E-02 ppm1      8.291 ppm2      8.669 CV     1
 ASSI {  621}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 65   and name HA  ))
      2.500     0.800     0.800 peak   621 spectrum    1 weight  0.10000E+01 volume  0.55182E-02 ppm1      7.701 ppm2      4.419 CV     1
 ASSI {  622}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 64   and name HA  ))
      2.800     1.000     1.000 peak   622 spectrum    1 weight  0.10000E+01 volume  0.35513E-02 ppm1      7.701 ppm2      4.108 CV     1
 ASSI {  623}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 62   and name HB3 ))
      3.900     1.900     1.900 peak   623 spectrum    1 weight  0.10000E+01 volume  0.10211E-02 ppm1      7.701 ppm2      3.766 CV     1
 ASSI {  624}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 65   and name HB3 ))
      2.300     0.700     0.700 peak   624 spectrum    1 weight  0.10000E+01 volume  0.91271E-02 ppm1      7.701 ppm2      2.404 CV     1
 ASSI {  625}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 64   and name HB2 ))
      2.600     0.800     0.800 peak   625 spectrum    1 weight  0.10000E+01 volume  0.26200E-02 ppm1      7.702 ppm2      1.813 CV     1
 ASSI {  626}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 64   and name HB3 ))
      3.200     1.300     1.300 peak   626 spectrum    1 weight  0.10000E+01 volume  0.30263E-02 ppm1      7.702 ppm2      1.751 CV     1
 ASSI {  627}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 66   and name H   ))
      2.200     0.600     0.600 peak   627 spectrum    1 weight  0.10000E+01 volume  0.52201E-02 ppm1      7.700 ppm2      7.521 CV     1
 ASSI {  628}
   (( segid "    " and resid 65   and name H   ))
   (  segid "    " and resid 66   and name HD% )
      3.500     1.600     1.600 peak   628 spectrum    1 weight  0.10000E+01 volume  0.10504E-02 ppm1      7.700 ppm2      7.303 CV     1
 ASSI {  630}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 64   and name H   ))
      2.400     0.700     0.700 peak   630 spectrum    1 weight  0.10000E+01 volume  0.43909E-02 ppm1      7.701 ppm2      8.292 CV     1
 ASSI {  631}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 66   and name HA  ))
      2.700     0.900     0.900 peak   631 spectrum    1 weight  0.10000E+01 volume  0.26847E-02 ppm1      7.518 ppm2      4.584 CV     1
 ASSI {  633}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 64   and name HA  ))
      3.800     1.800     1.800 peak   633 spectrum    1 weight  0.10000E+01 volume  0.63325E-03 ppm1      7.524 ppm2      4.114 CV     1
 ASSI {  634}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 63   and name HA  ))
      4.200     2.300     1.800 peak   634 spectrum    1 weight  0.10000E+01 volume  0.41093E-03 ppm1      7.523 ppm2      3.959 CV     1
 ASSI {  635}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 66   and name HB3 ))
      3.700     1.700     1.700 peak   635 spectrum    1 weight  0.10000E+01 volume  0.18367E-02 ppm1      7.518 ppm2      3.371 CV     1
 ASSI {  636}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 66   and name HB2 ))
      2.900     1.000     1.000 peak   636 spectrum    1 weight  0.10000E+01 volume  0.24469E-02 ppm1      7.518 ppm2      2.897 CV     1
 ASSI {  638}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 67   and name HB2 ))
      4.600     2.600     1.400 peak   638 spectrum    1 weight  0.10000E+01 volume  0.45446E-03 ppm1      7.525 ppm2      2.076 CV     1
 ASSI {  640}
   (( segid "    " and resid 66   and name H   ))
   (  segid "    " and resid 66   and name HD% )
      2.100     0.500     0.500 peak   640 spectrum    1 weight  0.10000E+01 volume  0.34791E-02 ppm1      7.520 ppm2      7.299 CV     1
 ASSI {  641}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 64   and name H   ))
      4.100     2.100     1.900 peak   641 spectrum    1 weight  0.10000E+01 volume  0.37086E-03 ppm1      7.520 ppm2      8.292 CV     1
 ASSI {  644}
   (( segid "    " and resid 66   and name H   ))
   (  segid "    " and resid 66   and name HE% )
      3.800     1.800     1.800 peak   644 spectrum    1 weight  0.10000E+01 volume  0.11436E-02 ppm1      7.516 ppm2      7.106 CV     1
 ASSI {  645}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 64   and name HA  ))
      3.000     1.100     1.100 peak   645 spectrum    1 weight  0.10000E+01 volume  0.10414E-02 ppm1      7.802 ppm2      4.109 CV     1
 ASSI {  647}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 67   and name HB3 ))
      2.900     1.100     1.100 peak   647 spectrum    1 weight  0.10000E+01 volume  0.52079E-02 ppm1      7.802 ppm2      2.161 CV     1
 ASSI {  648}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 64   and name HB3 ))
      4.000     2.000     2.000 peak   648 spectrum    1 weight  0.10000E+01 volume  0.85063E-03 ppm1      7.799 ppm2      1.739 CV     1
 ASSI {  650}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 66   and name HA  ))
      2.800     1.000     1.000 peak   650 spectrum    1 weight  0.10000E+01 volume  0.45317E-02 ppm1      7.802 ppm2      4.582 CV     1
 ASSI {  651}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 66   and name HB3 ))
      4.200     2.200     1.800 peak   651 spectrum    1 weight  0.10000E+01 volume  0.13065E-02 ppm1      7.804 ppm2      3.369 CV     1
 ASSI {  652}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 66   and name HB2 ))
      3.000     1.200     1.200 peak   652 spectrum    1 weight  0.10000E+01 volume  0.15181E-02 ppm1      7.801 ppm2      2.897 CV     1
 ASSI {  654}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 66   and name H   ))
      1.800     0.400     0.400 peak   654 spectrum    1 weight  0.10000E+01 volume  0.66731E-02 ppm1      7.803 ppm2      7.522 CV     1
 ASSI {  655}
   (( segid "    " and resid 67   and name H   ))
   (  segid "    " and resid 66   and name HD% )
      3.400     1.500     1.500 peak   655 spectrum    1 weight  0.10000E+01 volume  0.14478E-02 ppm1      7.803 ppm2      7.300 CV     1
 ASSI {  656}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 68   and name H   ))
      3.500     1.600     1.600 peak   656 spectrum    1 weight  0.10000E+01 volume  0.14113E-02 ppm1      7.803 ppm2      8.365 CV     1
 ASSI {  657}
   (( segid "    " and resid 67   and name HE22))
   (( segid "    " and resid 67   and name HG3 ))
      3.600     1.600     1.600 peak   657 spectrum    1 weight  0.10000E+01 volume  0.21984E-02 ppm1      6.951 ppm2      2.421 CV     1
 OR {  657}
   (( segid "    " and resid 67   and name HE22))
   (( segid "    " and resid 67   and name HG2 ))
 ASSI {  658}
   (( segid "    " and resid 67   and name HE22))
   (( segid "    " and resid 67   and name HB3 ))
      3.900     1.900     1.900 peak   658 spectrum    1 weight  0.10000E+01 volume  0.99650E-03 ppm1      6.952 ppm2      2.201 CV     1
 ASSI {  660}
   (( segid "    " and resid 67   and name HE22))
   (( segid "    " and resid 67   and name HE21))
      1.400     0.200     0.800 peak   660 spectrum    1 weight  0.10000E+01 volume  0.47020E-01 ppm1      6.951 ppm2      7.572 CV     1
 ASSI {  661}
   (( segid "    " and resid 67   and name HE21))
   (( segid "    " and resid 67   and name HA  ))
      4.500     2.600     1.500 peak   661 spectrum    1 weight  0.10000E+01 volume  0.55326E-03 ppm1      7.572 ppm2      4.410 CV     1
 ASSI {  662}
   (( segid "    " and resid 67   and name HE21))
   (( segid "    " and resid 67   and name HG3 ))
      2.300     0.700     0.700 peak   662 spectrum    1 weight  0.10000E+01 volume  0.48142E-02 ppm1      7.573 ppm2      2.420 CV     1
 OR {  662}
   (( segid "    " and resid 67   and name HE21))
   (( segid "    " and resid 67   and name HG2 ))
 ASSI {  663}
   (( segid "    " and resid 67   and name HE21))
   (( segid "    " and resid 67   and name HB3 ))
      3.800     1.900     1.900 peak   663 spectrum    1 weight  0.10000E+01 volume  0.98800E-03 ppm1      7.575 ppm2      2.163 CV     1
 ASSI {  664}
   (( segid "    " and resid 67   and name HE21))
   (  segid "    " and resid 33   and name HG1%)
      3.300     1.300     1.300 peak   664 spectrum    1 weight  0.10000E+01 volume  0.73479E-03 ppm1      7.572 ppm2      0.951 CV     1
 ASSI {  665}
   (( segid "    " and resid 67   and name HE21))
   (  segid "    " and resid 37   and name HD2%)
      4.000     2.000     2.000 peak   665 spectrum    1 weight  0.10000E+01 volume  0.46034E-03 ppm1      7.577 ppm2      0.875 CV     1
 ASSI {  667}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 67   and name HG2 ))
      4.600     2.700     1.400 peak   667 spectrum    1 weight  0.10000E+01 volume  0.10203E-02 ppm1      8.355 ppm2      2.419 CV     1
 OR {  667}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 67   and name HG3 ))
 ASSI {  669}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 67   and name HB2 ))
      2.800     1.000     1.000 peak   669 spectrum    1 weight  0.10000E+01 volume  0.13200E-02 ppm1      8.364 ppm2      2.063 CV     1
 ASSI {  670}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 64   and name HB3 ))
      3.300     3.300     2.700 peak   670 spectrum    1 weight  0.10000E+01 volume  0.26684E-02 ppm1      8.362 ppm2      1.722 CV     1
 ASSI {  671}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 67   and name HA  ))
      2.700     0.900     0.900 peak   671 spectrum    1 weight  0.10000E+01 volume  0.62055E-02 ppm1      8.361 ppm2      4.396 CV     1
 ASSI {  672}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 67   and name HB3 ))
      2.700     0.900     0.900 peak   672 spectrum    1 weight  0.10000E+01 volume  0.14967E-02 ppm1      8.358 ppm2      2.164 CV     1
 ASSI {  673}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 68   and name HB2 ))
      2.600     0.900     0.900 peak   673 spectrum    1 weight  0.10000E+01 volume  0.37670E-02 ppm1      8.361 ppm2      1.820 CV     1
 OR {  673}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 68   and name HB3 ))
 ASSI {  675}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 70   and name H   ))
      4.100     2.100     1.900 peak   675 spectrum    1 weight  0.10000E+01 volume  0.50872E-03 ppm1      8.359 ppm2      8.550 CV     1
 ASSI {  676}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 69   and name HA  ))
      2.800     1.000     1.000 peak   676 spectrum    1 weight  0.10000E+01 volume  0.22174E-02 ppm1      8.548 ppm2      4.400 CV     1
 ASSI {  677}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 70   and name HA3 ))
      3.000     1.100     1.100 peak   677 spectrum    1 weight  0.10000E+01 volume  0.20548E-02 ppm1      8.548 ppm2      4.024 CV     1
 OR {  677}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 70   and name HA2 ))
 ASSI {  678}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 68   and name HB3 ))
      2.600     2.600     3.400 peak   678 spectrum    1 weight  0.10000E+01 volume  0.60845E-03 ppm1      8.541 ppm2      1.885 CV     1
 OR {  678}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 68   and name HB2 ))
 ASSI {  679}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 69   and name HB3 ))
      4.100     2.100     1.900 peak   679 spectrum    1 weight  0.10000E+01 volume  0.61027E-03 ppm1      8.545 ppm2      1.791 CV     1
 OR {  679}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 69   and name HB2 ))
 ASSI {  680}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 71   and name HA  ))
      2.900     1.100     1.100 peak   680 spectrum    1 weight  0.10000E+01 volume  0.17359E-02 ppm1      8.100 ppm2      4.324 CV     1
 ASSI {  682}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 70   and name HA2 ))
      2.700     0.900     0.900 peak   682 spectrum    1 weight  0.10000E+01 volume  0.41602E-02 ppm1      8.098 ppm2      4.020 CV     1
 OR {  682}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 70   and name HA3 ))
 ASSI {  683}
   (( segid "    " and resid 71   and name H   ))
   (  segid "    " and resid 71   and name HG2%)
      3.400     1.500     1.500 peak   683 spectrum    1 weight  0.10000E+01 volume  0.10058E-02 ppm1      8.096 ppm2      1.172 CV     1
 ASSI {  684}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 70   and name H   ))
      5.000     3.200     1.000 peak   684 spectrum    1 weight  0.10000E+01 volume  0.26066E-03 ppm1      8.097 ppm2      8.551 CV     1
 ASSI {  685}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 73   and name HA  ))
      2.700     0.900     0.900 peak   685 spectrum    1 weight  0.10000E+01 volume  0.23717E-02 ppm1      8.167 ppm2      4.141 CV     1
 ASSI {  687}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 73   and name HG13))
      2.800     1.000     1.000 peak   687 spectrum    1 weight  0.10000E+01 volume  0.19981E-02 ppm1      8.166 ppm2      1.399 CV     1
 ASSI {  688}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 72   and name HA  ))
      2.300     0.600     0.600 peak   688 spectrum    1 weight  0.10000E+01 volume  0.64253E-02 ppm1      8.167 ppm2      4.689 CV     1
 ASSI {  689}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 72   and name HB3 ))
      3.800     1.800     1.800 peak   689 spectrum    1 weight  0.10000E+01 volume  0.21551E-02 ppm1      8.168 ppm2      3.141 CV     1
 ASSI {  690}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 73   and name HB  ))
      2.600     0.800     0.800 peak   690 spectrum    1 weight  0.10000E+01 volume  0.45032E-02 ppm1      8.166 ppm2      1.777 CV     1
 ASSI {  691}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 73   and name HG12))
      3.000     1.100     1.100 peak   691 spectrum    1 weight  0.10000E+01 volume  0.25687E-02 ppm1      8.167 ppm2      1.137 CV     1
 ASSI {  692}
   (( segid "    " and resid 73   and name H   ))
   (  segid "    " and resid 73   and name HG2%)
      3.500     1.600     1.600 peak   692 spectrum    1 weight  0.10000E+01 volume  0.32410E-02 ppm1      8.168 ppm2      0.832 CV     1
 OR {  692}
   (( segid "    " and resid 73   and name H   ))
   (  segid "    " and resid 73   and name HD1%)
 ASSI {  693}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 72   and name HE1 ))
      3.700     1.700     1.700 peak   693 spectrum    1 weight  0.10000E+01 volume  0.13218E-02 ppm1      8.165 ppm2      7.986 CV     1
 ASSI {  694}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 74   and name H   ))
      3.500     1.500     1.500 peak   694 spectrum    1 weight  0.10000E+01 volume  0.14074E-02 ppm1      8.165 ppm2      8.384 CV     1
 ASSI {  696}
   (( segid "    " and resid 74   and name H   ))
   (( segid "    " and resid 74   and name HB  ))
      3.300     1.300     1.300 peak   696 spectrum    1 weight  0.10000E+01 volume  0.12272E-02 ppm1      8.400 ppm2      2.025 CV     1
 ASSI {  700}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 75   and name HA  ))
      3.200     1.300     1.300 peak   700 spectrum    1 weight  0.10000E+01 volume  0.93035E-03 ppm1      8.389 ppm2      4.455 CV     1
 ASSI {  701}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 74   and name HA  ))
      2.400     0.700     0.700 peak   701 spectrum    1 weight  0.10000E+01 volume  0.43557E-02 ppm1      8.394 ppm2      4.097 CV     1
 ASSI {  702}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 74   and name HB  ))
      3.900     1.900     1.900 peak   702 spectrum    1 weight  0.10000E+01 volume  0.64964E-03 ppm1      8.399 ppm2      2.014 CV     1
 ASSI {  703}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 75   and name HG  ))
      2.600     0.900     0.900 peak   703 spectrum    1 weight  0.10000E+01 volume  0.28873E-02 ppm1      8.390 ppm2      1.661 CV     1
 OR {  703}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 75   and name HB3 ))
 ASSI {  704}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 75   and name HG  ))
      2.500     0.800     0.800 peak   704 spectrum    1 weight  0.10000E+01 volume  0.34769E-02 ppm1      8.393 ppm2      1.574 CV     1
 OR {  704}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 75   and name HB2 ))
 ASSI {  707}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 76   and name HA  ))
      3.900     1.900     1.900 peak   707 spectrum    1 weight  0.10000E+01 volume  0.99360E-03 ppm1      8.403 ppm2      4.953 CV     1
 ASSI {  708}
   (( segid "    " and resid 75   and name H   ))
   (( segid "    " and resid 76   and name H   ))
      4.100     2.100     1.900 peak   708 spectrum    1 weight  0.10000E+01 volume  0.11911E-02 ppm1      8.389 ppm2      8.664 CV     1
 ASSI {  709}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 75   and name HA  ))
      2.500     0.800     0.800 peak   709 spectrum    1 weight  0.10000E+01 volume  0.40893E-02 ppm1      8.661 ppm2      4.464 CV     1
 ASSI {  711}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 75   and name HB3 ))
      3.700     1.700     1.700 peak   711 spectrum    1 weight  0.10000E+01 volume  0.24693E-02 ppm1      8.658 ppm2      1.661 CV     1
 OR {  711}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 75   and name HG  ))
 ASSI {  712}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 75   and name HB2 ))
      3.800     1.800     1.800 peak   712 spectrum    1 weight  0.10000E+01 volume  0.24739E-02 ppm1      8.660 ppm2      1.573 CV     1
 OR {  712}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 75   and name HG  ))
 ASSI {  714}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 81   and name HA  ))
      3.200     1.300     1.300 peak   714 spectrum    1 weight  0.10000E+01 volume  0.91348E-03 ppm1      8.650 ppm2      3.936 CV     1
 ASSI {  719}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 76   and name HA  ))
      3.200     1.300     1.300 peak   719 spectrum    1 weight  0.10000E+01 volume  0.10838E-02 ppm1      8.658 ppm2      4.943 CV     1
 ASSI {  723}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 114  and name HG13))
      4.500     2.500     1.500 peak   723 spectrum    1 weight  0.10000E+01 volume  0.59328E-03 ppm1     10.470 ppm2      1.857 CV     1
 ASSI {  728}
   (( segid "    " and resid 76   and name HE1 ))
   (  segid "    " and resid 107  and name HB% )
      3.600     1.600     1.600 peak   728 spectrum    1 weight  0.10000E+01 volume  0.73748E-03 ppm1     10.468 ppm2      1.162 CV     1
 ASSI {  729}
   (( segid "    " and resid 76   and name HE1 ))
   (  segid "    " and resid 74   and name HG1%)
      2.900     1.100     1.100 peak   729 spectrum    1 weight  0.10000E+01 volume  0.30567E-02 ppm1     10.466 ppm2      0.879 CV     1
 OR {  729}
   (( segid "    " and resid 76   and name HE1 ))
   (  segid "    " and resid 74   and name HG2%)
 ASSI {  731}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 80   and name HE21))
      3.400     3.400     2.600 peak   731 spectrum    1 weight  0.10000E+01 volume  0.10947E-02 ppm1     10.464 ppm2      7.514 CV     1
 ASSI {  732}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 76   and name HD1 ))
      2.600     0.800     0.800 peak   732 spectrum    1 weight  0.10000E+01 volume  0.61930E-02 ppm1     10.467 ppm2      7.366 CV     1
 ASSI {  733}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 76   and name HZ2 ))
      2.900     1.000     1.000 peak   733 spectrum    1 weight  0.10000E+01 volume  0.25557E-02 ppm1     10.469 ppm2      7.109 CV     1
 ASSI {  734}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 76   and name HH2 ))
      4.600     2.700     1.400 peak   734 spectrum    1 weight  0.10000E+01 volume  0.57337E-03 ppm1     10.475 ppm2      6.903 CV     1
 ASSI {  735}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 77   and name HA  ))
      3.400     1.400     1.400 peak   735 spectrum    1 weight  0.10000E+01 volume  0.80558E-03 ppm1      8.653 ppm2      4.669 CV     1
 ASSI {  736}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 76   and name HB2 ))
      4.100     2.100     1.900 peak   736 spectrum    1 weight  0.10000E+01 volume  0.60149E-03 ppm1      8.665 ppm2      3.164 CV     1
 ASSI {  737}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 80   and name HG3 ))
      4.000     2.000     2.000 peak   737 spectrum    1 weight  0.10000E+01 volume  0.71859E-03 ppm1      8.659 ppm2      2.737 CV     1
 OR {  737}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 80   and name HG2 ))
 ASSI {  738}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 80   and name HB3 ))
      3.300     1.300     1.300 peak   738 spectrum    1 weight  0.10000E+01 volume  0.70681E-03 ppm1      8.651 ppm2      2.554 CV     1
 ASSI {  739}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 80   and name HB2 ))
      4.100     2.100     1.900 peak   739 spectrum    1 weight  0.10000E+01 volume  0.53332E-03 ppm1      8.651 ppm2      2.408 CV     1
 ASSI {  740}
   (( segid "    " and resid 77   and name H   ))
   (  segid "    " and resid 77   and name HG2%)
      2.900     1.100     1.100 peak   740 spectrum    1 weight  0.10000E+01 volume  0.15811E-02 ppm1      8.659 ppm2      1.210 CV     1
 ASSI {  741}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 76   and name HD1 ))
      4.400     2.400     1.600 peak   741 spectrum    1 weight  0.10000E+01 volume  0.64061E-03 ppm1      8.650 ppm2      7.381 CV     1
 OR {  741}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 76   and name HE3 ))
 ASSI {  742}
   (( segid "    " and resid 77   and name H   ))
   (( segid "    " and resid 76   and name HA  ))
      3.000     1.100     1.100 peak   742 spectrum    1 weight  0.10000E+01 volume  0.13304E-02 ppm1      8.659 ppm2      4.938 CV     1
 ASSI {  743}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 77   and name HA  ))
      3.300     1.400     1.400 peak   743 spectrum    1 weight  0.10000E+01 volume  0.10608E-02 ppm1      9.101 ppm2      4.676 CV     1
 OR {  743}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 77   and name HB  ))
 ASSI {  744}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 78   and name HA2 ))
      3.300     1.400     1.400 peak   744 spectrum    1 weight  0.10000E+01 volume  0.10495E-02 ppm1      9.103 ppm2      4.039 CV     1
 OR {  744}
   (( segid "    " and resid 78   and name H   ))
   (( segid "    " and resid 78   and name HA3 ))
 ASSI {  746}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 78   and name HA2 ))
      3.100     1.200     1.200 peak   746 spectrum    1 weight  0.10000E+01 volume  0.17383E-02 ppm1      8.551 ppm2      4.010 CV     1
 OR {  746}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 78   and name HA3 ))
 ASSI {  747}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 79   and name HA  ))
      3.100     1.200     1.200 peak   747 spectrum    1 weight  0.10000E+01 volume  0.17205E-02 ppm1      8.553 ppm2      4.544 CV     1
 ASSI {  748}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 79   and name HB3 ))
      3.300     1.400     1.400 peak   748 spectrum    1 weight  0.10000E+01 volume  0.22714E-02 ppm1      8.553 ppm2      2.700 CV     1
 ASSI {  749}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 79   and name HB2 ))
      2.900     1.100     1.100 peak   749 spectrum    1 weight  0.10000E+01 volume  0.25020E-02 ppm1      8.554 ppm2      2.594 CV     1
 ASSI {  751}
   (( segid "    " and resid 79   and name H   ))
   (( segid "    " and resid 78   and name H   ))
      3.800     1.800     1.800 peak   751 spectrum    1 weight  0.10000E+01 volume  0.64284E-03 ppm1      8.555 ppm2      9.094 CV     1
 ASSI {  752}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 80   and name HG3 ))
      4.300     2.300     1.700 peak   752 spectrum    1 weight  0.10000E+01 volume  0.13436E-02 ppm1      7.893 ppm2      2.769 CV     1
 ASSI {  755}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 80   and name HB2 ))
      3.000     1.200     1.200 peak   755 spectrum    1 weight  0.10000E+01 volume  0.12028E-02 ppm1      7.888 ppm2      2.405 CV     1
 ASSI {  756}
   (( segid "    " and resid 80   and name H   ))
   (  segid "    " and resid 77   and name HG2%)
      3.700     1.700     1.700 peak   756 spectrum    1 weight  0.10000E+01 volume  0.67872E-03 ppm1      7.888 ppm2      1.217 CV     1
 ASSI {  757}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 81   and name H   ))
      3.000     1.100     1.100 peak   757 spectrum    1 weight  0.10000E+01 volume  0.17639E-02 ppm1      7.888 ppm2      8.646 CV     1
 ASSI {  758}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 79   and name H   ))
      3.200     1.300     1.300 peak   758 spectrum    1 weight  0.10000E+01 volume  0.11232E-02 ppm1      7.888 ppm2      8.576 CV     1
 ASSI {  759}
   (( segid "    " and resid 49   and name HE21))
   (( segid "    " and resid 49   and name HG2 ))
      2.900     1.000     1.000 peak   759 spectrum    1 weight  0.10000E+01 volume  0.20433E-02 ppm1      7.061 ppm2      2.587 CV     1
 ASSI {  761}
   (( segid "    " and resid 49   and name HE21))
   (  segid "    " and resid 46   and name HG2%)
      3.500     1.600     1.600 peak   761 spectrum    1 weight  0.10000E+01 volume  0.92342E-03 ppm1      7.063 ppm2      1.256 CV     1
 ASSI {  763}
   (( segid "    " and resid 49   and name HE21))
   (( segid "    " and resid 49   and name HE22))
      1.900     0.500     0.500 peak   763 spectrum    1 weight  0.10000E+01 volume  0.82135E-02 ppm1      7.061 ppm2      7.472 CV     1
 ASSI {  764}
   (( segid "    " and resid 49   and name HE22))
   (( segid "    " and resid 49   and name HG2 ))
      3.900     1.900     1.900 peak   764 spectrum    1 weight  0.10000E+01 volume  0.13998E-02 ppm1      7.471 ppm2      2.573 CV     1
 ASSI {  767}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 81   and name HG3 ))
      3.200     1.300     1.300 peak   767 spectrum    1 weight  0.10000E+01 volume  0.11460E-02 ppm1      8.648 ppm2      2.488 CV     1
 ASSI {  768}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 81   and name HB3 ))
      3.400     1.500     1.500 peak   768 spectrum    1 weight  0.10000E+01 volume  0.12182E-02 ppm1      8.647 ppm2      1.939 CV     1
 ASSI {  770}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 79   and name HA  ))
      3.400     1.400     1.400 peak   770 spectrum    1 weight  0.10000E+01 volume  0.11871E-02 ppm1      8.151 ppm2      4.528 CV     1
 ASSI {  771}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 82   and name HA  ))
      3.100     1.200     1.200 peak   771 spectrum    1 weight  0.10000E+01 volume  0.14530E-02 ppm1      8.153 ppm2      4.222 CV     1
 ASSI {  772}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 83   and name HA  ))
      4.100     2.100     1.900 peak   772 spectrum    1 weight  0.10000E+01 volume  0.13361E-02 ppm1      8.149 ppm2      4.069 CV     1
 ASSI {  777}
   (( segid "    " and resid 82   and name H   ))
   (  segid "    " and resid 82   and name HD1%)
      3.700     1.700     1.700 peak   777 spectrum    1 weight  0.10000E+01 volume  0.32806E-02 ppm1      8.155 ppm2      0.958 CV     1
 OR {  777}
   (( segid "    " and resid 82   and name H   ))
   (  segid "    " and resid 82   and name HD2%)
 ASSI {  778}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 81   and name H   ))
      2.900     1.100     1.100 peak   778 spectrum    1 weight  0.10000E+01 volume  0.15854E-02 ppm1      8.152 ppm2      8.660 CV     1
 ASSI {  779}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 68   and name HA  ))
      3.200     1.300     1.300 peak   779 spectrum    1 weight  0.10000E+01 volume  0.77283E-03 ppm1      8.099 ppm2      4.364 CV     1
 ASSI {  780}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 82   and name HA  ))
      3.400     1.400     1.400 peak   780 spectrum    1 weight  0.10000E+01 volume  0.10307E-02 ppm1      8.109 ppm2      4.227 CV     1
 ASSI {  782}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 83   and name HG2 ))
      2.700     0.900     0.900 peak   782 spectrum    1 weight  0.10000E+01 volume  0.24810E-02 ppm1      8.103 ppm2      2.364 CV     1
 OR {  782}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 83   and name HB2 ))
 ASSI {  783}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 83   and name HB3 ))
      3.200     1.300     1.300 peak   783 spectrum    1 weight  0.10000E+01 volume  0.29148E-02 ppm1      8.101 ppm2      2.233 CV     1
 ASSI {  785}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 82   and name HB2 ))
      3.600     1.600     1.600 peak   785 spectrum    1 weight  0.10000E+01 volume  0.21449E-02 ppm1      8.104 ppm2      1.924 CV     1
 ASSI {  789}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 81   and name H   ))
      3.800     1.800     1.800 peak   789 spectrum    1 weight  0.10000E+01 volume  0.53434E-03 ppm1      8.102 ppm2      8.654 CV     1
 ASSI {  790}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 81   and name HA  ))
      3.700     1.700     1.700 peak   790 spectrum    1 weight  0.10000E+01 volume  0.48686E-03 ppm1      8.030 ppm2      3.928 CV     1
 ASSI {  791}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 83   and name HB2 ))
      3.100     1.200     1.200 peak   791 spectrum    1 weight  0.10000E+01 volume  0.13525E-02 ppm1      8.034 ppm2      2.389 CV     1
 OR {  791}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI {  792}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 85   and name HB2 ))
      4.000     2.000     2.000 peak   792 spectrum    1 weight  0.10000E+01 volume  0.14976E-02 ppm1      8.034 ppm2      2.300 CV     1
 OR {  792}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 85   and name HG3 ))
 ASSI {  793}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 84   and name HB3 ))
      3.000     1.100     1.100 peak   793 spectrum    1 weight  0.10000E+01 volume  0.10218E-02 ppm1      8.028 ppm2      2.032 CV     1
 ASSI {  794}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 84   and name HB2 ))
      3.300     1.300     1.300 peak   794 spectrum    1 weight  0.10000E+01 volume  0.97688E-03 ppm1      8.028 ppm2      1.786 CV     1
 ASSI {  795}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 84   and name HA  ))
      3.200     1.300     1.300 peak   795 spectrum    1 weight  0.10000E+01 volume  0.10031E-02 ppm1      8.024 ppm2      4.107 CV     1
 ASSI {  799}
   (( segid "    " and resid 84   and name H   ))
   (  segid "    " and resid 84   and name HD2%)
      4.400     2.400     1.600 peak   799 spectrum    1 weight  0.10000E+01 volume  0.78518E-03 ppm1      8.031 ppm2      0.600 CV     1
 ASSI {  800}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 82   and name HA  ))
      3.100     1.200     1.200 peak   800 spectrum    1 weight  0.10000E+01 volume  0.14113E-02 ppm1      8.135 ppm2      4.187 CV     1
 ASSI {  804}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 85   and name HB2 ))
      2.400     0.700     0.700 peak   804 spectrum    1 weight  0.10000E+01 volume  0.51287E-02 ppm1      8.134 ppm2      2.260 CV     1
 OR {  804}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 85   and name HB3 ))
 ASSI {  805}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 84   and name HB3 ))
      2.700     0.900     0.900 peak   805 spectrum    1 weight  0.10000E+01 volume  0.17807E-02 ppm1      8.136 ppm2      2.029 CV     1
 ASSI {  806}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 84   and name HB2 ))
      3.900     1.900     1.900 peak   806 spectrum    1 weight  0.10000E+01 volume  0.13897E-02 ppm1      8.134 ppm2      1.795 CV     1
 ASSI {  811}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 85   and name HG2 ))
      3.200     1.200     1.200 peak   811 spectrum    1 weight  0.10000E+01 volume  0.16832E-02 ppm1      6.845 ppm2      2.495 CV     1
 ASSI {  812}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 85   and name HB2 ))
      2.400     0.700     0.700 peak   812 spectrum    1 weight  0.10000E+01 volume  0.21178E-02 ppm1      6.846 ppm2      2.309 CV     1
 OR {  812}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 85   and name HG3 ))
 ASSI {  814}
   (( segid "    " and resid 85   and name HE21))
   (  segid "    " and resid 73   and name HD1%)
      3.200     1.300     1.300 peak   814 spectrum    1 weight  0.10000E+01 volume  0.11759E-02 ppm1      6.844 ppm2      0.853 CV     1
 ASSI {  815}
   (( segid "    " and resid 85   and name HE21))
   (  segid "    " and resid 121  and name HD1%)
      3.300     1.400     1.400 peak   815 spectrum    1 weight  0.10000E+01 volume  0.93868E-03 ppm1      6.849 ppm2      0.706 CV     1
 ASSI {  818}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 85   and name HE22))
      1.500     0.300     0.700 peak   818 spectrum    1 weight  0.10000E+01 volume  0.27274E-01 ppm1      6.846 ppm2      7.236 CV     1
 ASSI {  819}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 85   and name HG2 ))
      3.400     1.400     1.400 peak   819 spectrum    1 weight  0.10000E+01 volume  0.29262E-02 ppm1      7.237 ppm2      2.491 CV     1
 ASSI {  820}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 89   and name HG2 ))
      3.600     3.600     2.400 peak   820 spectrum    1 weight  0.10000E+01 volume  0.26231E-02 ppm1      7.240 ppm2      2.392 CV     1
 ASSI {  821}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 85   and name HB2 ))
      3.300     1.400     1.400 peak   821 spectrum    1 weight  0.10000E+01 volume  0.36191E-02 ppm1      7.238 ppm2      2.301 CV     1
 OR {  821}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 85   and name HG3 ))
 ASSI {  822}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 121  and name HG  ))
      4.200     2.200     1.800 peak   822 spectrum    1 weight  0.10000E+01 volume  0.61847E-03 ppm1      7.229 ppm2      1.550 CV     1
 ASSI {  823}
   (( segid "    " and resid 85   and name HE22))
   (  segid "    " and resid 82   and name HD2%)
      3.900     1.900     1.900 peak   823 spectrum    1 weight  0.10000E+01 volume  0.13791E-02 ppm1      7.236 ppm2      0.930 CV     1
 ASSI {  828}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 86   and name HA  ))
      2.700     0.900     0.900 peak   828 spectrum    1 weight  0.10000E+01 volume  0.30200E-02 ppm1      8.378 ppm2      4.134 CV     1
 ASSI {  829}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 85   and name HA  ))
      3.600     1.600     1.600 peak   829 spectrum    1 weight  0.10000E+01 volume  0.72929E-03 ppm1      8.383 ppm2      3.855 CV     1
 ASSI {  830}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 86   and name HD2 ))
      4.800     2.900     1.200 peak   830 spectrum    1 weight  0.10000E+01 volume  0.47800E-03 ppm1      8.380 ppm2      3.267 CV     1
 OR {  830}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 86   and name HD3 ))
 ASSI {  832}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 86   and name HB2 ))
      2.400     0.700     0.700 peak   832 spectrum    1 weight  0.10000E+01 volume  0.55255E-02 ppm1      8.381 ppm2      2.021 CV     1
 OR {  832}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 86   and name HB3 ))
 ASSI {  833}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 86   and name HG2 ))
      3.500     1.500     1.500 peak   833 spectrum    1 weight  0.10000E+01 volume  0.24182E-02 ppm1      8.382 ppm2      1.795 CV     1
 ASSI {  834}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 86   and name HG3 ))
      2.500     0.800     0.800 peak   834 spectrum    1 weight  0.10000E+01 volume  0.18939E-02 ppm1      8.379 ppm2      1.683 CV     1
 ASSI {  837}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 85   and name H   ))
      2.700     0.900     0.900 peak   837 spectrum    1 weight  0.10000E+01 volume  0.25078E-02 ppm1      8.381 ppm2      8.138 CV     1
 ASSI {  838}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 87   and name H   ))
      2.900     1.000     1.000 peak   838 spectrum    1 weight  0.10000E+01 volume  0.13021E-02 ppm1      8.382 ppm2      8.683 CV     1
 ASSI {  839}
   (( segid "    " and resid 87   and name H   ))
   (( segid "    " and resid 87   and name HA  ))
      3.200     1.200     1.200 peak   839 spectrum    1 weight  0.10000E+01 volume  0.97940E-03 ppm1      8.678 ppm2      4.238 CV     1
 ASSI {  841}
   (( segid "    " and resid 87   and name H   ))
   (( segid "    " and resid 87   and name HG  ))
      3.700     1.700     1.700 peak   841 spectrum    1 weight  0.10000E+01 volume  0.25502E-02 ppm1      8.683 ppm2      2.142 CV     1
 ASSI {  842}
   (( segid "    " and resid 87   and name H   ))
   (( segid "    " and resid 86   and name HG3 ))
      3.900     1.900     1.900 peak   842 spectrum    1 weight  0.10000E+01 volume  0.90864E-03 ppm1      8.677 ppm2      1.698 CV     1
 ASSI {  843}
   (( segid "    " and resid 87   and name H   ))
   (( segid "    " and resid 87   and name HB3 ))
      4.000     2.000     2.000 peak   843 spectrum    1 weight  0.10000E+01 volume  0.83960E-03 ppm1      8.677 ppm2      1.485 CV     1
 ASSI {  846}
   (( segid "    " and resid 87   and name H   ))
   (( segid "    " and resid 88   and name H   ))
      3.200     1.300     1.300 peak   846 spectrum    1 weight  0.10000E+01 volume  0.85626E-03 ppm1      8.686 ppm2      8.905 CV     1
 ASSI {  847}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 88   and name HA  ))
      2.900     1.100     1.100 peak   847 spectrum    1 weight  0.10000E+01 volume  0.15295E-02 ppm1      8.899 ppm2      3.935 CV     1
 ASSI {  848}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 88   and name HB3 ))
      2.700     0.900     0.900 peak   848 spectrum    1 weight  0.10000E+01 volume  0.13053E-02 ppm1      8.900 ppm2      3.185 CV     1
 ASSI {  849}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 88   and name HB2 ))
      3.300     1.400     1.400 peak   849 spectrum    1 weight  0.10000E+01 volume  0.12634E-02 ppm1      8.902 ppm2      2.939 CV     1
 ASSI {  851}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 87   and name HG  ))
      4.100     2.100     1.900 peak   851 spectrum    1 weight  0.10000E+01 volume  0.12269E-02 ppm1      8.900 ppm2      2.112 CV     1
 ASSI {  852}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 87   and name HB3 ))
      3.500     1.500     1.500 peak   852 spectrum    1 weight  0.10000E+01 volume  0.44992E-03 ppm1      8.911 ppm2      1.506 CV     1
 ASSI {  856}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 89   and name H   ))
      2.900     1.100     1.100 peak   856 spectrum    1 weight  0.10000E+01 volume  0.13685E-02 ppm1      8.901 ppm2      8.188 CV     1
 ASSI {  857}
   (( segid "    " and resid 88   and name H   ))
   (  segid "    " and resid 88   and name HD% )
      4.000     2.000     2.000 peak   857 spectrum    1 weight  0.10000E+01 volume  0.11896E-02 ppm1      8.900 ppm2      7.055 CV     1
 ASSI {  858}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 86   and name HA  ))
      3.600     1.600     1.600 peak   858 spectrum    1 weight  0.10000E+01 volume  0.67268E-03 ppm1      8.188 ppm2      4.129 CV     1
 ASSI {  859}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 85   and name HA  ))
      3.700     1.700     1.700 peak   859 spectrum    1 weight  0.10000E+01 volume  0.65363E-03 ppm1      8.191 ppm2      3.836 CV     1
 ASSI {  860}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 89   and name HA  ))
      2.800     1.000     1.000 peak   860 spectrum    1 weight  0.10000E+01 volume  0.17733E-02 ppm1      8.193 ppm2      3.744 CV     1
 ASSI {  861}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 88   and name HB2 ))
      4.600     2.600     1.400 peak   861 spectrum    1 weight  0.10000E+01 volume  0.55850E-03 ppm1      8.188 ppm2      2.937 CV     1
 ASSI {  864}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 89   and name HB3 ))
      3.400     1.400     1.400 peak   864 spectrum    1 weight  0.10000E+01 volume  0.27312E-02 ppm1      8.190 ppm2      2.173 CV     1
 ASSI {  865}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 89   and name HB2 ))
      2.700     0.900     0.900 peak   865 spectrum    1 weight  0.10000E+01 volume  0.23444E-02 ppm1      8.189 ppm2      2.053 CV     1
 ASSI {  868}
   (( segid "    " and resid 89   and name H   ))
   (  segid "    " and resid 88   and name HD% )
      3.100     1.200     1.200 peak   868 spectrum    1 weight  0.10000E+01 volume  0.70881E-03 ppm1      8.189 ppm2      7.052 CV     1
 ASSI {  870}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 87   and name HA  ))
      3.700     1.700     1.700 peak   870 spectrum    1 weight  0.10000E+01 volume  0.66295E-03 ppm1      7.905 ppm2      4.270 CV     1
 ASSI {  871}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 89   and name HB3 ))
      4.000     2.000     2.000 peak   871 spectrum    1 weight  0.10000E+01 volume  0.11657E-02 ppm1      7.923 ppm2      2.160 CV     1
 ASSI {  872}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 89   and name HB2 ))
      3.000     1.100     1.100 peak   872 spectrum    1 weight  0.10000E+01 volume  0.11612E-02 ppm1      7.923 ppm2      2.047 CV     1
 ASSI {  873}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 90   and name HB2 ))
      2.400     0.700     0.700 peak   873 spectrum    1 weight  0.10000E+01 volume  0.32724E-02 ppm1      7.912 ppm2      1.776 CV     1
 ASSI {  875}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 91   and name H   ))
      2.800     1.000     1.000 peak   875 spectrum    1 weight  0.10000E+01 volume  0.15912E-02 ppm1      7.922 ppm2      7.750 CV     1
 ASSI {  876}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 89   and name H   ))
      2.600     0.900     0.900 peak   876 spectrum    1 weight  0.10000E+01 volume  0.20266E-02 ppm1      7.905 ppm2      8.176 CV     1
 ASSI {  878}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 91   and name HB2 ))
      3.000     1.100     1.100 peak   878 spectrum    1 weight  0.10000E+01 volume  0.95533E-03 ppm1      7.750 ppm2      3.385 CV     1
 ASSI {  879}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 91   and name HB3 ))
      4.000     2.000     2.000 peak   879 spectrum    1 weight  0.10000E+01 volume  0.13481E-02 ppm1      7.746 ppm2      2.664 CV     1
 ASSI {  881}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 90   and name HB2 ))
      3.100     1.200     1.200 peak   881 spectrum    1 weight  0.10000E+01 volume  0.13351E-02 ppm1      7.745 ppm2      1.770 CV     1
 ASSI {  885}
   (( segid "    " and resid 91   and name H   ))
   (  segid "    " and resid 91   and name HD% )
      2.800     1.000     1.000 peak   885 spectrum    1 weight  0.10000E+01 volume  0.27561E-02 ppm1      7.749 ppm2      7.103 CV     1
 ASSI {  886}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 91   and name HA  ))
      3.200     1.300     1.300 peak   886 spectrum    1 weight  0.10000E+01 volume  0.13511E-02 ppm1      7.747 ppm2      4.814 CV     1
 ASSI {  889}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 92   and name HA  ))
      2.600     0.900     0.900 peak   889 spectrum    1 weight  0.10000E+01 volume  0.27424E-02 ppm1      7.845 ppm2      3.600 CV     1
 ASSI {  890}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 92   and name HD3 ))
      4.300     2.300     1.700 peak   890 spectrum    1 weight  0.10000E+01 volume  0.91550E-03 ppm1      7.849 ppm2      3.015 CV     1
 ASSI {  891}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 92   and name HD2 ))
      4.400     2.400     1.600 peak   891 spectrum    1 weight  0.10000E+01 volume  0.10761E-02 ppm1      7.844 ppm2      2.905 CV     1
 ASSI {  892}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 92   and name HG3 ))
      3.100     1.200     1.200 peak   892 spectrum    1 weight  0.10000E+01 volume  0.46366E-02 ppm1      7.845 ppm2      1.521 CV     1
 OR {  892}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 92   and name HB2 ))
 ASSI {  893}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 92   and name HG2 ))
      2.400     0.700     0.700 peak   893 spectrum    1 weight  0.10000E+01 volume  0.20725E-02 ppm1      7.848 ppm2      1.238 CV     1
 ASSI {  894}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 92   and name HB3 ))
      2.500     0.800     0.800 peak   894 spectrum    1 weight  0.10000E+01 volume  0.36528E-02 ppm1      7.844 ppm2      1.083 CV     1
 ASSI {  895}
   (( segid "    " and resid 92   and name H   ))
   (  segid "    " and resid 97   and name HG2%)
      2.800     1.000     1.000 peak   895 spectrum    1 weight  0.10000E+01 volume  0.37980E-02 ppm1      7.846 ppm2      1.032 CV     1
 OR {  895}
   (( segid "    " and resid 92   and name H   ))
   (  segid "    " and resid 97   and name HG1%)
 ASSI {  896}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 93   and name HA  ))
      4.400     2.400     1.600 peak   896 spectrum    1 weight  0.10000E+01 volume  0.99016E-03 ppm1      7.846 ppm2      4.926 CV     1
 ASSI {  898}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 91   and name HA  ))
      3.600     1.600     1.600 peak   898 spectrum    1 weight  0.10000E+01 volume  0.56668E-03 ppm1      7.847 ppm2      4.802 CV     1
 ASSI {  899}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 93   and name H   ))
      2.800     1.000     1.000 peak   899 spectrum    1 weight  0.10000E+01 volume  0.16241E-02 ppm1      7.847 ppm2      8.378 CV     1
 ASSI {  900}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 92   and name HA  ))
      3.300     1.400     1.400 peak   900 spectrum    1 weight  0.10000E+01 volume  0.10135E-02 ppm1      8.386 ppm2      3.604 CV     1
 ASSI {  902}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 93   and name HB2 ))
      2.600     0.900     0.900 peak   902 spectrum    1 weight  0.10000E+01 volume  0.34671E-02 ppm1      8.381 ppm2      2.850 CV     1
 ASSI {  903}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 93   and name HB3 ))
      3.000     1.100     1.100 peak   903 spectrum    1 weight  0.10000E+01 volume  0.37941E-02 ppm1      8.382 ppm2      2.471 CV     1
 ASSI {  904}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 92   and name HG3 ))
      3.100     1.200     1.200 peak   904 spectrum    1 weight  0.10000E+01 volume  0.20075E-02 ppm1      8.381 ppm2      1.518 CV     1
 OR {  904}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 92   and name HB2 ))
 ASSI {  905}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 92   and name HG2 ))
      3.500     1.500     1.500 peak   905 spectrum    1 weight  0.10000E+01 volume  0.90754E-03 ppm1      8.376 ppm2      1.283 CV     1
 ASSI {  906}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 92   and name HB3 ))
      3.700     1.700     1.700 peak   906 spectrum    1 weight  0.10000E+01 volume  0.17388E-02 ppm1      8.381 ppm2      1.081 CV     1
 ASSI {  908}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 93   and name HA  ))
      2.800     1.000     1.000 peak   908 spectrum    1 weight  0.10000E+01 volume  0.31974E-02 ppm1      8.381 ppm2      4.931 CV     1
 ASSI {  909}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 91   and name HA  ))
      3.000     1.100     1.100 peak   909 spectrum    1 weight  0.10000E+01 volume  0.19511E-02 ppm1      8.383 ppm2      4.807 CV     1
 ASSI {  910}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 94   and name HA  ))
      3.000     1.100     1.100 peak   910 spectrum    1 weight  0.10000E+01 volume  0.23741E-02 ppm1      7.830 ppm2      4.537 CV     1
 ASSI {  911}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 94   and name HB3 ))
      3.100     1.200     1.200 peak   911 spectrum    1 weight  0.10000E+01 volume  0.17093E-02 ppm1      7.831 ppm2      4.178 CV     1
 ASSI {  912}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 94   and name HB2 ))
      3.000     1.100     1.100 peak   912 spectrum    1 weight  0.10000E+01 volume  0.22974E-02 ppm1      7.829 ppm2      4.012 CV     1
 ASSI {  914}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 93   and name HB2 ))
      3.500     1.600     1.600 peak   914 spectrum    1 weight  0.10000E+01 volume  0.13197E-02 ppm1      7.835 ppm2      2.845 CV     1
 ASSI {  915}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 93   and name HB3 ))
      3.800     1.800     1.800 peak   915 spectrum    1 weight  0.10000E+01 volume  0.10245E-02 ppm1      7.834 ppm2      2.473 CV     1
 ASSI {  916}
   (( segid "    " and resid 94   and name H   ))
   (  segid "    " and resid 97   and name HG2%)
      3.600     1.600     1.600 peak   916 spectrum    1 weight  0.10000E+01 volume  0.19046E-02 ppm1      7.829 ppm2      1.016 CV     1
 OR {  916}
   (( segid "    " and resid 94   and name H   ))
   (  segid "    " and resid 97   and name HG1%)
 ASSI {  918}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 93   and name HA  ))
      3.100     1.200     1.200 peak   918 spectrum    1 weight  0.10000E+01 volume  0.25372E-02 ppm1      7.830 ppm2      4.925 CV     1
 ASSI {  919}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 91   and name HA  ))
      3.000     1.100     1.100 peak   919 spectrum    1 weight  0.10000E+01 volume  0.33221E-02 ppm1      7.829 ppm2      4.806 CV     1
 ASSI {  920}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 95   and name H   ))
      4.400     2.400     1.600 peak   920 spectrum    1 weight  0.10000E+01 volume  0.72520E-03 ppm1      7.836 ppm2      8.707 CV     1
 ASSI {  921}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 93   and name H   ))
      2.600     0.800     0.800 peak   921 spectrum    1 weight  0.10000E+01 volume  0.45239E-02 ppm1      7.830 ppm2      8.381 CV     1
 ASSI {  923}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 94   and name HB3 ))
      3.900     1.900     1.900 peak   923 spectrum    1 weight  0.10000E+01 volume  0.61078E-03 ppm1      8.708 ppm2      4.175 CV     1
 ASSI {  924}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 95   and name HB2 ))
      3.100     1.200     1.200 peak   924 spectrum    1 weight  0.10000E+01 volume  0.17627E-02 ppm1      8.709 ppm2      2.789 CV     1
 OR {  924}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 95   and name HB3 ))
 ASSI {  925}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 96   and name H   ))
      3.300     1.400     1.400 peak   925 spectrum    1 weight  0.10000E+01 volume  0.11606E-02 ppm1      8.712 ppm2      7.855 CV     1
 ASSI {  927}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 95   and name HB2 ))
      3.100     1.200     1.200 peak   927 spectrum    1 weight  0.10000E+01 volume  0.24683E-02 ppm1      7.876 ppm2      2.797 CV     1
 OR {  927}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 95   and name HB3 ))
 ASSI {  928}
   (( segid "    " and resid 96   and name H   ))
   (  segid "    " and resid 97   and name HG1%)
      3.800     1.800     1.800 peak   928 spectrum    1 weight  0.10000E+01 volume  0.22819E-02 ppm1      7.877 ppm2      1.030 CV     1
 OR {  928}
   (( segid "    " and resid 96   and name H   ))
   (  segid "    " and resid 97   and name HG2%)
 ASSI {  929}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 96   and name HB3 ))
      2.800     1.000     1.000 peak   929 spectrum    1 weight  0.10000E+01 volume  0.38904E-02 ppm1      7.878 ppm2      2.565 CV     1
 OR {  929}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 96   and name HB2 ))
 ASSI {  930}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 100  and name HD2 ))
      3.500     1.500     1.500 peak   930 spectrum    1 weight  0.10000E+01 volume  0.12352E-02 ppm1      7.878 ppm2      7.085 CV     1
 ASSI {  931}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 97   and name H   ))
      3.100     1.200     1.200 peak   931 spectrum    1 weight  0.10000E+01 volume  0.29223E-02 ppm1      7.877 ppm2      8.654 CV     1
 ASSI {  932}
   (( segid "    " and resid 97   and name H   ))
   (( segid "    " and resid 97   and name HA  ))
      3.100     1.200     1.200 peak   932 spectrum    1 weight  0.10000E+01 volume  0.12055E-02 ppm1      8.640 ppm2      3.665 CV     1
 ASSI {  933}
   (( segid "    " and resid 97   and name H   ))
   (( segid "    " and resid 96   and name HB2 ))
      4.500     2.500     1.500 peak   933 spectrum    1 weight  0.10000E+01 volume  0.70462E-03 ppm1      8.631 ppm2      2.557 CV     1
 OR {  933}
   (( segid "    " and resid 97   and name H   ))
   (( segid "    " and resid 96   and name HB3 ))
 ASSI {  934}
   (( segid "    " and resid 97   and name H   ))
   (( segid "    " and resid 97   and name HB  ))
      2.900     1.000     1.000 peak   934 spectrum    1 weight  0.10000E+01 volume  0.14315E-02 ppm1      8.642 ppm2      2.207 CV     1
 ASSI {  935}
   (( segid "    " and resid 97   and name H   ))
   (  segid "    " and resid 97   and name HG1%)
      2.500     0.800     0.800 peak   935 spectrum    1 weight  0.10000E+01 volume  0.38871E-02 ppm1      8.638 ppm2      1.016 CV     1
 ASSI {  937}
   (( segid "    " and resid 98   and name H   ))
   (( segid "    " and resid 97   and name HB  ))
      3.900     1.900     1.900 peak   937 spectrum    1 weight  0.10000E+01 volume  0.11575E-02 ppm1      8.576 ppm2      2.203 CV     1
 ASSI {  938}
   (( segid "    " and resid 98   and name H   ))
   (( segid "    " and resid 98   and name HB2 ))
      2.400     0.700     0.700 peak   938 spectrum    1 weight  0.10000E+01 volume  0.18009E-02 ppm1      8.578 ppm2      1.433 CV     1
 ASSI {  939}
   (( segid "    " and resid 98   and name H   ))
   (  segid "    " and resid 97   and name HG1%)
      2.400     0.700     0.700 peak   939 spectrum    1 weight  0.10000E+01 volume  0.41040E-02 ppm1      8.578 ppm2      1.009 CV     1
 OR {  939}
   (( segid "    " and resid 98   and name H   ))
   (  segid "    " and resid 97   and name HG2%)
 ASSI {  941}
   (( segid "    " and resid 98   and name H   ))
   (( segid "    " and resid 96   and name HA  ))
      4.100     2.100     1.900 peak   941 spectrum    1 weight  0.10000E+01 volume  0.55397E-03 ppm1      8.586 ppm2      4.804 CV     1
 ASSI {  942}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 99   and name HA3 ))
      2.400     0.800     0.800 peak   942 spectrum    1 weight  0.10000E+01 volume  0.37887E-02 ppm1      7.847 ppm2      3.623 CV     1
 ASSI {  945}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 98   and name HB3 ))
      3.200     1.300     1.300 peak   945 spectrum    1 weight  0.10000E+01 volume  0.15091E-02 ppm1      7.848 ppm2      1.826 CV     1
 ASSI {  947}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 99   and name HA2 ))
      2.600     0.800     0.800 peak   947 spectrum    1 weight  0.10000E+01 volume  0.68013E-02 ppm1      7.840 ppm2      3.814 CV     1
 ASSI {  949}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 98   and name HB2 ))
      2.900     1.000     1.000 peak   949 spectrum    1 weight  0.10000E+01 volume  0.24720E-02 ppm1      7.842 ppm2      1.436 CV     1
 ASSI {  951}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 96   and name HA  ))
      3.700     1.700     1.700 peak   951 spectrum    1 weight  0.10000E+01 volume  0.71297E-03 ppm1      7.846 ppm2      4.803 CV     1
 ASSI {  952}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 98   and name H   ))
      2.500     0.800     0.800 peak   952 spectrum    1 weight  0.10000E+01 volume  0.25182E-02 ppm1      7.846 ppm2      8.584 CV     1
 ASSI {  953}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 96   and name HB2 ))
      3.800     1.800     1.800 peak   953 spectrum    1 weight  0.10000E+01 volume  0.81283E-03 ppm1      7.756 ppm2      2.524 CV     1
 ASSI {  957}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 100  and name HB2 ))
      2.300     0.700     0.700 peak   957 spectrum    1 weight  0.10000E+01 volume  0.42918E-02 ppm1      7.753 ppm2      2.275 CV     1
 ASSI {  961}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 100  and name HD2 ))
      3.000     1.100     1.100 peak   961 spectrum    1 weight  0.10000E+01 volume  0.20599E-02 ppm1      7.747 ppm2      7.084 CV     1
 ASSI {  963}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 101  and name H   ))
      2.600     0.800     0.800 peak   963 spectrum    1 weight  0.10000E+01 volume  0.22240E-02 ppm1      7.749 ppm2      8.307 CV     1
 ASSI {  965}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 101  and name HB  ))
      2.600     0.900     0.900 peak   965 spectrum    1 weight  0.10000E+01 volume  0.19111E-02 ppm1      8.308 ppm2      2.068 CV     1
 ASSI {  967}
   (( segid "    " and resid 102  and name H   ))
   (( segid "    " and resid 101  and name H   ))
      3.300     1.400     1.400 peak   967 spectrum    1 weight  0.10000E+01 volume  0.60248E-03 ppm1      8.593 ppm2      8.303 CV     1
 ASSI {  968}
   (( segid "    " and resid 102  and name H   ))
   (( segid "    " and resid 103  and name H   ))
      3.000     1.100     1.100 peak   968 spectrum    1 weight  0.10000E+01 volume  0.11680E-02 ppm1      8.594 ppm2      7.480 CV     1
 ASSI {  969}
   (( segid "    " and resid 103  and name H   ))
   (( segid "    " and resid 103  and name HA  ))
      2.900     1.100     1.100 peak   969 spectrum    1 weight  0.10000E+01 volume  0.22089E-02 ppm1      7.471 ppm2      4.158 CV     1
 ASSI {  970}
   (( segid "    " and resid 103  and name H   ))
   (( segid "    " and resid 102  and name HA  ))
      3.300     1.400     1.400 peak   970 spectrum    1 weight  0.10000E+01 volume  0.13013E-02 ppm1      7.473 ppm2      4.045 CV     1
 ASSI {  971}
   (( segid "    " and resid 103  and name H   ))
   (( segid "    " and resid 100  and name HA  ))
      3.200     1.300     1.300 peak   971 spectrum    1 weight  0.10000E+01 volume  0.12835E-02 ppm1      7.475 ppm2      3.974 CV     1
 ASSI {  972}
   (( segid "    " and resid 103  and name H   ))
   (( segid "    " and resid 102  and name HB3 ))
      3.700     1.700     1.700 peak   972 spectrum    1 weight  0.10000E+01 volume  0.15248E-02 ppm1      7.475 ppm2      2.166 CV     1
 ASSI {  973}
   (( segid "    " and resid 103  and name H   ))
   (( segid "    " and resid 102  and name HB2 ))
      2.900     1.000     1.000 peak   973 spectrum    1 weight  0.10000E+01 volume  0.13257E-02 ppm1      7.468 ppm2      2.111 CV     1
 ASSI {  975}
   (( segid "    " and resid 103  and name H   ))
   (( segid "    " and resid 103  and name HG3 ))
      3.000     1.100     1.100 peak   975 spectrum    1 weight  0.10000E+01 volume  0.22066E-02 ppm1      7.470 ppm2      1.449 CV     1
 OR {  975}
   (( segid "    " and resid 103  and name H   ))
   (( segid "    " and resid 103  and name HG2 ))
 ASSI {  979}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 103  and name HA  ))
      3.800     1.800     1.800 peak   979 spectrum    1 weight  0.10000E+01 volume  0.58888E-03 ppm1      7.375 ppm2      4.165 CV     1
 ASSI {  980}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 104  and name HB3 ))
      4.000     2.000     2.000 peak   980 spectrum    1 weight  0.10000E+01 volume  0.11285E-02 ppm1      7.374 ppm2      2.901 CV     1
 ASSI {  981}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 104  and name HB2 ))
      2.900     1.000     1.000 peak   981 spectrum    1 weight  0.10000E+01 volume  0.13286E-02 ppm1      7.370 ppm2      2.619 CV     1
 ASSI {  982}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 103  and name HB3 ))
      3.400     1.400     1.400 peak   982 spectrum    1 weight  0.10000E+01 volume  0.13305E-02 ppm1      7.371 ppm2      1.816 CV     1
 OR {  982}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 103  and name HB2 ))
 ASSI {  984}
   (( segid "    " and resid 104  and name H   ))
   (  segid "    " and resid 105  and name HG2%)
      3.600     1.600     1.600 peak   984 spectrum    1 weight  0.10000E+01 volume  0.23252E-02 ppm1      7.371 ppm2      1.040 CV     1
 OR {  984}
   (( segid "    " and resid 104  and name H   ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI {  985}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 104  and name HA  ))
      3.300     1.400     1.400 peak   985 spectrum    1 weight  0.10000E+01 volume  0.11440E-02 ppm1      7.372 ppm2      4.822 CV     1
 ASSI {  986}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 105  and name H   ))
      2.700     0.900     0.900 peak   986 spectrum    1 weight  0.10000E+01 volume  0.21835E-02 ppm1      7.372 ppm2      8.078 CV     1
 ASSI {  987}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 100  and name H   ))
      2.500     2.500     3.500 peak   987 spectrum    1 weight  0.10000E+01 volume  0.72663E-03 ppm1      7.372 ppm2      7.760 CV     1
 ASSI {  988}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 103  and name H   ))
      2.700     0.900     0.900 peak   988 spectrum    1 weight  0.10000E+01 volume  0.22894E-02 ppm1      7.370 ppm2      7.484 CV     1
 ASSI {  989}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 105  and name HA  ))
      3.100     1.200     1.200 peak   989 spectrum    1 weight  0.10000E+01 volume  0.12349E-02 ppm1      8.083 ppm2      4.216 CV     1
 ASSI {  991}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 105  and name HB  ))
      2.700     0.900     0.900 peak   991 spectrum    1 weight  0.10000E+01 volume  0.23958E-02 ppm1      8.083 ppm2      1.960 CV     1
 ASSI {  992}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 105  and name HG13))
      4.000     2.000     2.000 peak   992 spectrum    1 weight  0.10000E+01 volume  0.10366E-02 ppm1      8.089 ppm2      1.426 CV     1
 ASSI {  994}
   (( segid "    " and resid 105  and name H   ))
   (  segid "    " and resid 105  and name HG2%)
      2.500     0.800     0.800 peak   994 spectrum    1 weight  0.10000E+01 volume  0.57699E-02 ppm1      8.080 ppm2      1.033 CV     1
 OR {  994}
   (( segid "    " and resid 105  and name H   ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI {  996}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 104  and name HA  ))
      3.600     1.600     1.600 peak   996 spectrum    1 weight  0.10000E+01 volume  0.71942E-03 ppm1      8.090 ppm2      4.814 CV     1
 ASSI {  997}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 106  and name HB  ))
      2.900     1.100     1.100 peak   997 spectrum    1 weight  0.10000E+01 volume  0.10099E-02 ppm1      9.158 ppm2      4.375 CV     1
 ASSI {  998}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 105  and name HA  ))
      2.700     0.900     0.900 peak   998 spectrum    1 weight  0.10000E+01 volume  0.14212E-02 ppm1      9.165 ppm2      4.230 CV     1
 ASSI { 1000}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 105  and name HG12))
      2.900     1.100     1.100 peak  1000 spectrum    1 weight  0.10000E+01 volume  0.56137E-03 ppm1      9.169 ppm2      1.565 CV     1
 ASSI { 1001}
   (( segid "    " and resid 106  and name H   ))
   (( segid "    " and resid 105  and name HG13))
      3.400     1.500     1.500 peak  1001 spectrum    1 weight  0.10000E+01 volume  0.86803E-03 ppm1      9.163 ppm2      1.386 CV     1
 ASSI { 1003}
   (( segid "    " and resid 106  and name H   ))
   (  segid "    " and resid 105  and name HG2%)
      3.700     1.800     1.800 peak  1003 spectrum    1 weight  0.10000E+01 volume  0.17500E-02 ppm1      9.160 ppm2      1.047 CV     1
 OR { 1003}
   (( segid "    " and resid 106  and name H   ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI { 1005}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 107  and name HA  ))
      2.400     0.700     0.700 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.40224E-02 ppm1      7.635 ppm2      4.461 CV     1
 ASSI { 1006}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 106  and name HB  ))
      3.000     1.100     1.100 peak  1006 spectrum    1 weight  0.10000E+01 volume  0.47342E-02 ppm1      7.636 ppm2      4.382 CV     1
 ASSI { 1007}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 105  and name HA  ))
      4.000     2.000     2.000 peak  1007 spectrum    1 weight  0.10000E+01 volume  0.17127E-02 ppm1      7.636 ppm2      4.235 CV     1
 ASSI { 1008}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 106  and name HA  ))
      2.900     1.000     1.000 peak  1008 spectrum    1 weight  0.10000E+01 volume  0.29812E-02 ppm1      7.635 ppm2      4.069 CV     1
 ASSI { 1009}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 105  and name HB  ))
      4.800     2.800     1.200 peak  1009 spectrum    1 weight  0.10000E+01 volume  0.68308E-03 ppm1      7.636 ppm2      1.950 CV     1
 ASSI { 1010}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 105  and name HG12))
      1.700     0.400     0.500 peak  1010 spectrum    1 weight  0.10000E+01 volume  0.15161E-02 ppm1      7.635 ppm2      1.588 CV     1
 ASSI { 1011}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 105  and name HG13))
      3.300     1.300     1.300 peak  1011 spectrum    1 weight  0.10000E+01 volume  0.32527E-02 ppm1      7.635 ppm2      1.391 CV     1
 ASSI { 1012}
   (( segid "    " and resid 107  and name H   ))
   (  segid "    " and resid 107  and name HB% )
      2.100     0.500     0.500 peak  1012 spectrum    1 weight  0.10000E+01 volume  0.87201E-02 ppm1      7.635 ppm2      1.142 CV     1
 ASSI { 1013}
   (( segid "    " and resid 107  and name H   ))
   (  segid "    " and resid 105  and name HG2%)
      2.600     0.800     0.800 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.73002E-02 ppm1      7.636 ppm2      1.072 CV     1
 OR { 1013}
   (( segid "    " and resid 107  and name H   ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI { 1014}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 106  and name H   ))
      2.400     0.700     0.700 peak  1014 spectrum    1 weight  0.10000E+01 volume  0.25338E-02 ppm1      7.636 ppm2      9.168 CV     1
 ASSI { 1015}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 108  and name H   ))
      3.600     1.600     1.600 peak  1015 spectrum    1 weight  0.10000E+01 volume  0.14537E-02 ppm1      7.634 ppm2      8.194 CV     1
 ASSI { 1017}
   (( segid "    " and resid 108  and name H   ))
   (( segid "    " and resid 107  and name HA  ))
      2.300     0.600     0.600 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.72196E-02 ppm1      8.191 ppm2      4.465 CV     1
 ASSI { 1018}
   (( segid "    " and resid 108  and name H   ))
   (( segid "    " and resid 108  and name HA  ))
      2.700     0.900     0.900 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.30129E-02 ppm1      8.190 ppm2      4.081 CV     1
 ASSI { 1019}
   (( segid "    " and resid 108  and name H   ))
   (( segid "    " and resid 108  and name HB2 ))
      2.400     0.700     0.700 peak  1019 spectrum    1 weight  0.10000E+01 volume  0.76911E-02 ppm1      8.191 ppm2      1.730 CV     1
 OR { 1019}
   (( segid "    " and resid 108  and name H   ))
   (( segid "    " and resid 108  and name HB3 ))
 ASSI { 1020}
   (( segid "    " and resid 108  and name H   ))
   (( segid "    " and resid 108  and name HG2 ))
      2.600     0.900     0.900 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.48215E-02 ppm1      8.190 ppm2      1.411 CV     1
 OR { 1020}
   (( segid "    " and resid 108  and name H   ))
   (( segid "    " and resid 108  and name HG3 ))
 ASSI { 1021}
   (( segid "    " and resid 108  and name H   ))
   (  segid "    " and resid 107  and name HB% )
      3.000     1.100     1.100 peak  1021 spectrum    1 weight  0.10000E+01 volume  0.40046E-02 ppm1      8.192 ppm2      1.160 CV     1
 ASSI { 1022}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 108  and name HA  ))
      2.200     0.600     0.600 peak  1022 spectrum    1 weight  0.10000E+01 volume  0.78637E-02 ppm1      7.638 ppm2      4.084 CV     1
 ASSI { 1024}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 109  and name HB3 ))
      2.600     0.900     0.900 peak  1024 spectrum    1 weight  0.10000E+01 volume  0.49745E-02 ppm1      7.639 ppm2      1.472 CV     1
 OR { 1024}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 109  and name HG3 ))
 ASSI { 1025}
   (( segid "    " and resid 109  and name H   ))
   (  segid "    " and resid 107  and name HB% )
      3.100     1.200     1.200 peak  1025 spectrum    1 weight  0.10000E+01 volume  0.22062E-02 ppm1      7.638 ppm2      1.119 CV     1
 ASSI { 1026}
   (( segid "    " and resid 109  and name H   ))
   (  segid "    " and resid 105  and name HG2%)
      2.800     1.000     1.000 peak  1026 spectrum    1 weight  0.10000E+01 volume  0.32400E-02 ppm1      7.639 ppm2      1.044 CV     1
 OR { 1026}
   (( segid "    " and resid 109  and name H   ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI { 1027}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 109  and name HA  ))
      3.000     1.200     1.200 peak  1027 spectrum    1 weight  0.10000E+01 volume  0.16736E-02 ppm1      7.640 ppm2      4.619 CV     1
 ASSI { 1028}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 110  and name H   ))
      4.200     2.200     1.800 peak  1028 spectrum    1 weight  0.10000E+01 volume  0.66623E-03 ppm1      7.642 ppm2      8.381 CV     1
 ASSI { 1029}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 108  and name H   ))
      3.800     1.800     1.800 peak  1029 spectrum    1 weight  0.10000E+01 volume  0.12950E-02 ppm1      7.636 ppm2      8.192 CV     1
 ASSI { 1030}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 110  and name HB2 ))
      3.200     1.300     1.300 peak  1030 spectrum    1 weight  0.10000E+01 volume  0.15400E-02 ppm1      8.375 ppm2      4.311 CV     1
 ASSI { 1033}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 109  and name HA  ))
      2.700     0.900     0.900 peak  1033 spectrum    1 weight  0.10000E+01 volume  0.30840E-02 ppm1      8.376 ppm2      4.616 CV     1
 ASSI { 1034}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 110  and name HA  ))
      3.000     1.100     1.100 peak  1034 spectrum    1 weight  0.10000E+01 volume  0.20421E-02 ppm1      8.378 ppm2      4.461 CV     1
 ASSI { 1035}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 110  and name HB3 ))
      3.200     1.300     1.300 peak  1035 spectrum    1 weight  0.10000E+01 volume  0.14456E-02 ppm1      8.376 ppm2      4.001 CV     1
 ASSI { 1036}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 113  and name HB3 ))
      3.300     1.300     1.300 peak  1036 spectrum    1 weight  0.10000E+01 volume  0.11057E-02 ppm1      8.374 ppm2      2.182 CV     1
 OR { 1036}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 113  and name HB2 ))
 ASSI { 1037}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 74   and name HB  ))
      3.900     3.900     2.100 peak  1037 spectrum    1 weight  0.10000E+01 volume  0.89199E-03 ppm1      8.379 ppm2      2.048 CV     1
 ASSI { 1039}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 109  and name HB2 ))
      3.100     1.200     1.200 peak  1039 spectrum    1 weight  0.10000E+01 volume  0.17043E-02 ppm1      8.374 ppm2      1.797 CV     1
 ASSI { 1040}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 109  and name HB3 ))
      3.100     1.200     1.200 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.19532E-02 ppm1      8.376 ppm2      1.461 CV     1
 OR { 1040}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 109  and name HG3 ))
 ASSI { 1042}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 113  and name H   ))
      4.100     2.100     1.900 peak  1042 spectrum    1 weight  0.10000E+01 volume  0.44082E-03 ppm1      8.373 ppm2      7.546 CV     1
 ASSI { 1043}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 127  and name HA  ))
      3.400     1.500     1.500 peak  1043 spectrum    1 weight  0.10000E+01 volume  0.49311E-03 ppm1      9.025 ppm2      3.766 CV     1
 ASSI { 1045}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 111  and name HG3 ))
      3.200     1.300     1.300 peak  1045 spectrum    1 weight  0.10000E+01 volume  0.84779E-03 ppm1      9.023 ppm2      1.618 CV     1
 ASSI { 1046}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 110  and name HA  ))
      2.900     1.000     1.000 peak  1046 spectrum    1 weight  0.10000E+01 volume  0.16500E-02 ppm1      9.007 ppm2      4.444 CV     1
 ASSI { 1047}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 110  and name HB2 ))
      3.900     1.900     1.900 peak  1047 spectrum    1 weight  0.10000E+01 volume  0.97077E-03 ppm1      9.007 ppm2      4.315 CV     1
 ASSI { 1050}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 111  and name HB3 ))
      2.800     1.000     1.000 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.21779E-02 ppm1      9.009 ppm2      1.903 CV     1
 OR { 1050}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 111  and name HB2 ))
 ASSI { 1054}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 112  and name HA  ))
      2.800     1.000     1.000 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.22894E-02 ppm1      8.526 ppm2      4.042 CV     1
 ASSI { 1055}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 111  and name HB3 ))
      2.900     1.000     1.000 peak  1055 spectrum    1 weight  0.10000E+01 volume  0.20545E-02 ppm1      8.529 ppm2      1.891 CV     1
 OR { 1055}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 111  and name HB2 ))
 ASSI { 1056}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 111  and name HG2 ))
      3.900     1.900     1.900 peak  1056 spectrum    1 weight  0.10000E+01 volume  0.12502E-02 ppm1      8.521 ppm2      1.766 CV     1
 ASSI { 1057}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 111  and name HG3 ))
      4.100     2.100     1.900 peak  1057 spectrum    1 weight  0.10000E+01 volume  0.86237E-03 ppm1      8.526 ppm2      1.616 CV     1
 ASSI { 1060}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 111  and name H   ))
      3.300     1.400     1.400 peak  1060 spectrum    1 weight  0.10000E+01 volume  0.77936E-03 ppm1      8.525 ppm2      9.007 CV     1
 ASSI { 1063}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 113  and name HB2 ))
      2.900     1.000     1.000 peak  1063 spectrum    1 weight  0.10000E+01 volume  0.20353E-02 ppm1      7.552 ppm2      2.217 CV     1
 OR { 1063}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 113  and name HB3 ))
 ASSI { 1064}
   (( segid "    " and resid 113  and name H   ))
   (  segid "    " and resid 102  and name HE% )
      3.600     1.600     1.600 peak  1064 spectrum    1 weight  0.10000E+01 volume  0.15246E-02 ppm1      7.553 ppm2      2.111 CV     1
 ASSI { 1065}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 113  and name HG2 ))
      3.400     1.500     1.500 peak  1065 spectrum    1 weight  0.10000E+01 volume  0.25244E-02 ppm1      7.552 ppm2      1.925 CV     1
 OR { 1065}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 113  and name HG3 ))
 ASSI { 1068}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 112  and name H   ))
      3.100     1.200     1.200 peak  1068 spectrum    1 weight  0.10000E+01 volume  0.13040E-02 ppm1      7.552 ppm2      8.534 CV     1
 ASSI { 1069}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 114  and name H   ))
      2.800     1.000     1.000 peak  1069 spectrum    1 weight  0.10000E+01 volume  0.18473E-02 ppm1      7.554 ppm2      8.107 CV     1
 ASSI { 1071}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 111  and name HA  ))
      3.300     1.300     1.300 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.93804E-03 ppm1      8.100 ppm2      3.999 CV     1
 ASSI { 1072}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 114  and name HA  ))
      3.300     1.300     1.300 peak  1072 spectrum    1 weight  0.10000E+01 volume  0.78877E-03 ppm1      8.102 ppm2      3.865 CV     1
 ASSI { 1075}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 115  and name H   ))
      3.100     1.200     1.200 peak  1075 spectrum    1 weight  0.10000E+01 volume  0.10596E-02 ppm1      8.099 ppm2      8.557 CV     1
 ASSI { 1076}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 115  and name HA  ))
      3.200     1.300     1.300 peak  1076 spectrum    1 weight  0.10000E+01 volume  0.72814E-03 ppm1      8.555 ppm2      3.347 CV     1
 ASSI { 1085}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 112  and name HA  ))
      4.000     2.000     2.000 peak  1085 spectrum    1 weight  0.10000E+01 volume  0.11893E-02 ppm1      8.125 ppm2      4.063 CV     1
 ASSI { 1086}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 115  and name HA  ))
      3.700     1.700     1.700 peak  1086 spectrum    1 weight  0.10000E+01 volume  0.45584E-03 ppm1      8.118 ppm2      3.354 CV     1
 ASSI { 1087}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 116  and name HB2 ))
      2.700     0.900     0.900 peak  1087 spectrum    1 weight  0.10000E+01 volume  0.22220E-02 ppm1      8.115 ppm2      2.810 CV     1
 ASSI { 1088}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 116  and name HB3 ))
      2.700     0.900     0.900 peak  1088 spectrum    1 weight  0.10000E+01 volume  0.20631E-02 ppm1      8.114 ppm2      2.673 CV     1
 ASSI { 1094}
   (( segid "    " and resid 116  and name H   ))
   (  segid "    " and resid 115  and name HG1%)
      4.000     2.000     2.000 peak  1094 spectrum    1 weight  0.10000E+01 volume  0.14001E-02 ppm1      8.113 ppm2      1.137 CV     1
 ASSI { 1095}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 117  and name H   ))
      2.900     1.000     1.000 peak  1095 spectrum    1 weight  0.10000E+01 volume  0.12701E-02 ppm1      8.113 ppm2      7.541 CV     1
 ASSI { 1096}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 115  and name H   ))
      2.900     1.000     1.000 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.13394E-02 ppm1      8.115 ppm2      8.561 CV     1
 ASSI { 1099}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 116  and name HB2 ))
      4.100     2.100     1.900 peak  1099 spectrum    1 weight  0.10000E+01 volume  0.87505E-03 ppm1      7.535 ppm2      2.793 CV     1
 ASSI { 1100}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 116  and name HB3 ))
      3.100     1.200     1.200 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.82829E-03 ppm1      7.540 ppm2      2.690 CV     1
 ASSI { 1103}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 114  and name HG12))
      4.100     2.100     1.900 peak  1103 spectrum    1 weight  0.10000E+01 volume  0.77800E-03 ppm1      7.537 ppm2      1.217 CV     1
 ASSI { 1108}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 117  and name HD3 ))
      3.500     1.600     1.600 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.15545E-02 ppm1      7.537 ppm2      0.596 CV     1
 ASSI { 1113}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 118  and name H   ))
      2.900     1.100     1.100 peak  1113 spectrum    1 weight  0.10000E+01 volume  0.11516E-02 ppm1      7.542 ppm2      8.406 CV     1
 ASSI { 1114}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 117  and name HA  ))
      3.600     1.600     1.600 peak  1114 spectrum    1 weight  0.10000E+01 volume  0.75555E-03 ppm1      8.412 ppm2      4.048 CV     1
 ASSI { 1115}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 118  and name HA  ))
      3.400     1.400     1.400 peak  1115 spectrum    1 weight  0.10000E+01 volume  0.51601E-03 ppm1      8.408 ppm2      3.660 CV     1
 ASSI { 1123}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 119  and name H   ))
      2.900     1.000     1.000 peak  1123 spectrum    1 weight  0.10000E+01 volume  0.10987E-02 ppm1      8.400 ppm2      7.881 CV     1
 ASSI { 1126}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 119  and name HA  ))
      2.800     1.000     1.000 peak  1126 spectrum    1 weight  0.10000E+01 volume  0.21120E-02 ppm1      7.883 ppm2      4.152 CV     1
 ASSI { 1127}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 118  and name HB2 ))
      3.200     1.300     1.300 peak  1127 spectrum    1 weight  0.10000E+01 volume  0.10266E-02 ppm1      7.889 ppm2      2.010 CV     1
 ASSI { 1128}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 119  and name HB2 ))
      2.400     0.700     0.700 peak  1128 spectrum    1 weight  0.10000E+01 volume  0.31758E-02 ppm1      7.892 ppm2      1.764 CV     1
 ASSI { 1134}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 120  and name H   ))
      2.600     0.900     0.900 peak  1134 spectrum    1 weight  0.10000E+01 volume  0.25114E-02 ppm1      7.883 ppm2      8.151 CV     1
 ASSI { 1135}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 120  and name HA  ))
      2.700     0.900     0.900 peak  1135 spectrum    1 weight  0.10000E+01 volume  0.40343E-02 ppm1      8.157 ppm2      4.052 CV     1
 ASSI { 1136}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 119  and name HB2 ))
      2.900     1.000     1.000 peak  1136 spectrum    1 weight  0.10000E+01 volume  0.21270E-02 ppm1      8.153 ppm2      1.748 CV     1
 ASSI { 1137}
   (( segid "    " and resid 120  and name H   ))
   (  segid "    " and resid 120  and name HB% )
      2.400     0.700     0.700 peak  1137 spectrum    1 weight  0.10000E+01 volume  0.65267E-02 ppm1      8.155 ppm2      1.456 CV     1
 ASSI { 1138}
   (( segid "    " and resid 120  and name H   ))
   (  segid "    " and resid 71   and name HG2%)
      4.100     2.100     1.900 peak  1138 spectrum    1 weight  0.10000E+01 volume  0.51568E-03 ppm1      8.158 ppm2      1.200 CV     1
 ASSI { 1139}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 123  and name HB2 ))
      4.100     2.100     1.900 peak  1139 spectrum    1 weight  0.10000E+01 volume  0.59717E-03 ppm1      8.150 ppm2      1.049 CV     1
 ASSI { 1143}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 118  and name H   ))
      3.600     1.600     1.600 peak  1143 spectrum    1 weight  0.10000E+01 volume  0.81636E-03 ppm1      8.157 ppm2      8.399 CV     1
 ASSI { 1145}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 120  and name HA  ))
      3.100     1.200     1.200 peak  1145 spectrum    1 weight  0.10000E+01 volume  0.22074E-02 ppm1      8.145 ppm2      4.051 CV     1
 ASSI { 1146}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 121  and name HG  ))
      2.300     0.700     0.700 peak  1146 spectrum    1 weight  0.10000E+01 volume  0.37957E-02 ppm1      8.147 ppm2      1.545 CV     1
 ASSI { 1148}
   (( segid "    " and resid 121  and name H   ))
   (  segid "    " and resid 121  and name HD1%)
      3.100     1.200     1.200 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.32232E-02 ppm1      8.146 ppm2      0.705 CV     1
 ASSI { 1149}
   (( segid "    " and resid 121  and name H   ))
   (  segid "    " and resid 121  and name HD2%)
      2.800     1.000     1.000 peak  1149 spectrum    1 weight  0.10000E+01 volume  0.31819E-02 ppm1      8.144 ppm2      0.615 CV     1
 ASSI { 1150}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 122  and name H   ))
      2.700     0.900     0.900 peak  1150 spectrum    1 weight  0.10000E+01 volume  0.18997E-02 ppm1      8.144 ppm2      7.842 CV     1
 ASSI { 1151}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 122  and name HA2 ))
      2.200     0.600     0.600 peak  1151 spectrum    1 weight  0.10000E+01 volume  0.69754E-02 ppm1      7.836 ppm2      4.005 CV     1
 ASSI { 1153}
   (( segid "    " and resid 122  and name H   ))
   (  segid "    " and resid 121  and name HD1%)
      3.900     1.900     1.900 peak  1153 spectrum    1 weight  0.10000E+01 volume  0.17456E-02 ppm1      7.837 ppm2      0.708 CV     1
 ASSI { 1155}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 123  and name H   ))
      2.700     0.900     0.900 peak  1155 spectrum    1 weight  0.10000E+01 volume  0.20716E-02 ppm1      7.838 ppm2      7.573 CV     1
 ASSI { 1156}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 124  and name H   ))
      4.000     2.000     2.000 peak  1156 spectrum    1 weight  0.10000E+01 volume  0.90268E-03 ppm1      7.837 ppm2      6.796 CV     1
 ASSI { 1160}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 122  and name HA3 ))
      3.900     1.900     1.900 peak  1160 spectrum    1 weight  0.10000E+01 volume  0.77283E-03 ppm1      7.582 ppm2      3.808 CV     1
 ASSI { 1162}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 123  and name HG  ))
      2.900     1.000     1.000 peak  1162 spectrum    1 weight  0.10000E+01 volume  0.14471E-02 ppm1      7.573 ppm2      1.370 CV     1
 ASSI { 1163}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 123  and name HB2 ))
      2.700     0.900     0.900 peak  1163 spectrum    1 weight  0.10000E+01 volume  0.94569E-03 ppm1      7.575 ppm2      1.057 CV     1
 ASSI { 1164}
   (( segid "    " and resid 123  and name H   ))
   (  segid "    " and resid 130  and name HD2%)
      4.600     2.600     1.400 peak  1164 spectrum    1 weight  0.10000E+01 volume  0.10369E-02 ppm1      7.585 ppm2      0.887 CV     1
 ASSI { 1166}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 123  and name HB3 ))
      3.300     1.400     1.400 peak  1166 spectrum    1 weight  0.10000E+01 volume  0.30523E-02 ppm1      7.578 ppm2      0.628 CV     1
 OR { 1166}
   (( segid "    " and resid 123  and name H   ))
   (  segid "    " and resid 123  and name HD2%)
 ASSI { 1172}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 124  and name HA  ))
      2.900     1.100     1.100 peak  1172 spectrum    1 weight  0.10000E+01 volume  0.19917E-02 ppm1      6.797 ppm2      4.276 CV     1
 ASSI { 1173}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 119  and name HA  ))
      3.000     1.100     1.100 peak  1173 spectrum    1 weight  0.10000E+01 volume  0.15647E-02 ppm1      6.799 ppm2      4.156 CV     1
 ASSI { 1177}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 123  and name HG  ))
      4.300     2.400     1.700 peak  1177 spectrum    1 weight  0.10000E+01 volume  0.77271E-03 ppm1      6.795 ppm2      1.366 CV     1
 ASSI { 1178}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 123  and name HB2 ))
      3.400     1.500     1.500 peak  1178 spectrum    1 weight  0.10000E+01 volume  0.87904E-03 ppm1      6.796 ppm2      1.040 CV     1
 ASSI { 1179}
   (( segid "    " and resid 124  and name H   ))
   (  segid "    " and resid 130  and name HD2%)
      4.400     2.400     1.600 peak  1179 spectrum    1 weight  0.10000E+01 volume  0.14534E-02 ppm1      6.800 ppm2      0.894 CV     1
 ASSI { 1181}
   (( segid "    " and resid 124  and name H   ))
   (  segid "    " and resid 118  and name HD2%)
      3.600     1.600     1.600 peak  1181 spectrum    1 weight  0.10000E+01 volume  0.24559E-02 ppm1      6.796 ppm2      0.716 CV     1
 ASSI { 1182}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 123  and name HB3 ))
      2.900     1.100     1.100 peak  1182 spectrum    1 weight  0.10000E+01 volume  0.35372E-02 ppm1      6.798 ppm2      0.597 CV     1
 ASSI { 1183}
   (( segid "    " and resid 124  and name H   ))
   (  segid "    " and resid 124  and name HG1%)
      2.400     0.700     0.700 peak  1183 spectrum    1 weight  0.10000E+01 volume  0.35692E-02 ppm1      6.798 ppm2      0.527 CV     1
 ASSI { 1186}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 123  and name H   ))
      2.600     0.800     0.800 peak  1186 spectrum    1 weight  0.10000E+01 volume  0.29601E-02 ppm1      6.799 ppm2      7.573 CV     1
 ASSI { 1189}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 124  and name HB  ))
      3.500     1.500     1.500 peak  1189 spectrum    1 weight  0.10000E+01 volume  0.24898E-02 ppm1      8.865 ppm2      1.898 CV     1
 ASSI { 1191}
   (( segid "    " and resid 125  and name H   ))
   (  segid "    " and resid 130  and name HD2%)
      4.900     3.000     1.100 peak  1191 spectrum    1 weight  0.10000E+01 volume  0.99683E-03 ppm1      8.865 ppm2      0.888 CV     1
 ASSI { 1194}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 126  and name H   ))
      2.300     0.600     0.600 peak  1194 spectrum    1 weight  0.10000E+01 volume  0.40080E-02 ppm1      8.864 ppm2      7.633 CV     1
 ASSI { 1195}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 124  and name H   ))
      4.100     2.100     1.900 peak  1195 spectrum    1 weight  0.10000E+01 volume  0.63250E-03 ppm1      8.864 ppm2      6.806 CV     1
 ASSI { 1196}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 126  and name HA  ))
      2.800     1.000     1.000 peak  1196 spectrum    1 weight  0.10000E+01 volume  0.15682E-02 ppm1      7.633 ppm2      4.572 CV     1
 ASSI { 1198}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 129  and name HG2 ))
      3.200     1.300     1.300 peak  1198 spectrum    1 weight  0.10000E+01 volume  0.14328E-02 ppm1      7.633 ppm2      2.381 CV     1
 OR { 1198}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 129  and name HG3 ))
 ASSI { 1202}
   (( segid "    " and resid 126  and name H   ))
   (  segid "    " and resid 130  and name HD2%)
      5.100     3.200     0.900 peak  1202 spectrum    1 weight  0.10000E+01 volume  0.71368E-03 ppm1      7.632 ppm2      0.890 CV     1
 ASSI { 1204}
   (( segid "    " and resid 126  and name H   ))
   (  segid "    " and resid 119  and name HD1%)
      3.800     1.800     1.800 peak  1204 spectrum    1 weight  0.10000E+01 volume  0.11075E-02 ppm1      7.632 ppm2      0.642 CV     1
 ASSI { 1205}
   (( segid "    " and resid 126  and name H   ))
   (  segid "    " and resid 124  and name HG1%)
      4.200     2.200     1.800 peak  1205 spectrum    1 weight  0.10000E+01 volume  0.11098E-02 ppm1      7.633 ppm2      0.525 CV     1
 ASSI { 1206}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 127  and name H   ))
      3.900     1.900     1.900 peak  1206 spectrum    1 weight  0.10000E+01 volume  0.77532E-03 ppm1      7.634 ppm2      9.023 CV     1
 ASSI { 1208}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 126  and name HG2 ))
      4.700     2.700     1.300 peak  1208 spectrum    1 weight  0.10000E+01 volume  0.65961E-03 ppm1      9.027 ppm2      2.298 CV     1
 ASSI { 1209}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 126  and name HA  ))
      3.000     1.100     1.100 peak  1209 spectrum    1 weight  0.10000E+01 volume  0.99562E-03 ppm1      9.028 ppm2      4.565 CV     1
 ASSI { 1210}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 126  and name HB2 ))
      3.400     1.500     1.500 peak  1210 spectrum    1 weight  0.10000E+01 volume  0.98047E-03 ppm1      9.038 ppm2      2.209 CV     1
 OR { 1210}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 126  and name HG3 ))
 ASSI { 1211}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 127  and name HB2 ))
      2.700     0.900     0.900 peak  1211 spectrum    1 weight  0.10000E+01 volume  0.24374E-02 ppm1      9.030 ppm2      1.863 CV     1
 OR { 1211}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 127  and name HB3 ))
 ASSI { 1212}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 128  and name HA  ))
      3.000     1.100     1.100 peak  1212 spectrum    1 weight  0.10000E+01 volume  0.17761E-02 ppm1      8.613 ppm2      4.049 CV     1
 ASSI { 1213}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 128  and name HD3 ))
      4.300     2.300     1.700 peak  1213 spectrum    1 weight  0.10000E+01 volume  0.68844E-03 ppm1      8.612 ppm2      3.207 CV     1
 OR { 1213}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 128  and name HD2 ))
 ASSI { 1215}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 128  and name HG3 ))
      3.100     1.200     1.200 peak  1215 spectrum    1 weight  0.10000E+01 volume  0.22417E-02 ppm1      8.614 ppm2      1.601 CV     1
 OR { 1215}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 128  and name HG2 ))
 ASSI { 1216}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 129  and name H   ))
      3.000     1.100     1.100 peak  1216 spectrum    1 weight  0.10000E+01 volume  0.12864E-02 ppm1      8.613 ppm2      7.788 CV     1
 ASSI { 1217}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 127  and name H   ))
      3.700     1.700     1.700 peak  1217 spectrum    1 weight  0.10000E+01 volume  0.34396E-03 ppm1      8.611 ppm2      9.027 CV     1
 ASSI { 1218}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 129  and name HA  ))
      2.800     1.000     1.000 peak  1218 spectrum    1 weight  0.10000E+01 volume  0.26365E-02 ppm1      7.793 ppm2      4.152 CV     1
 ASSI { 1219}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 128  and name HA  ))
      3.000     1.100     1.100 peak  1219 spectrum    1 weight  0.10000E+01 volume  0.18279E-02 ppm1      7.789 ppm2      4.054 CV     1
 ASSI { 1220}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 127  and name HA  ))
      3.600     1.700     1.700 peak  1220 spectrum    1 weight  0.10000E+01 volume  0.57152E-03 ppm1      7.791 ppm2      3.742 CV     1
 ASSI { 1221}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 129  and name HG2 ))
      2.400     0.700     0.700 peak  1221 spectrum    1 weight  0.10000E+01 volume  0.43209E-02 ppm1      7.791 ppm2      2.390 CV     1
 OR { 1221}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 129  and name HG3 ))
 ASSI { 1227}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 129  and name HA  ))
      3.000     1.100     1.100 peak  1227 spectrum    1 weight  0.10000E+01 volume  0.18405E-02 ppm1      7.762 ppm2      4.157 CV     1
 ASSI { 1228}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 128  and name HA  ))
      3.300     1.300     1.300 peak  1228 spectrum    1 weight  0.10000E+01 volume  0.12096E-02 ppm1      7.761 ppm2      4.057 CV     1
 ASSI { 1229}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 129  and name HG3 ))
      2.800     1.000     1.000 peak  1229 spectrum    1 weight  0.10000E+01 volume  0.14517E-02 ppm1      7.760 ppm2      2.404 CV     1
 OR { 1229}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 129  and name HG2 ))
 ASSI { 1232}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 130  and name HG  ))
      2.500     0.800     0.800 peak  1232 spectrum    1 weight  0.10000E+01 volume  0.59603E-02 ppm1      7.763 ppm2      1.664 CV     1
 OR { 1232}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 130  and name HB3 ))
 ASSI { 1233}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 130  and name HB2 ))
      2.500     0.800     0.800 peak  1233 spectrum    1 weight  0.10000E+01 volume  0.29308E-02 ppm1      7.763 ppm2      1.417 CV     1
 ASSI { 1234}
   (( segid "    " and resid 130  and name H   ))
   (  segid "    " and resid 130  and name HD2%)
      2.100     0.600     0.600 peak  1234 spectrum    1 weight  0.10000E+01 volume  0.49885E-02 ppm1      7.763 ppm2      0.949 CV     1
 OR { 1234}
   (( segid "    " and resid 130  and name H   ))
   (  segid "    " and resid 130  and name HD1%)
 ASSI { 1235}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 130  and name HA  ))
      2.700     0.900     0.900 peak  1235 spectrum    1 weight  0.10000E+01 volume  0.24632E-02 ppm1      7.765 ppm2      4.299 CV     1
 ASSI { 1236}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 131  and name H   ))
      2.400     0.700     0.700 peak  1236 spectrum    1 weight  0.10000E+01 volume  0.40749E-02 ppm1      7.763 ppm2      7.419 CV     1
 ASSI { 1238}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 128  and name HA  ))
      3.800     1.800     1.800 peak  1238 spectrum    1 weight  0.10000E+01 volume  0.68843E-03 ppm1      7.430 ppm2      4.049 CV     1
 ASSI { 1240}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 131  and name HA  ))
      3.100     1.200     1.200 peak  1240 spectrum    1 weight  0.10000E+01 volume  0.17208E-02 ppm1      7.417 ppm2      4.745 CV     1
 ASSI { 1241}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 130  and name HA  ))
      3.300     1.300     1.300 peak  1241 spectrum    1 weight  0.10000E+01 volume  0.11566E-02 ppm1      7.416 ppm2      4.302 CV     1
 ASSI { 1242}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 129  and name HA  ))
      3.400     1.500     1.500 peak  1242 spectrum    1 weight  0.10000E+01 volume  0.82980E-03 ppm1      7.420 ppm2      4.147 CV     1
 ASSI { 1244}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 131  and name HB3 ))
      3.900     1.900     1.900 peak  1244 spectrum    1 weight  0.10000E+01 volume  0.18605E-02 ppm1      7.421 ppm2      3.283 CV     1
 ASSI { 1245}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 131  and name HB2 ))
      2.900     1.000     1.000 peak  1245 spectrum    1 weight  0.10000E+01 volume  0.18206E-02 ppm1      7.418 ppm2      2.832 CV     1
 ASSI { 1247}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 130  and name HB3 ))
      3.600     1.700     1.700 peak  1247 spectrum    1 weight  0.10000E+01 volume  0.16136E-02 ppm1      7.417 ppm2      1.678 CV     1
 OR { 1247}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 130  and name HG  ))
 ASSI { 1248}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 130  and name HB2 ))
      3.500     1.600     1.600 peak  1248 spectrum    1 weight  0.10000E+01 volume  0.79024E-03 ppm1      7.417 ppm2      1.408 CV     1
 ASSI { 1250}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 132  and name H   ))
      3.400     1.400     1.400 peak  1250 spectrum    1 weight  0.10000E+01 volume  0.26556E-02 ppm1      7.421 ppm2      7.867 CV     1
 ASSI { 1259}
   (( segid "    " and resid 134  and name H   ))
   (( segid "    " and resid 133  and name HG3 ))
      2.900     1.100     1.100 peak  1259 spectrum    1 weight  0.10000E+01 volume  0.25918E-02 ppm1      8.532 ppm2      1.480 CV     1
 OR { 1259}
   (( segid "    " and resid 134  and name H   ))
   (( segid "    " and resid 133  and name HG2 ))
 ASSI { 1262}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 135  and name HG2 ))
      3.300     1.400     1.400 peak  1262 spectrum    1 weight  0.10000E+01 volume  0.10257E-02 ppm1      8.525 ppm2      2.394 CV     1
 OR { 1262}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 135  and name HG3 ))
 ASSI { 1263}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 135  and name HB3 ))
      3.400     1.400     1.400 peak  1263 spectrum    1 weight  0.10000E+01 volume  0.20054E-02 ppm1      8.523 ppm2      2.090 CV     1
 ASSI { 1264}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 135  and name HB2 ))
      2.900     1.100     1.100 peak  1264 spectrum    1 weight  0.10000E+01 volume  0.25552E-02 ppm1      8.524 ppm2      2.004 CV     1
 ASSI { 1265}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 133  and name HB3 ))
      3.100     3.100     2.900 peak  1265 spectrum    1 weight  0.10000E+01 volume  0.19766E-02 ppm1      8.525 ppm2      1.898 CV     1
 ASSI { 1267}
   (( segid "    " and resid 135  and name HE22))
   (( segid "    " and resid 135  and name HG2 ))
      3.800     1.900     1.900 peak  1267 spectrum    1 weight  0.10000E+01 volume  0.13992E-02 ppm1      6.937 ppm2      2.394 CV     1
 OR { 1267}
   (( segid "    " and resid 135  and name HE22))
   (( segid "    " and resid 135  and name HG3 ))
 ASSI { 1269}
   (( segid "    " and resid 135  and name HE21))
   (( segid "    " and resid 135  and name HA  ))
      3.900     1.900     1.900 peak  1269 spectrum    1 weight  0.10000E+01 volume  0.10539E-02 ppm1      7.612 ppm2      4.358 CV     1
 ASSI { 1270}
   (( segid "    " and resid 135  and name HE21))
   (( segid "    " and resid 135  and name HG2 ))
      2.700     0.900     0.900 peak  1270 spectrum    1 weight  0.10000E+01 volume  0.35319E-02 ppm1      7.610 ppm2      2.395 CV     1
 OR { 1270}
   (( segid "    " and resid 135  and name HE21))
   (( segid "    " and resid 135  and name HG3 ))
 ASSI { 1272}
   (( segid "    " and resid 135  and name HE21))
   (( segid "    " and resid 129  and name HB2 ))
      2.600     2.600     3.400 peak  1272 spectrum    1 weight  0.10000E+01 volume  0.58775E-03 ppm1      7.610 ppm2      2.133 CV     1
 ASSI { 1273}
   (( segid "    " and resid 135  and name HE21))
   (( segid "    " and resid 135  and name HE22))
      1.400     0.200     0.800 peak  1273 spectrum    1 weight  0.10000E+01 volume  0.67498E-01 ppm1      7.610 ppm2      6.935 CV     1
 ASSI { 1275}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 135  and name HG3 ))
      4.900     3.000     1.100 peak  1275 spectrum    1 weight  0.10000E+01 volume  0.42828E-03 ppm1      8.455 ppm2      2.395 CV     1
 OR { 1275}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 135  and name HG2 ))
 ASSI { 1276}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 135  and name HB3 ))
      3.500     1.500     1.500 peak  1276 spectrum    1 weight  0.10000E+01 volume  0.80949E-03 ppm1      8.460 ppm2      2.090 CV     1
 ASSI { 1277}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 135  and name HB2 ))
      3.300     1.400     1.400 peak  1277 spectrum    1 weight  0.10000E+01 volume  0.10265E-02 ppm1      8.460 ppm2      2.016 CV     1
 ASSI { 1278}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 136  and name HB3 ))
      2.600     0.900     0.900 peak  1278 spectrum    1 weight  0.10000E+01 volume  0.42485E-02 ppm1      8.454 ppm2      1.771 CV     1
 OR { 1278}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 136  and name HB2 ))
 ASSI { 1279}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 136  and name HG3 ))
      3.200     1.300     1.300 peak  1279 spectrum    1 weight  0.10000E+01 volume  0.11114E-02 ppm1      8.455 ppm2      1.454 CV     1
 OR { 1279}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 136  and name HG2 ))
 ASSI { 1283}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 137  and name HA  ))
      1.900     0.500     0.500 peak  1283 spectrum    1 weight  0.10000E+01 volume  0.21460E-01 ppm1      8.366 ppm2      4.316 CV     1
 ASSI { 1284}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 138  and name HB2 ))
      2.200     0.600     0.600 peak  1284 spectrum    1 weight  0.10000E+01 volume  0.10944E-01 ppm1      8.366 ppm2      1.657 CV     1
 OR { 1284}
   (( segid "    " and resid 138  and name H   ))
   (( segid "    " and resid 138  and name HB3 ))
 ASSI { 1285}
   (( segid "    " and resid 138  and name H   ))
   (  segid "    " and resid 138  and name HD1%)
      4.300     2.300     1.700 peak  1285 spectrum    1 weight  0.10000E+01 volume  0.13760E-02 ppm1      8.365 ppm2      0.926 CV     1
 OR { 1285}
   (( segid "    " and resid 138  and name H   ))
   (  segid "    " and resid 138  and name HD2%)
 ASSI { 1286}
   (( segid "    " and resid 138  and name H   ))
   (  segid "    " and resid 138  and name HD1%)
      5.000     3.100     1.000 peak  1286 spectrum    1 weight  0.10000E+01 volume  0.54420E-03 ppm1      8.362 ppm2      0.879 CV     1
 ASSI { 1288}
   (( segid "    " and resid 139  and name H   ))
   (  segid "    " and resid 139  and name HB% )
      2.700     0.900     0.900 peak  1288 spectrum    1 weight  0.10000E+01 volume  0.41030E-02 ppm1      8.369 ppm2      1.442 CV     1
 ASSI { 1289}
   (( segid "    " and resid 140  and name H   ))
   (( segid "    " and resid 140  and name HA  ))
      3.100     1.200     1.200 peak  1289 spectrum    1 weight  0.10000E+01 volume  0.16829E-02 ppm1      8.292 ppm2      4.457 CV     1
 ASSI { 1290}
   (( segid "    " and resid 140  and name H   ))
   (( segid "    " and resid 140  and name HB2 ))
      3.400     1.400     1.400 peak  1290 spectrum    1 weight  0.10000E+01 volume  0.12000E-02 ppm1      8.292 ppm2      3.945 CV     1
 OR { 1290}
   (( segid "    " and resid 140  and name H   ))
   (( segid "    " and resid 140  and name HB3 ))
 ASSI { 1291}
   (( segid "    " and resid 140  and name H   ))
   (  segid "    " and resid 139  and name HB% )
      4.500     2.500     1.500 peak  1291 spectrum    1 weight  0.10000E+01 volume  0.64474E-03 ppm1      8.292 ppm2      1.485 CV     1
 ASSI { 1292}
   (( segid "    " and resid 140  and name H   ))
   (( segid "    " and resid 139  and name HA  ))
      2.700     0.900     0.900 peak  1292 spectrum    1 weight  0.10000E+01 volume  0.31336E-02 ppm1      8.288 ppm2      4.385 CV     1
 ASSI { 1294}
   (( segid "    " and resid 141  and name H   ))
   (( segid "    " and resid 139  and name HA  ))
      2.600     2.600     3.400 peak  1294 spectrum    1 weight  0.10000E+01 volume  0.60687E-03 ppm1      7.979 ppm2      4.387 CV     1
 ASSI { 1295}
   (( segid "    " and resid 141  and name H   ))
   (( segid "    " and resid 141  and name HA  ))
      3.600     1.600     1.600 peak  1295 spectrum    1 weight  0.10000E+01 volume  0.77539E-03 ppm1      7.978 ppm2      4.312 CV     1
 ASSI { 1297}
   (( segid "    " and resid 141  and name H   ))
   (( segid "    " and resid 129  and name HG2 ))
      2.500     2.500     3.500 peak  1297 spectrum    1 weight  0.10000E+01 volume  0.74496E-03 ppm1      7.993 ppm2      2.378 CV     1
 OR { 1297}
   (( segid "    " and resid 141  and name H   ))
   (( segid "    " and resid 129  and name HG3 ))
 ASSI { 1300}
   (( segid "    " and resid 24   and name HD22))
   (( segid "    " and resid 24   and name HD21))
      2.000     0.500     0.500 peak  1300 spectrum    1 weight  0.10000E+01 volume  0.42634E-02 ppm1      7.486 ppm2      8.115 CV     1
 ASSI { 1302}
   (( segid "    " and resid 24   and name HD22))
   (( segid "    " and resid 24   and name HB2 ))
      4.100     2.100     1.900 peak  1302 spectrum    1 weight  0.10000E+01 volume  0.12753E-02 ppm1      7.488 ppm2      2.539 CV     1
 OR { 1302}
   (( segid "    " and resid 24   and name HD22))
   (( segid "    " and resid 24   and name HB3 ))
 ASSI { 1303}
   (( segid "    " and resid 24   and name HD21))
   (( segid "    " and resid 24   and name HB2 ))
      2.600     0.800     0.800 peak  1303 spectrum    1 weight  0.10000E+01 volume  0.13818E-02 ppm1      8.117 ppm2      2.514 CV     1
 ASSI { 1306}
   (( segid "    " and resid 80   and name HE22))
   (( segid "    " and resid 80   and name HB3 ))
      4.400     2.400     1.600 peak  1306 spectrum    1 weight  0.10000E+01 volume  0.94270E-03 ppm1      6.603 ppm2      2.550 CV     1
 ASSI { 1307}
   (( segid "    " and resid 80   and name HE22))
   (( segid "    " and resid 80   and name HE21))
      2.200     0.600     0.600 peak  1307 spectrum    1 weight  0.10000E+01 volume  0.30506E-02 ppm1      6.605 ppm2      7.459 CV     1
 ASSI { 1310}
   (( segid "    " and resid 80   and name HE21))
   (( segid "    " and resid 80   and name HB3 ))
      3.700     1.800     1.800 peak  1310 spectrum    1 weight  0.10000E+01 volume  0.85268E-03 ppm1      7.464 ppm2      2.586 CV     1
 ASSI { 1311}
   (( segid "    " and resid 92   and name HE  ))
   (( segid "    " and resid 92   and name HB3 ))
      4.400     2.400     1.600 peak  1311 spectrum    1 weight  0.10000E+01 volume  0.50833E-03 ppm1      7.320 ppm2      1.094 CV     1
 ASSI { 1312}
   (( segid "    " and resid 92   and name HE  ))
   (( segid "    " and resid 92   and name HG2 ))
      3.500     1.500     1.500 peak  1312 spectrum    1 weight  0.10000E+01 volume  0.87977E-03 ppm1      7.318 ppm2      1.284 CV     1
 ASSI { 1313}
   (( segid "    " and resid 92   and name HE  ))
   (( segid "    " and resid 92   and name HG3 ))
      3.000     1.200     1.200 peak  1313 spectrum    1 weight  0.10000E+01 volume  0.13359E-02 ppm1      7.319 ppm2      1.527 CV     1
 OR { 1313}
   (( segid "    " and resid 92   and name HE  ))
   (( segid "    " and resid 92   and name HB2 ))
 ASSI { 1314}
   (( segid "    " and resid 92   and name HE  ))
   (( segid "    " and resid 92   and name HD3 ))
      3.100     1.200     1.200 peak  1314 spectrum    1 weight  0.10000E+01 volume  0.13211E-02 ppm1      7.321 ppm2      3.032 CV     1
 ASSI { 1315}
   (( segid "    " and resid 92   and name HE  ))
   (( segid "    " and resid 92   and name HD2 ))
      3.000     1.100     1.100 peak  1315 spectrum    1 weight  0.10000E+01 volume  0.16898E-02 ppm1      7.318 ppm2      2.924 CV     1
 ASSI { 1316}
   (( segid "    " and resid 45   and name HE  ))
   (( segid "    " and resid 53   and name HD2 ))
      3.600     1.600     1.600 peak  1316 spectrum    1 weight  0.10000E+01 volume  0.15476E-02 ppm1      7.114 ppm2      5.807 CV     1
 ASSI { 1319}
   (( segid "    " and resid 45   and name HE  ))
   (  segid "    " and resid 43   and name HG2%)
      4.000     2.000     2.000 peak  1319 spectrum    1 weight  0.10000E+01 volume  0.99241E-03 ppm1      7.108 ppm2      0.736 CV     1
 OR { 1319}
   (( segid "    " and resid 45   and name HE  ))
   (  segid "    " and resid 43   and name HG1%)
 ASSI { 1321}
   (( segid "    " and resid 45   and name HE  ))
   (( segid "    " and resid 45   and name HB3 ))
      3.400     1.400     1.400 peak  1321 spectrum    1 weight  0.10000E+01 volume  0.83989E-03 ppm1      7.117 ppm2      1.707 CV     1
 OR { 1321}
   (( segid "    " and resid 45   and name HE  ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 1322}
   (( segid "    " and resid 45   and name HE  ))
   (( segid "    " and resid 45   and name HG3 ))
      3.600     1.600     1.600 peak  1322 spectrum    1 weight  0.10000E+01 volume  0.67083E-03 ppm1      7.112 ppm2      1.349 CV     1
 ASSI { 1324}
   (( segid "    " and resid 111  and name HE  ))
   (( segid "    " and resid 111  and name HD3 ))
      2.500     0.800     0.800 peak  1324 spectrum    1 weight  0.10000E+01 volume  0.28452E-02 ppm1      7.416 ppm2      3.241 CV     1
 ASSI { 1325}
   (( segid "    " and resid 111  and name HE  ))
   (( segid "    " and resid 111  and name HG3 ))
      3.000     1.100     1.100 peak  1325 spectrum    1 weight  0.10000E+01 volume  0.12016E-02 ppm1      7.411 ppm2      1.675 CV     1
 ASSI { 1326}
   (( segid "    " and resid 111  and name HE  ))
   (( segid "    " and resid 101  and name HB  ))
      2.400     2.400     3.600 peak  1326 spectrum    1 weight  0.10000E+01 volume  0.82410E-03 ppm1      7.420 ppm2      2.020 CV     1
 ASSI { 1329}
   (( segid "    " and resid 109  and name HE  ))
   (( segid "    " and resid 109  and name HG3 ))
      3.900     1.900     1.900 peak  1329 spectrum    1 weight  0.10000E+01 volume  0.61178E-03 ppm1      6.513 ppm2      1.452 CV     1
 OR { 1329}
   (( segid "    " and resid 109  and name HE  ))
   (( segid "    " and resid 109  and name HB3 ))
 ASSI { 1330}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 68   and name HD2 ))
      4.400     2.400     1.600 peak  1330 spectrum    1 weight  0.10000E+01 volume  0.37733E-03 ppm1      8.365 ppm2      3.215 CV     1
 OR { 1330}
   (( segid "    " and resid 68   and name H   ))
   (( segid "    " and resid 68   and name HD3 ))
 ASSI {    1}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 21   and name H   ))
      4.500     2.600     1.500 peak     1 spectrum    1 weight  0.10000E+01 volume  0.80816E-03 ppm1      1.036 ppm2      8.935 CV     1
 ASSI {    2}
   (( segid "    " and resid 82   and name HB3 ))
   (( segid "    " and resid 85   and name HE22))
      6.000     4.600     0.000 peak     2 spectrum    1 weight  0.10000E+01 volume  0.24503E-03 ppm1      1.683 ppm2      7.215 CV     1
 ASSI {    2}
   (( segid "    " and resid 73   and name HB  ))
   (( segid "    " and resid 73   and name HG12))
      2.700     0.900     0.900 peak     2 spectrum    1 weight  0.10000E+01 volume  0.55594E-02 ppm1      1.774 ppm2      1.139 CV     1
 ASSI {    3}
   (( segid "    " and resid 6    and name HA  ))
   (  segid "    " and resid 6    and name HB% )
      2.100     0.500     0.500 peak     3 spectrum    1 weight  0.10000E+01 volume  0.16741E-01 ppm1      4.562 ppm2      1.341 CV     1
 ASSI {    6}
   (  segid "    " and resid 131  and name HD% )
   (( segid "    " and resid 131  and name HB3 ))
      2.700     0.900     0.900 peak     6 spectrum    1 weight  0.10000E+01 volume  0.34226E-02 ppm1      7.123 ppm2      3.280 CV     1
 ASSI {    7}
   (  segid "    " and resid 131  and name HD% )
   (( segid "    " and resid 131  and name HB2 ))
      2.800     1.000     1.000 peak     7 spectrum    1 weight  0.10000E+01 volume  0.28632E-02 ppm1      7.123 ppm2      2.826 CV     1
 ASSI {   11}
   (( segid "    " and resid 141  and name HB3 ))
   (( segid "    " and resid 141  and name H   ))
      3.800     1.800     1.800 peak    11 spectrum    1 weight  0.10000E+01 volume  0.66509E-03 ppm1      3.878 ppm2      7.976 CV     1
 OR {   11}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 141  and name H   ))
 ASSI {   12}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 141  and name HB3 ))
      3.000     1.200     1.200 peak    12 spectrum    1 weight  0.10000E+01 volume  0.23279E-02 ppm1      4.290 ppm2      3.868 CV     1
 OR {   12}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 141  and name HB2 ))
 ASSI {   14}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 114  and name HG12))
      3.000     1.100     1.100 peak    14 spectrum    1 weight  0.10000E+01 volume  0.11857E-02 ppm1      3.870 ppm2      1.246 CV     1
 ASSI {   15}
   (( segid "    " and resid 114  and name HA  ))
   (  segid "    " and resid 114  and name HG2%)
      2.600     0.900     0.900 peak    15 spectrum    1 weight  0.10000E+01 volume  0.43483E-02 ppm1      3.872 ppm2      0.951 CV     1
 OR {   15}
   (( segid "    " and resid 114  and name HA  ))
   (  segid "    " and resid 114  and name HD1%)
 ASSI {   18}
   (( segid "    " and resid 141  and name HB2 ))
   (  segid "    " and resid 125  and name HB% )
      2.200     0.600     0.600 peak    18 spectrum    1 weight  0.10000E+01 volume  0.13981E-02 ppm1      3.874 ppm2      1.433 CV     1
 OR {   18}
   (( segid "    " and resid 141  and name HB3 ))
   (  segid "    " and resid 125  and name HB% )
 ASSI {   20}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 141  and name H   ))
      2.800     1.000     1.000 peak    20 spectrum    1 weight  0.10000E+01 volume  0.22213E-02 ppm1      4.489 ppm2      7.976 CV     1
 ASSI {   21}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 64   and name H   ))
      3.000     1.200     1.200 peak    21 spectrum    1 weight  0.10000E+01 volume  0.13253E-02 ppm1      3.956 ppm2      8.282 CV     1
 ASSI {   22}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name H   ))
      2.700     0.900     0.900 peak    22 spectrum    1 weight  0.10000E+01 volume  0.17583E-02 ppm1      3.959 ppm2      8.661 CV     1
 ASSI {   23}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 66   and name HD% )
      2.500     0.800     0.800 peak    23 spectrum    1 weight  0.10000E+01 volume  0.25923E-02 ppm1      3.956 ppm2      7.292 CV     1
 ASSI {   24}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 140  and name HA  ))
      2.800     1.000     1.000 peak    24 spectrum    1 weight  0.10000E+01 volume  0.32627E-02 ppm1      3.924 ppm2      4.486 CV     1
 OR {   24}
   (( segid "    " and resid 140  and name HB3 ))
   (( segid "    " and resid 140  and name HA  ))
 ASSI {   26}
   (( segid "    " and resid 3    and name HB3 ))
   (( segid "    " and resid 44   and name HA  ))
      2.500     2.500     3.500 peak    26 spectrum    1 weight  0.10000E+01 volume  0.70939E-02 ppm1      3.935 ppm2      4.392 CV     1
 ASSI {   27}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 44   and name HA  ))
      2.600     0.800     0.800 peak    27 spectrum    1 weight  0.10000E+01 volume  0.65412E-02 ppm1      3.879 ppm2      4.391 CV     1
 ASSI {   29}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 63   and name HG2%)
      2.200     0.600     0.600 peak    29 spectrum    1 weight  0.10000E+01 volume  0.13839E-01 ppm1      3.955 ppm2      0.950 CV     1
 OR {   29}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 63   and name HG1%)
 ASSI {   34}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 50   and name HD1%)
      2.400     0.700     0.700 peak    34 spectrum    1 weight  0.10000E+01 volume  0.78958E-02 ppm1      3.780 ppm2      0.911 CV     1
 OR {   34}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 50   and name HG2%)
 ASSI {   36}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HG13))
      2.600     0.800     0.800 peak    36 spectrum    1 weight  0.10000E+01 volume  0.23396E-02 ppm1      3.781 ppm2      1.602 CV     1
 OR {   36}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HG12))
 ASSI {   37}
   (( segid "    " and resid 139  and name HA  ))
   (  segid "    " and resid 139  and name HB% )
      2.600     0.800     0.800 peak    37 spectrum    1 weight  0.10000E+01 volume  0.51161E-02 ppm1      4.369 ppm2      1.438 CV     1
 ASSI {   38}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 139  and name H   ))
      3.800     1.800     1.800 peak    38 spectrum    1 weight  0.10000E+01 volume  0.50048E-03 ppm1      4.379 ppm2      8.364 CV     1
 ASSI {   40}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 20   and name H   ))
      4.100     2.100     1.900 peak    40 spectrum    1 weight  0.10000E+01 volume  0.86701E-03 ppm1      1.431 ppm2      8.665 CV     1
 ASSI {   42}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 24   and name HD22))
      2.900     1.100     1.100 peak    42 spectrum    1 weight  0.10000E+01 volume  0.43147E-02 ppm1      1.431 ppm2      7.484 CV     1
 ASSI {   43}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 24   and name H   ))
      2.700     0.900     0.900 peak    43 spectrum    1 weight  0.10000E+01 volume  0.40964E-02 ppm1      1.432 ppm2      7.278 CV     1
 ASSI {   44}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 20   and name HA  ))
      2.300     0.700     0.700 peak    44 spectrum    1 weight  0.10000E+01 volume  0.83299E-02 ppm1      1.433 ppm2      3.965 CV     1
 ASSI {   45}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 23   and name HA  ))
      2.100     0.600     0.600 peak    45 spectrum    1 weight  0.10000E+01 volume  0.15661E-01 ppm1      1.431 ppm2      4.235 CV     1
 ASSI {   52}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 86   and name H   ))
      3.200     1.300     1.300 peak    52 spectrum    1 weight  0.10000E+01 volume  0.15989E-02 ppm1      0.938 ppm2      8.357 CV     1
 ASSI {   58}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 22   and name H   ))
      3.600     1.600     1.600 peak    58 spectrum    1 weight  0.10000E+01 volume  0.40222E-02 ppm1      0.947 ppm2      8.554 CV     1
 ASSI {   60}
   (( segid "    " and resid 75   and name HG  ))
   (( segid "    " and resid 76   and name H   ))
      3.900     1.900     1.900 peak    60 spectrum    1 weight  0.10000E+01 volume  0.21207E-02 ppm1      1.588 ppm2      8.621 CV     1
 ASSI {   62}
   (  segid "    " and resid 33   and name HG1%)
   (( segid "    " and resid 35   and name H   ))
      3.200     1.300     1.300 peak    62 spectrum    1 weight  0.10000E+01 volume  0.27658E-02 ppm1      0.934 ppm2      7.869 CV     1
 ASSI {   65}
   (  segid "    " and resid 59   and name HD2%)
   (( segid "    " and resid 59   and name H   ))
      3.400     1.500     1.500 peak    65 spectrum    1 weight  0.10000E+01 volume  0.33761E-02 ppm1      0.932 ppm2      7.663 CV     1
 ASSI {   67}
   (  segid "    " and resid 33   and name HG1%)
   (  segid "    " and resid 66   and name HD% )
      2.200     0.600     0.600 peak    67 spectrum    1 weight  0.10000E+01 volume  0.55190E-02 ppm1      0.938 ppm2      7.277 CV     1
 ASSI {   69}
   (  segid "    " and resid 33   and name HG1%)
   (  segid "    " and resid 66   and name HE% )
      2.900     1.000     1.000 peak    69 spectrum    1 weight  0.10000E+01 volume  0.57139E-02 ppm1      0.936 ppm2      7.100 CV     1
 ASSI {   70}
   (  segid "    " and resid 59   and name HD2%)
   (  segid "    " and resid 21   and name HD% )
      2.500     0.800     0.800 peak    70 spectrum    1 weight  0.10000E+01 volume  0.71908E-02 ppm1      0.932 ppm2      6.877 CV     1
 OR {   70}
   (  segid "    " and resid 59   and name HD2%)
   (  segid "    " and resid 21   and name HE% )
 ASSI {   71}
   (  segid "    " and resid 75   and name HD2%)
   (( segid "    " and resid 76   and name HD1 ))
      2.200     2.200     3.800 peak    71 spectrum    1 weight  0.10000E+01 volume  0.13089E-02 ppm1      0.889 ppm2      7.358 CV     1
 OR {   71}
   (  segid "    " and resid 75   and name HD2%)
   (( segid "    " and resid 76   and name HE3 ))
 ASSI {   73}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 99   and name H   ))
      3.700     1.700     1.700 peak    73 spectrum    1 weight  0.10000E+01 volume  0.14693E-02 ppm1      0.891 ppm2      7.829 CV     1
 ASSI {   76}
   (  segid "    " and resid 98   and name HD1%)
   (  segid "    " and resid 131  and name HE% )
      4.300     2.300     1.700 peak    76 spectrum    1 weight  0.10000E+01 volume  0.13470E-02 ppm1      0.891 ppm2      6.743 CV     1
 ASSI {   77}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 43   and name H   ))
      3.600     1.600     1.600 peak    77 spectrum    1 weight  0.10000E+01 volume  0.15514E-02 ppm1      0.946 ppm2      7.985 CV     1
 ASSI {   80}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 40   and name H   ))
      3.300     1.400     1.400 peak    80 spectrum    1 weight  0.10000E+01 volume  0.29639E-02 ppm1      0.945 ppm2      7.868 CV     1
 ASSI {   83}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 9    and name HZ3 ))
      2.900     1.000     1.000 peak    83 spectrum    1 weight  0.10000E+01 volume  0.30253E-02 ppm1      0.945 ppm2      6.796 CV     1
 ASSI {   84}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 9    and name HH2 ))
      2.900     1.000     1.000 peak    84 spectrum    1 weight  0.10000E+01 volume  0.22434E-02 ppm1      0.945 ppm2      6.731 CV     1
 ASSI {   88}
   (  segid "    " and resid 138  and name HD2%)
   (( segid "    " and resid 138  and name HA  ))
      3.700     1.700     1.700 peak    88 spectrum    1 weight  0.10000E+01 volume  0.24172E-02 ppm1      0.941 ppm2      4.358 CV     1
 ASSI {   89}
   (  segid "    " and resid 75   and name HD2%)
   (( segid "    " and resid 75   and name HA  ))
      2.800     0.900     0.900 peak    89 spectrum    1 weight  0.10000E+01 volume  0.56619E-02 ppm1      0.887 ppm2      4.460 CV     1
 ASSI {   90}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 138  and name HA  ))
      2.400     0.700     0.700 peak    90 spectrum    1 weight  0.10000E+01 volume  0.77011E-02 ppm1      0.887 ppm2      4.354 CV     1
 ASSI {   91}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 19   and name HA  ))
      2.700     0.900     0.900 peak    91 spectrum    1 weight  0.10000E+01 volume  0.52305E-02 ppm1      0.947 ppm2      4.011 CV     1
 ASSI {   92}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 17   and name HA  ))
      2.400     0.700     0.700 peak    92 spectrum    1 weight  0.10000E+01 volume  0.45631E-02 ppm1      0.989 ppm2      3.959 CV     1
 ASSI {   96}
   (  segid "    " and resid 33   and name HG1%)
   (( segid "    " and resid 33   and name HA  ))
      2.500     0.800     0.800 peak    96 spectrum    1 weight  0.10000E+01 volume  0.53113E-02 ppm1      0.939 ppm2      3.582 CV     1
 ASSI {   97}
   (  segid "    " and resid 59   and name HD2%)
   (( segid "    " and resid 18   and name HA  ))
      3.300     1.400     1.400 peak    97 spectrum    1 weight  0.10000E+01 volume  0.39769E-02 ppm1      0.932 ppm2      3.799 CV     1
 ASSI {   99}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 22   and name HA  ))
      3.400     1.400     1.400 peak    99 spectrum    1 weight  0.10000E+01 volume  0.44868E-02 ppm1      0.947 ppm2      3.728 CV     1
 ASSI {  101}
   (( segid "    " and resid 75   and name HB3 ))
   (( segid "    " and resid 74   and name HA  ))
      4.400     2.400     1.600 peak   101 spectrum    1 weight  0.10000E+01 volume  0.11223E-02 ppm1      1.669 ppm2      4.099 CV     1
 ASSI {  108}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 86   and name HD3 ))
      2.800     1.000     1.000 peak   108 spectrum    1 weight  0.10000E+01 volume  0.20059E-02 ppm1      0.977 ppm2      3.239 CV     1
 OR {  108}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 86   and name HD2 ))
 ASSI {  111}
   (  segid "    " and resid 33   and name HG1%)
   (( segid "    " and resid 51   and name HA  ))
      3.300     1.400     1.400 peak   111 spectrum    1 weight  0.10000E+01 volume  0.25667E-02 ppm1      0.936 ppm2      2.968 CV     1
 ASSI {  112}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 86   and name HD3 ))
      3.200     1.300     1.300 peak   112 spectrum    1 weight  0.10000E+01 volume  0.39053E-02 ppm1      0.937 ppm2      3.271 CV     1
 OR {  112}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 86   and name HD2 ))
 ASSI {  113}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 136  and name HE2 ))
      3.300     1.300     1.300 peak   113 spectrum    1 weight  0.10000E+01 volume  0.13514E-02 ppm1      0.888 ppm2      3.012 CV     1
 OR {  113}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 136  and name HE3 ))
 ASSI {  116}
   (( segid "    " and resid 119  and name HG  ))
   (( segid "    " and resid 129  and name HG2 ))
      4.000     2.000     2.000 peak   116 spectrum    1 weight  0.10000E+01 volume  0.19678E-02 ppm1      1.590 ppm2      2.394 CV     1
 OR {  116}
   (( segid "    " and resid 119  and name HG  ))
   (( segid "    " and resid 129  and name HG3 ))
 ASSI {  120}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 40   and name HG  ))
      2.000     0.500     0.500 peak   120 spectrum    1 weight  0.10000E+01 volume  0.21477E-01 ppm1      0.945 ppm2      1.903 CV     1
 OR {  120}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 40   and name HB2 ))
 ASSI {  121}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 114  and name HB  ))
      2.400     0.700     0.700 peak   121 spectrum    1 weight  0.10000E+01 volume  0.41298E-02 ppm1      0.893 ppm2      2.236 CV     1
 ASSI {  124}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 82   and name HG  ))
      2.000     0.500     0.500 peak   124 spectrum    1 weight  0.10000E+01 volume  0.20810E-01 ppm1      0.942 ppm2      1.814 CV     1
 ASSI {  128}
   (  segid "    " and resid 59   and name HD2%)
   (( segid "    " and resid 59   and name HG  ))
      1.800     0.400     0.400 peak   128 spectrum    1 weight  0.10000E+01 volume  0.19362E-01 ppm1      0.932 ppm2      1.468 CV     1
 ASSI {  129}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 127  and name HG2 ))
      2.400     2.400     3.600 peak   129 spectrum    1 weight  0.10000E+01 volume  0.60925E-02 ppm1      0.888 ppm2      1.781 CV     1
 ASSI {  130}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 129  and name HG3 ))
      3.100     1.200     1.200 peak   130 spectrum    1 weight  0.10000E+01 volume  0.24574E-02 ppm1      0.889 ppm2      2.387 CV     1
 ASSI {  131}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 126  and name HG2 ))
      2.500     2.500     3.500 peak   131 spectrum    1 weight  0.10000E+01 volume  0.27870E-02 ppm1      0.890 ppm2      2.327 CV     1
 ASSI {  132}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 115  and name HB  ))
      2.600     0.800     0.800 peak   132 spectrum    1 weight  0.10000E+01 volume  0.22257E-02 ppm1      0.889 ppm2      2.250 CV     1
 ASSI {  134}
   (  segid "    " and resid 130  and name HD2%)
   (  segid "    " and resid 124  and name HG1%)
      1.900     0.500     0.500 peak   134 spectrum    1 weight  0.10000E+01 volume  0.10670E-01 ppm1      0.931 ppm2      0.517 CV     1
 ASSI {  136}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 85   and name HG2 ))
      2.900     1.000     1.000 peak   136 spectrum    1 weight  0.10000E+01 volume  0.34095E-02 ppm1      0.941 ppm2      2.479 CV     1
 ASSI {  137}
   (( segid "    " and resid 138  and name HA  ))
   (  segid "    " and resid 138  and name HD1%)
      2.300     0.700     0.700 peak   137 spectrum    1 weight  0.10000E+01 volume  0.99121E-02 ppm1      4.356 ppm2      0.897 CV     1
 OR {  137}
   (( segid "    " and resid 138  and name HA  ))
   (  segid "    " and resid 138  and name HD2%)
 ASSI {  138}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HB3 ))
      2.100     0.600     0.600 peak   138 spectrum    1 weight  0.10000E+01 volume  0.15481E-01 ppm1      4.356 ppm2      1.628 CV     1
 OR {  138}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HB2 ))
 OR {  138}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HG  ))
 ASSI {  139}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 136  and name HG3 ))
      3.500     1.500     1.500 peak   139 spectrum    1 weight  0.10000E+01 volume  0.37227E-02 ppm1      4.352 ppm2      1.441 CV     1
 OR {  139}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 136  and name HG2 ))
 ASSI {  140}
   (( segid "    " and resid 75   and name HB3 ))
   (  segid "    " and resid 75   and name HD1%)
      2.300     0.700     0.700 peak   140 spectrum    1 weight  0.10000E+01 volume  0.11626E-01 ppm1      1.674 ppm2      0.911 CV     1
 OR {  140}
   (( segid "    " and resid 75   and name HB3 ))
   (  segid "    " and resid 75   and name HD2%)
 ASSI {  141}
   (( segid "    " and resid 138  and name HB3 ))
   (  segid "    " and resid 138  and name HD2%)
      2.300     0.600     0.600 peak   141 spectrum    1 weight  0.10000E+01 volume  0.13757E-01 ppm1      1.659 ppm2      0.924 CV     1
 OR {  141}
   (( segid "    " and resid 138  and name HB2 ))
   (  segid "    " and resid 138  and name HD2%)
 OR {  141}
   (( segid "    " and resid 138  and name HB2 ))
   (  segid "    " and resid 138  and name HD1%)
 ASSI {  142}
   (( segid "    " and resid 75   and name HB2 ))
   (  segid "    " and resid 75   and name HD2%)
      2.300     0.600     0.600 peak   142 spectrum    1 weight  0.10000E+01 volume  0.14306E-01 ppm1      1.565 ppm2      0.902 CV     1
 OR {  142}
   (( segid "    " and resid 75   and name HB2 ))
   (  segid "    " and resid 75   and name HD1%)
 ASSI {  145}
   (( segid "    " and resid 75   and name HG  ))
   (  segid "    " and resid 75   and name HD2%)
      1.900     0.500     0.500 peak   145 spectrum    1 weight  0.10000E+01 volume  0.24218E-01 ppm1      1.586 ppm2      0.908 CV     1
 OR {  145}
   (( segid "    " and resid 75   and name HG  ))
   (  segid "    " and resid 75   and name HD1%)
 ASSI {  150}
   (( segid "    " and resid 64   and name HE2 ))
   (( segid "    " and resid 64   and name H   ))
      4.100     2.100     1.900 peak   150 spectrum    1 weight  0.10000E+01 volume  0.89718E-03 ppm1      2.980 ppm2      8.287 CV     1
 OR {  150}
   (( segid "    " and resid 64   and name HE3 ))
   (( segid "    " and resid 64   and name H   ))
 ASSI {  156}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 65   and name H   ))
      3.800     1.800     1.800 peak   156 spectrum    1 weight  0.10000E+01 volume  0.13932E-02 ppm1      1.463 ppm2      7.751 CV     1
 OR {  156}
   (( segid "    " and resid 64   and name HG3 ))
   (( segid "    " and resid 65   and name H   ))
 ASSI {  168}
   (( segid "    " and resid 48   and name HD3 ))
   (( segid "    " and resid 48   and name HA  ))
      3.600     1.700     1.700 peak   168 spectrum    1 weight  0.10000E+01 volume  0.32084E-02 ppm1      1.693 ppm2      3.887 CV     1
 OR {  168}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 48   and name HA  ))
 ASSI {  187}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 134  and name HD3 ))
      3.900     1.900     1.900 peak   187 spectrum    1 weight  0.10000E+01 volume  0.11709E-02 ppm1      1.766 ppm2      3.229 CV     1
 OR {  187}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 134  and name HD2 ))
 ASSI {  189}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 103  and name HA  ))
      2.500     0.800     0.800 peak   189 spectrum    1 weight  0.10000E+01 volume  0.63422E-02 ppm1      1.811 ppm2      4.152 CV     1
 OR {  189}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 103  and name HA  ))
 ASSI {  192}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 103  and name H   ))
      2.400     0.700     0.700 peak   192 spectrum    1 weight  0.10000E+01 volume  0.58781E-02 ppm1      1.811 ppm2      7.468 CV     1
 OR {  192}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 103  and name H   ))
 ASSI {  206}
   (( segid "    " and resid 14   and name HB3 ))
   (( segid "    " and resid 14   and name H   ))
      3.600     1.600     1.600 peak   206 spectrum    1 weight  0.10000E+01 volume  0.18072E-02 ppm1      2.078 ppm2      8.707 CV     1
 ASSI {  208}
   (( segid "    " and resid 67   and name HG2 ))
   (( segid "    " and resid 67   and name H   ))
      2.800     1.000     1.000 peak   208 spectrum    1 weight  0.10000E+01 volume  0.23160E-02 ppm1      2.411 ppm2      7.794 CV     1
 OR {  208}
   (( segid "    " and resid 67   and name HG3 ))
   (( segid "    " and resid 67   and name H   ))
 ASSI {  213}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 135  and name HA  ))
      2.700     0.900     0.900 peak   213 spectrum    1 weight  0.10000E+01 volume  0.58909E-02 ppm1      1.997 ppm2      4.345 CV     1
 ASSI {  216}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name HB3 ))
      2.000     0.500     0.500 peak   216 spectrum    1 weight  0.10000E+01 volume  0.14188E-01 ppm1      4.344 ppm2      2.096 CV     1
 ASSI {  217}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name HG3 ))
      2.500     0.800     0.800 peak   217 spectrum    1 weight  0.10000E+01 volume  0.96982E-02 ppm1      4.345 ppm2      2.393 CV     1
 OR {  217}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name HG2 ))
 ASSI {  219}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 135  and name HG3 ))
      2.100     0.500     0.500 peak   219 spectrum    1 weight  0.10000E+01 volume  0.19437E-01 ppm1      1.997 ppm2      2.388 CV     1
 OR {  219}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 135  and name HG2 ))
 ASSI {  220}
   (( segid "    " and resid 135  and name HB3 ))
   (( segid "    " and resid 135  and name HB2 ))
      1.200     0.200     1.000 peak   220 spectrum    1 weight  0.10000E+01 volume  0.10884E+00 ppm1      2.097 ppm2      2.002 CV     1
 ASSI {  227}
   (( segid "    " and resid 67   and name HG2 ))
   (( segid "    " and resid 51   and name HG12))
      2.800     1.000     1.000 peak   227 spectrum    1 weight  0.10000E+01 volume  0.19550E-02 ppm1      2.391 ppm2      1.448 CV     1
 OR {  227}
   (( segid "    " and resid 67   and name HG3 ))
   (( segid "    " and resid 51   and name HG12))
 ASSI {  231}
   (( segid "    " and resid 134  and name HD3 ))
   (( segid "    " and resid 134  and name H   ))
      3.300     1.300     1.300 peak   231 spectrum    1 weight  0.10000E+01 volume  0.10902E-02 ppm1      3.231 ppm2      8.529 CV     1
 OR {  231}
   (( segid "    " and resid 134  and name HD2 ))
   (( segid "    " and resid 134  and name H   ))
 ASSI {  232}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 111  and name HE  ))
      3.300     1.300     1.300 peak   232 spectrum    1 weight  0.10000E+01 volume  0.74790E-03 ppm1      3.260 ppm2      7.413 CV     1
 OR {  232}
   (( segid "    " and resid 111  and name HD3 ))
   (( segid "    " and resid 111  and name HE  ))
 ASSI {  237}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HB3 ))
      1.600     0.300     0.600 peak   237 spectrum    1 weight  0.10000E+01 volume  0.17889E-01 ppm1      1.865 ppm2      2.184 CV     1
 ASSI {  240}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name HB2 ))
      2.400     0.700     0.700 peak   240 spectrum    1 weight  0.10000E+01 volume  0.71134E-02 ppm1      3.262 ppm2      2.004 CV     1
 OR {  240}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name HB3 ))
 OR {  240}
   (( segid "    " and resid 86   and name HD3 ))
   (( segid "    " and resid 86   and name HB2 ))
 OR {  240}
   (( segid "    " and resid 86   and name HD3 ))
   (( segid "    " and resid 86   and name HB3 ))
 ASSI {  249}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HD3 ))
      3.800     1.800     1.800 peak   249 spectrum    1 weight  0.10000E+01 volume  0.20399E-02 ppm1      1.869 ppm2      3.735 CV     1
 ASSI {  250}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HD2 ))
      3.800     1.800     1.800 peak   250 spectrum    1 weight  0.10000E+01 volume  0.17057E-02 ppm1      1.870 ppm2      3.543 CV     1
 ASSI {  251}
   (( segid "    " and resid 111  and name HB3 ))
   (( segid "    " and resid 111  and name HA  ))
      2.800     1.000     1.000 peak   251 spectrum    1 weight  0.10000E+01 volume  0.21096E-02 ppm1      1.883 ppm2      4.000 CV     1
 ASSI {  262}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 45   and name H   ))
      3.700     1.700     1.700 peak   262 spectrum    1 weight  0.10000E+01 volume  0.16301E-02 ppm1      1.867 ppm2      8.101 CV     1
 ASSI {  278}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 48   and name H   ))
      2.400     0.700     0.700 peak   278 spectrum    1 weight  0.10000E+01 volume  0.33851E-02 ppm1      1.874 ppm2      8.330 CV     1
 ASSI {  288}
   (( segid "    " and resid 14   and name HG2 ))
   (( segid "    " and resid 14   and name H   ))
      3.900     1.900     1.900 peak   288 spectrum    1 weight  0.10000E+01 volume  0.12464E-02 ppm1      2.847 ppm2      8.711 CV     1
 ASSI {  289}
   (( segid "    " and resid 131  and name HA  ))
   (  segid "    " and resid 131  and name HD% )
      2.900     1.000     1.000 peak   289 spectrum    1 weight  0.10000E+01 volume  0.26573E-02 ppm1      4.736 ppm2      7.112 CV     1
 ASSI {  293}
   (( segid "    " and resid 131  and name HB3 ))
   (( segid "    " and resid 131  and name HB2 ))
      2.200     0.600     0.600 peak   293 spectrum    1 weight  0.10000E+01 volume  0.37140E-02 ppm1      3.285 ppm2      2.827 CV     1
 ASSI {  295}
   (( segid "    " and resid 14   and name HG2 ))
   (( segid "    " and resid 14   and name HA  ))
      2.900     1.100     1.100 peak   295 spectrum    1 weight  0.10000E+01 volume  0.14839E-02 ppm1      2.847 ppm2      3.978 CV     1
 ASSI {  296}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HB3 ))
      2.600     0.800     0.800 peak   296 spectrum    1 weight  0.10000E+01 volume  0.38265E-02 ppm1      4.735 ppm2      2.846 CV     1
 ASSI {  298}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HB2 ))
      3.200     1.300     1.300 peak   298 spectrum    1 weight  0.10000E+01 volume  0.25090E-02 ppm1      4.730 ppm2      3.478 CV     1
 ASSI {  299}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 132  and name HB3 ))
      4.500     2.500     1.500 peak   299 spectrum    1 weight  0.10000E+01 volume  0.98507E-03 ppm1      4.733 ppm2      1.827 CV     1
 OR {  299}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 132  and name HB2 ))
 ASSI {  303}
   (( segid "    " and resid 14   and name HG2 ))
   (( segid "    " and resid 14   and name HG3 ))
      2.100     0.600     0.600 peak   303 spectrum    1 weight  0.10000E+01 volume  0.42098E-02 ppm1      2.851 ppm2      2.144 CV     1
 ASSI {  305}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 133  and name HB2 ))
      3.300     1.400     1.400 peak   305 spectrum    1 weight  0.10000E+01 volume  0.19252E-02 ppm1      2.834 ppm2      1.797 CV     1
 OR {  305}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 133  and name HB3 ))
 ASSI {  307}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 131  and name HB2 ))
      4.300     2.300     1.700 peak   307 spectrum    1 weight  0.10000E+01 volume  0.90109E-03 ppm1      6.742 ppm2      2.828 CV     1
 ASSI {  308}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 112  and name HA  ))
      3.700     1.700     1.700 peak   308 spectrum    1 weight  0.10000E+01 volume  0.12703E-02 ppm1      6.742 ppm2      4.044 CV     1
 ASSI {  309}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 131  and name HB3 ))
      3.300     1.400     1.400 peak   309 spectrum    1 weight  0.10000E+01 volume  0.19752E-02 ppm1      6.742 ppm2      3.269 CV     1
 ASSI {  310}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 129  and name HG3 ))
      2.500     2.500     3.500 peak   310 spectrum    1 weight  0.10000E+01 volume  0.61677E-03 ppm1      6.743 ppm2      2.397 CV     1
 OR {  310}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 129  and name HG2 ))
 ASSI {  311}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 115  and name HB  ))
      3.400     1.400     1.400 peak   311 spectrum    1 weight  0.10000E+01 volume  0.10163E-02 ppm1      6.742 ppm2      2.217 CV     1
 ASSI {  312}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 127  and name HB3 ))
      2.700     0.900     0.900 peak   312 spectrum    1 weight  0.10000E+01 volume  0.27077E-02 ppm1      6.742 ppm2      1.861 CV     1
 OR {  312}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 127  and name HB2 ))
 ASSI {  313}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 127  and name HG2 ))
      3.000     1.200     1.200 peak   313 spectrum    1 weight  0.10000E+01 volume  0.23883E-02 ppm1      6.742 ppm2      1.707 CV     1
 ASSI {  316}
   (  segid "    " and resid 131  and name HE% )
   (  segid "    " and resid 115  and name HG1%)
      2.900     1.100     1.100 peak   316 spectrum    1 weight  0.10000E+01 volume  0.18832E-02 ppm1      6.742 ppm2      1.127 CV     1
 ASSI {  317}
   (  segid "    " and resid 131  and name HE% )
   (  segid "    " and resid 115  and name HG2%)
      2.200     0.600     0.600 peak   317 spectrum    1 weight  0.10000E+01 volume  0.59174E-02 ppm1      6.742 ppm2      0.943 CV     1
 ASSI {  318}
   (  segid "    " and resid 131  and name HD% )
   (( segid "    " and resid 128  and name HA  ))
      3.000     1.100     1.100 peak   318 spectrum    1 weight  0.10000E+01 volume  0.20954E-02 ppm1      7.122 ppm2      4.045 CV     1
 ASSI {  319}
   (  segid "    " and resid 131  and name HD% )
   (( segid "    " and resid 115  and name HB  ))
      4.000     2.000     2.000 peak   319 spectrum    1 weight  0.10000E+01 volume  0.64618E-03 ppm1      7.123 ppm2      2.209 CV     1
 ASSI {  320}
   (  segid "    " and resid 131  and name HD% )
   (( segid "    " and resid 127  and name HB3 ))
      3.000     1.100     1.100 peak   320 spectrum    1 weight  0.10000E+01 volume  0.21760E-02 ppm1      7.123 ppm2      1.868 CV     1
 OR {  320}
   (  segid "    " and resid 131  and name HD% )
   (( segid "    " and resid 127  and name HB2 ))
 ASSI {  321}
   (  segid "    " and resid 131  and name HD% )
   (( segid "    " and resid 130  and name HB3 ))
      3.200     1.300     1.300 peak   321 spectrum    1 weight  0.10000E+01 volume  0.21237E-02 ppm1      7.123 ppm2      1.679 CV     1
 ASSI {  322}
   (  segid "    " and resid 131  and name HD% )
   (( segid "    " and resid 130  and name HB2 ))
      2.900     1.000     1.000 peak   322 spectrum    1 weight  0.10000E+01 volume  0.13863E-02 ppm1      7.123 ppm2      1.444 CV     1
 ASSI {  323}
   (  segid "    " and resid 131  and name HD% )
   (  segid "    " and resid 115  and name HG1%)
      4.000     2.000     2.000 peak   323 spectrum    1 weight  0.10000E+01 volume  0.65698E-03 ppm1      7.124 ppm2      1.120 CV     1
 ASSI {  324}
   (  segid "    " and resid 131  and name HD% )
   (  segid "    " and resid 115  and name HG2%)
      3.200     1.300     1.300 peak   324 spectrum    1 weight  0.10000E+01 volume  0.30564E-02 ppm1      7.123 ppm2      0.946 CV     1
 ASSI {  326}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 131  and name H   ))
      2.400     2.400     3.600 peak   326 spectrum    1 weight  0.10000E+01 volume  0.93776E-03 ppm1      6.742 ppm2      7.409 CV     1
 ASSI {  327}
   (  segid "    " and resid 131  and name HE% )
   (  segid "    " and resid 131  and name HD% )
      1.900     0.400     0.400 peak   327 spectrum    1 weight  0.10000E+01 volume  0.25022E-01 ppm1      6.742 ppm2      7.120 CV     1
 ASSI {  329}
   (  segid "    " and resid 131  and name HD% )
   (( segid "    " and resid 132  and name H   ))
      2.300     2.300     3.700 peak   329 spectrum    1 weight  0.10000E+01 volume  0.10446E-02 ppm1      7.124 ppm2      7.863 CV     1
 ASSI {  330}
   (  segid "    " and resid 131  and name HD% )
   (( segid "    " and resid 130  and name H   ))
      3.000     1.200     1.200 peak   330 spectrum    1 weight  0.10000E+01 volume  0.11565E-02 ppm1      7.123 ppm2      7.762 CV     1
 ASSI {  331}
   (  segid "    " and resid 131  and name HD% )
   (( segid "    " and resid 131  and name H   ))
      3.000     1.100     1.100 peak   331 spectrum    1 weight  0.10000E+01 volume  0.24834E-02 ppm1      7.123 ppm2      7.411 CV     1
 ASSI {  334}
   (( segid "    " and resid 130  and name HB3 ))
   (( segid "    " and resid 130  and name H   ))
      3.700     1.700     1.700 peak   334 spectrum    1 weight  0.10000E+01 volume  0.11591E-02 ppm1      1.680 ppm2      7.760 CV     1
 ASSI {  336}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 130  and name H   ))
      2.300     0.700     0.700 peak   336 spectrum    1 weight  0.10000E+01 volume  0.29360E-02 ppm1      0.972 ppm2      7.760 CV     1
 ASSI {  337}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 130  and name HA  ))
      3.600     1.600     1.600 peak   337 spectrum    1 weight  0.10000E+01 volume  0.10043E-02 ppm1      1.402 ppm2      4.301 CV     1
 ASSI {  342}
   (  segid "    " and resid 130  and name HD1%)
   (  segid "    " and resid 88   and name HE% )
      3.700     1.700     1.700 peak   342 spectrum    1 weight  0.10000E+01 volume  0.10280E-02 ppm1      0.973 ppm2      7.209 CV     1
 ASSI {  343}
   (  segid "    " and resid 130  and name HD1%)
   (  segid "    " and resid 131  and name HE% )
      3.700     1.700     1.700 peak   343 spectrum    1 weight  0.10000E+01 volume  0.88025E-03 ppm1      0.974 ppm2      6.749 CV     1
 ASSI {  344}
   (  segid "    " and resid 130  and name HD1%)
   (  segid "    " and resid 131  and name HD% )
      3.700     1.700     1.700 peak   344 spectrum    1 weight  0.10000E+01 volume  0.10989E-02 ppm1      0.971 ppm2      7.113 CV     1
 ASSI {  347}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 130  and name HA  ))
      3.200     1.300     1.300 peak   347 spectrum    1 weight  0.10000E+01 volume  0.24671E-02 ppm1      0.974 ppm2      4.296 CV     1
 ASSI {  348}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 129  and name HA  ))
      4.000     2.000     2.000 peak   348 spectrum    1 weight  0.10000E+01 volume  0.11386E-02 ppm1      0.974 ppm2      4.155 CV     1
 ASSI {  350}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 127  and name HA  ))
      2.600     0.800     0.800 peak   350 spectrum    1 weight  0.10000E+01 volume  0.16613E-02 ppm1      0.971 ppm2      3.742 CV     1
 ASSI {  351}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 115  and name HA  ))
      3.300     1.400     1.400 peak   351 spectrum    1 weight  0.10000E+01 volume  0.19742E-02 ppm1      0.972 ppm2      3.345 CV     1
 ASSI {  352}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 79   and name HA  ))
      3.400     1.400     1.400 peak   352 spectrum    1 weight  0.10000E+01 volume  0.17169E-02 ppm1      0.979 ppm2      4.533 CV     1
 ASSI {  354}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 83   and name HA  ))
      3.000     1.100     1.100 peak   354 spectrum    1 weight  0.10000E+01 volume  0.34975E-02 ppm1      0.935 ppm2      4.026 CV     1
 ASSI {  355}
   (  segid "    " and resid 33   and name HG1%)
   (( segid "    " and resid 51   and name HG13))
      2.600     0.800     0.800 peak   355 spectrum    1 weight  0.10000E+01 volume  0.29173E-02 ppm1      0.939 ppm2      0.094 CV     1
 ASSI {  356}
   (  segid "    " and resid 33   and name HG1%)
   (  segid "    " and resid 32   and name HG1%)
      2.600     0.900     0.900 peak   356 spectrum    1 weight  0.10000E+01 volume  0.14299E-01 ppm1      0.940 ppm2      1.293 CV     1
 ASSI {  357}
   (  segid "    " and resid 130  and name HD1%)
   (  segid "    " and resid 119  and name HD1%)
      2.600     0.800     0.800 peak   357 spectrum    1 weight  0.10000E+01 volume  0.38262E-02 ppm1      0.973 ppm2      0.655 CV     1
 ASSI {  358}
   (  segid "    " and resid 130  and name HD1%)
   (  segid "    " and resid 124  and name HG1%)
      2.200     0.600     0.600 peak   358 spectrum    1 weight  0.10000E+01 volume  0.66008E-02 ppm1      0.972 ppm2      0.519 CV     1
 ASSI {  359}
   (  segid "    " and resid 130  and name HD1%)
   (  segid "    " and resid 124  and name HG2%)
      1.800     0.400     0.400 peak   359 spectrum    1 weight  0.10000E+01 volume  0.14486E-01 ppm1      0.971 ppm2      0.809 CV     1
 ASSI {  360}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 130  and name HB2 ))
      2.200     0.600     0.600 peak   360 spectrum    1 weight  0.10000E+01 volume  0.57145E-02 ppm1      0.973 ppm2      1.414 CV     1
 ASSI {  361}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 127  and name HB3 ))
      2.900     1.000     1.000 peak   361 spectrum    1 weight  0.10000E+01 volume  0.48817E-02 ppm1      0.977 ppm2      1.829 CV     1
 OR {  361}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 127  and name HB2 ))
 ASSI {  362}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 129  and name HG3 ))
      3.100     1.200     1.200 peak   362 spectrum    1 weight  0.10000E+01 volume  0.11106E-02 ppm1      0.971 ppm2      2.398 CV     1
 OR {  362}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 129  and name HG2 ))
 ASSI {  370}
   (( segid "    " and resid 129  and name HB3 ))
   (( segid "    " and resid 129  and name HA  ))
      2.900     1.000     1.000 peak   370 spectrum    1 weight  0.10000E+01 volume  0.23303E-02 ppm1      2.241 ppm2      4.145 CV     1
 ASSI {  371}
   (( segid "    " and resid 129  and name HB2 ))
   (( segid "    " and resid 129  and name HA  ))
      2.900     1.000     1.000 peak   371 spectrum    1 weight  0.10000E+01 volume  0.20840E-02 ppm1      2.178 ppm2      4.147 CV     1
 ASSI {  373}
   (( segid "    " and resid 129  and name HG3 ))
   (( segid "    " and resid 129  and name HA  ))
      3.100     1.200     1.200 peak   373 spectrum    1 weight  0.10000E+01 volume  0.48396E-02 ppm1      2.399 ppm2      4.147 CV     1
 OR {  373}
   (( segid "    " and resid 129  and name HG2 ))
   (( segid "    " and resid 129  and name HA  ))
 ASSI {  374}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 113  and name HG2 ))
      2.500     0.800     0.800 peak   374 spectrum    1 weight  0.10000E+01 volume  0.44903E-02 ppm1      2.235 ppm2      1.906 CV     1
 OR {  374}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 113  and name HG3 ))
 OR {  374}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 113  and name HG3 ))
 OR {  374}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 113  and name HG2 ))
 ASSI {  377}
   (( segid "    " and resid 129  and name HG3 ))
   (( segid "    " and resid 130  and name HG  ))
      2.800     1.000     1.000 peak   377 spectrum    1 weight  0.10000E+01 volume  0.23775E-02 ppm1      2.396 ppm2      1.621 CV     1
 OR {  377}
   (( segid "    " and resid 129  and name HG2 ))
   (( segid "    " and resid 130  and name HG  ))
 ASSI {  381}
   (( segid "    " and resid 129  and name HB3 ))
   (  segid "    " and resid 124  and name HG2%)
      3.600     1.600     1.600 peak   381 spectrum    1 weight  0.10000E+01 volume  0.25224E-02 ppm1      2.240 ppm2      0.811 CV     1
 ASSI {  384}
   (( segid "    " and resid 129  and name HB2 ))
   (  segid "    " and resid 124  and name HG2%)
      3.800     1.800     1.800 peak   384 spectrum    1 weight  0.10000E+01 volume  0.23972E-02 ppm1      2.176 ppm2      0.816 CV     1
 ASSI {  387}
   (( segid "    " and resid 129  and name HG3 ))
   (  segid "    " and resid 130  and name HD2%)
      2.600     0.800     0.800 peak   387 spectrum    1 weight  0.10000E+01 volume  0.41753E-02 ppm1      2.401 ppm2      0.958 CV     1
 OR {  387}
   (( segid "    " and resid 129  and name HG2 ))
   (  segid "    " and resid 130  and name HD2%)
 OR {  387}
   (( segid "    " and resid 129  and name HG3 ))
   (  segid "    " and resid 130  and name HD1%)
 OR {  387}
   (( segid "    " and resid 129  and name HG2 ))
   (  segid "    " and resid 130  and name HD1%)
 ASSI {  388}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 9    and name HZ3 ))
      3.400     1.400     1.400 peak   388 spectrum    1 weight  0.10000E+01 volume  0.91704E-03 ppm1      2.425 ppm2      6.800 CV     1
 OR {  388}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 9    and name HZ3 ))
 ASSI {  389}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 9    and name HE3 ))
      2.800     1.000     1.000 peak   389 spectrum    1 weight  0.10000E+01 volume  0.10439E-02 ppm1      2.427 ppm2      7.072 CV     1
 OR {  389}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 9    and name HE3 ))
 ASSI {  390}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 28   and name H   ))
      2.700     0.900     0.900 peak   390 spectrum    1 weight  0.10000E+01 volume  0.31757E-02 ppm1      4.150 ppm2      8.624 CV     1
 ASSI {  393}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 67   and name H   ))
      2.400     0.700     0.700 peak   393 spectrum    1 weight  0.10000E+01 volume  0.33101E-02 ppm1      2.058 ppm2      7.795 CV     1
 ASSI {  394}
   (( segid "    " and resid 128  and name HB3 ))
   (( segid "    " and resid 129  and name H   ))
      3.300     1.300     1.300 peak   394 spectrum    1 weight  0.10000E+01 volume  0.12811E-02 ppm1      1.867 ppm2      7.782 CV     1
 OR {  394}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 129  and name H   ))
 ASSI {  395}
   (( segid "    " and resid 28   and name HB3 ))
   (( segid "    " and resid 28   and name H   ))
      2.300     0.700     0.700 peak   395 spectrum    1 weight  0.10000E+01 volume  0.92734E-02 ppm1      1.990 ppm2      8.626 CV     1
 OR {  395}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 28   and name H   ))
 ASSI {  404}
   (( segid "    " and resid 127  and name HD2 ))
   (  segid "    " and resid 131  and name HE% )
      4.300     2.300     1.700 peak   404 spectrum    1 weight  0.10000E+01 volume  0.58226E-03 ppm1      3.248 ppm2      6.745 CV     1
 OR {  404}
   (( segid "    " and resid 127  and name HD3 ))
   (  segid "    " and resid 131  and name HE% )
 ASSI {  405}
   (( segid "    " and resid 127  and name HD2 ))
   (  segid "    " and resid 131  and name HE% )
      4.300     2.300     1.700 peak   405 spectrum    1 weight  0.10000E+01 volume  0.51051E-03 ppm1      3.200 ppm2      6.744 CV     1
 ASSI {  410}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 126  and name H   ))
      3.700     1.700     1.700 peak   410 spectrum    1 weight  0.10000E+01 volume  0.12356E-02 ppm1      2.222 ppm2      7.624 CV     1
 ASSI {  411}
   (( segid "    " and resid 126  and name HB3 ))
   (( segid "    " and resid 126  and name H   ))
      3.200     1.300     1.300 peak   411 spectrum    1 weight  0.10000E+01 volume  0.14267E-02 ppm1      1.958 ppm2      7.627 CV     1
 ASSI {  412}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 126  and name H   ))
      2.500     0.800     0.800 peak   412 spectrum    1 weight  0.10000E+01 volume  0.17807E-02 ppm1      2.295 ppm2      7.627 CV     1
 ASSI {  413}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 126  and name H   ))
      3.200     1.300     1.300 peak   413 spectrum    1 weight  0.10000E+01 volume  0.18822E-02 ppm1      2.206 ppm2      7.626 CV     1
 ASSI {  415}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 128  and name H   ))
      4.200     2.200     1.800 peak   415 spectrum    1 weight  0.10000E+01 volume  0.71870E-03 ppm1      4.562 ppm2      8.621 CV     1
 ASSI {  416}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 129  and name H   ))
      4.800     2.900     1.200 peak   416 spectrum    1 weight  0.10000E+01 volume  0.50402E-03 ppm1      4.576 ppm2      7.783 CV     1
 ASSI {  418}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 126  and name HB3 ))
      2.600     0.800     0.800 peak   418 spectrum    1 weight  0.10000E+01 volume  0.31505E-02 ppm1      4.566 ppm2      1.953 CV     1
 ASSI {  419}
   (( segid "    " and resid 126  and name HA  ))
   (  segid "    " and resid 119  and name HD2%)
      3.000     1.100     1.100 peak   419 spectrum    1 weight  0.10000E+01 volume  0.16383E-02 ppm1      4.563 ppm2      0.803 CV     1
 ASSI {  420}
   (( segid "    " and resid 126  and name HA  ))
   (  segid "    " and resid 119  and name HD1%)
      3.400     1.400     1.400 peak   420 spectrum    1 weight  0.10000E+01 volume  0.17951E-02 ppm1      4.563 ppm2      0.657 CV     1
 ASSI {  421}
   (( segid "    " and resid 126  and name HB2 ))
   (  segid "    " and resid 119  and name HD1%)
      4.300     2.300     1.700 peak   421 spectrum    1 weight  0.10000E+01 volume  0.90637E-03 ppm1      2.221 ppm2      0.663 CV     1
 ASSI {  422}
   (( segid "    " and resid 126  and name HB3 ))
   (  segid "    " and resid 119  and name HD1%)
      4.500     2.600     1.500 peak   422 spectrum    1 weight  0.10000E+01 volume  0.89194E-03 ppm1      1.967 ppm2      0.667 CV     1
 ASSI {  423}
   (( segid "    " and resid 126  and name HB2 ))
   (  segid "    " and resid 125  and name HB% )
      4.000     2.000     2.000 peak   423 spectrum    1 weight  0.10000E+01 volume  0.16379E-02 ppm1      2.216 ppm2      1.475 CV     1
 ASSI {  424}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 126  and name HB3 ))
      1.800     0.400     0.400 peak   424 spectrum    1 weight  0.10000E+01 volume  0.11456E-01 ppm1      2.222 ppm2      1.962 CV     1
 ASSI {  425}
   (( segid "    " and resid 126  and name HB3 ))
   (( segid "    " and resid 129  and name HG2 ))
      3.900     1.900     1.900 peak   425 spectrum    1 weight  0.10000E+01 volume  0.24545E-02 ppm1      1.958 ppm2      2.390 CV     1
 OR {  425}
   (( segid "    " and resid 126  and name HB3 ))
   (( segid "    " and resid 129  and name HG3 ))
 ASSI {  426}
   (( segid "    " and resid 126  and name HB3 ))
   (( segid "    " and resid 126  and name HB2 ))
      1.800     0.400     0.400 peak   426 spectrum    1 weight  0.10000E+01 volume  0.14600E-01 ppm1      1.958 ppm2      2.218 CV     1
 OR {  426}
   (( segid "    " and resid 126  and name HB3 ))
   (( segid "    " and resid 126  and name HG3 ))
 ASSI {  427}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 128  and name HD3 ))
      3.500     1.600     1.600 peak   427 spectrum    1 weight  0.10000E+01 volume  0.84379E-03 ppm1      2.221 ppm2      3.201 CV     1
 OR {  427}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 128  and name HD2 ))
 ASSI {  428}
   (( segid "    " and resid 126  and name HB3 ))
   (( segid "    " and resid 128  and name HD3 ))
      4.300     2.300     1.700 peak   428 spectrum    1 weight  0.10000E+01 volume  0.67783E-03 ppm1      1.957 ppm2      3.198 CV     1
 OR {  428}
   (( segid "    " and resid 126  and name HB3 ))
   (( segid "    " and resid 128  and name HD2 ))
 ASSI {  429}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 126  and name HA  ))
      3.300     1.300     1.300 peak   429 spectrum    1 weight  0.10000E+01 volume  0.89338E-03 ppm1      2.220 ppm2      4.566 CV     1
 ASSI {  431}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 127  and name H   ))
      3.700     1.700     1.700 peak   431 spectrum    1 weight  0.10000E+01 volume  0.51212E-03 ppm1      2.222 ppm2      9.024 CV     1
 ASSI {  432}
   (( segid "    " and resid 126  and name HB2 ))
   (( segid "    " and resid 128  and name H   ))
      3.200     1.300     1.300 peak   432 spectrum    1 weight  0.10000E+01 volume  0.70725E-03 ppm1      2.231 ppm2      8.602 CV     1
 ASSI {  433}
   (( segid "    " and resid 126  and name HB3 ))
   (( segid "    " and resid 129  and name H   ))
      5.100     3.300     0.900 peak   433 spectrum    1 weight  0.10000E+01 volume  0.78892E-03 ppm1      1.960 ppm2      7.786 CV     1
 ASSI {  434}
   (( segid "    " and resid 126  and name HB3 ))
   (( segid "    " and resid 128  and name H   ))
      5.000     3.100     1.000 peak   434 spectrum    1 weight  0.10000E+01 volume  0.71555E-03 ppm1      1.956 ppm2      8.604 CV     1
 ASSI {  435}
   (( segid "    " and resid 126  and name HB3 ))
   (( segid "    " and resid 127  and name H   ))
      4.900     2.900     1.100 peak   435 spectrum    1 weight  0.10000E+01 volume  0.52680E-03 ppm1      1.959 ppm2      9.024 CV     1
 ASSI {  436}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 129  and name H   ))
      4.500     2.500     1.500 peak   436 spectrum    1 weight  0.10000E+01 volume  0.10589E-02 ppm1      2.297 ppm2      7.785 CV     1
 ASSI {  437}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 129  and name H   ))
      2.700     0.900     0.900 peak   437 spectrum    1 weight  0.10000E+01 volume  0.11835E-02 ppm1      2.207 ppm2      7.781 CV     1
 ASSI {  438}
   (( segid "    " and resid 12   and name HG3 ))
   (( segid "    " and resid 12   and name H   ))
      3.700     1.700     1.700 peak   438 spectrum    1 weight  0.10000E+01 volume  0.14505E-02 ppm1      2.300 ppm2      8.967 CV     1
 ASSI {  441}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 127  and name H   ))
      4.100     2.100     1.900 peak   441 spectrum    1 weight  0.10000E+01 volume  0.63892E-03 ppm1      2.208 ppm2      9.025 CV     1
 ASSI {  444}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 126  and name HA  ))
      3.700     1.700     1.700 peak   444 spectrum    1 weight  0.10000E+01 volume  0.11279E-02 ppm1      2.296 ppm2      4.569 CV     1
 ASSI {  445}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 126  and name HA  ))
      3.800     1.800     1.800 peak   445 spectrum    1 weight  0.10000E+01 volume  0.10231E-02 ppm1      2.207 ppm2      4.567 CV     1
 ASSI {  449}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 128  and name HA  ))
      4.000     2.000     2.000 peak   449 spectrum    1 weight  0.10000E+01 volume  0.98082E-03 ppm1      2.191 ppm2      4.050 CV     1
 ASSI {  450}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 28   and name HA  ))
      2.500     0.800     0.800 peak   450 spectrum    1 weight  0.10000E+01 volume  0.55431E-02 ppm1      2.304 ppm2      4.144 CV     1
 ASSI {  453}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 128  and name HD3 ))
      4.200     2.200     1.800 peak   453 spectrum    1 weight  0.10000E+01 volume  0.90246E-03 ppm1      2.298 ppm2      3.201 CV     1
 OR {  453}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 128  and name HD2 ))
 ASSI {  454}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 128  and name HD3 ))
      3.700     1.700     1.700 peak   454 spectrum    1 weight  0.10000E+01 volume  0.81809E-03 ppm1      2.207 ppm2      3.199 CV     1
 OR {  454}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 128  and name HD2 ))
 ASSI {  455}
   (( segid "    " and resid 126  and name HG2 ))
   (  segid "    " and resid 124  and name HG1%)
      5.400     3.600     0.600 peak   455 spectrum    1 weight  0.10000E+01 volume  0.48427E-03 ppm1      2.298 ppm2      0.523 CV     1
 ASSI {  456}
   (( segid "    " and resid 126  and name HG2 ))
   (  segid "    " and resid 119  and name HD1%)
      4.300     2.300     1.700 peak   456 spectrum    1 weight  0.10000E+01 volume  0.10974E-02 ppm1      2.296 ppm2      0.661 CV     1
 ASSI {  457}
   (( segid "    " and resid 126  and name HG3 ))
   (  segid "    " and resid 119  and name HD1%)
      4.000     2.000     2.000 peak   457 spectrum    1 weight  0.10000E+01 volume  0.13162E-02 ppm1      2.204 ppm2      0.661 CV     1
 ASSI {  459}
   (( segid "    " and resid 126  and name HG2 ))
   (  segid "    " and resid 125  and name HB% )
      2.500     0.800     0.800 peak   459 spectrum    1 weight  0.10000E+01 volume  0.47994E-02 ppm1      2.296 ppm2      1.468 CV     1
 ASSI {  465}
   (( segid "    " and resid 125  and name HA  ))
   (  segid "    " and resid 119  and name HD1%)
      3.800     1.800     1.800 peak   465 spectrum    1 weight  0.10000E+01 volume  0.13796E-02 ppm1      4.304 ppm2      0.658 CV     1
 ASSI {  466}
   (( segid "    " and resid 125  and name HA  ))
   (  segid "    " and resid 124  and name HG1%)
      4.000     2.000     2.000 peak   466 spectrum    1 weight  0.10000E+01 volume  0.74158E-03 ppm1      4.301 ppm2      0.518 CV     1
 ASSI {  468}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name HG2 ))
      4.500     2.600     1.500 peak   468 spectrum    1 weight  0.10000E+01 volume  0.71477E-03 ppm1      4.296 ppm2      2.269 CV     1
 OR {  468}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name HB2 ))
 ASSI {  469}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 126  and name H   ))
      3.300     1.400     1.400 peak   469 spectrum    1 weight  0.10000E+01 volume  0.13654E-02 ppm1      4.301 ppm2      7.623 CV     1
 ASSI {  470}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 125  and name H   ))
      2.900     1.100     1.100 peak   470 spectrum    1 weight  0.10000E+01 volume  0.20250E-02 ppm1      4.304 ppm2      8.859 CV     1
 ASSI {  471}
   (  segid "    " and resid 125  and name HB% )
   (( segid "    " and resid 125  and name H   ))
      2.300     0.700     0.700 peak   471 spectrum    1 weight  0.10000E+01 volume  0.84216E-02 ppm1      1.466 ppm2      8.858 CV     1
 ASSI {  472}
   (  segid "    " and resid 125  and name HB% )
   (( segid "    " and resid 126  and name H   ))
      2.600     0.800     0.800 peak   472 spectrum    1 weight  0.10000E+01 volume  0.56239E-02 ppm1      1.465 ppm2      7.626 CV     1
 ASSI {  473}
   (  segid "    " and resid 125  and name HB% )
   (( segid "    " and resid 124  and name H   ))
      2.500     2.500     3.500 peak   473 spectrum    1 weight  0.10000E+01 volume  0.64669E-03 ppm1      1.465 ppm2      6.792 CV     1
 ASSI {  474}
   (  segid "    " and resid 125  and name HB% )
   (( segid "    " and resid 125  and name HA  ))
      2.200     0.600     0.600 peak   474 spectrum    1 weight  0.10000E+01 volume  0.16201E-01 ppm1      1.466 ppm2      4.302 CV     1
 ASSI {  477}
   (  segid "    " and resid 125  and name HB% )
   (( segid "    " and resid 129  and name HG2 ))
      3.800     1.800     1.800 peak   477 spectrum    1 weight  0.10000E+01 volume  0.20740E-02 ppm1      1.465 ppm2      2.383 CV     1
 OR {  477}
   (  segid "    " and resid 125  and name HB% )
   (( segid "    " and resid 129  and name HG3 ))
 ASSI {  478}
   (  segid "    " and resid 125  and name HB% )
   (  segid "    " and resid 124  and name HG2%)
      3.600     1.600     1.600 peak   478 spectrum    1 weight  0.10000E+01 volume  0.34824E-02 ppm1      1.466 ppm2      0.810 CV     1
 ASSI {  479}
   (  segid "    " and resid 125  and name HB% )
   (  segid "    " and resid 119  and name HD1%)
      3.700     1.700     1.700 peak   479 spectrum    1 weight  0.10000E+01 volume  0.27230E-02 ppm1      1.466 ppm2      0.662 CV     1
 ASSI {  480}
   (  segid "    " and resid 125  and name HB% )
   (  segid "    " and resid 124  and name HG1%)
      4.000     2.000     2.000 peak   480 spectrum    1 weight  0.10000E+01 volume  0.20300E-02 ppm1      1.465 ppm2      0.519 CV     1
 ASSI {  481}
   (  segid "    " and resid 125  and name HB% )
   (  segid "    " and resid 130  and name HD2%)
      4.500     2.500     1.500 peak   481 spectrum    1 weight  0.10000E+01 volume  0.16810E-02 ppm1      1.462 ppm2      0.958 CV     1
 OR {  481}
   (  segid "    " and resid 125  and name HB% )
   (  segid "    " and resid 130  and name HD1%)
 ASSI {  482}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 125  and name H   ))
      2.600     0.800     0.800 peak   482 spectrum    1 weight  0.10000E+01 volume  0.27968E-02 ppm1      4.269 ppm2      8.858 CV     1
 ASSI {  484}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 125  and name H   ))
      2.400     0.700     0.700 peak   484 spectrum    1 weight  0.10000E+01 volume  0.35056E-02 ppm1      0.808 ppm2      8.859 CV     1
 ASSI {  485}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 125  and name H   ))
      3.700     1.700     1.700 peak   485 spectrum    1 weight  0.10000E+01 volume  0.19829E-02 ppm1      0.514 ppm2      8.859 CV     1
 ASSI {  486}
   (( segid "    " and resid 124  and name HA  ))
   (  segid "    " and resid 124  and name HG1%)
      3.300     1.300     1.300 peak   486 spectrum    1 weight  0.10000E+01 volume  0.19993E-02 ppm1      4.269 ppm2      0.518 CV     1
 ASSI {  487}
   (( segid "    " and resid 124  and name HA  ))
   (  segid "    " and resid 124  and name HG2%)
      2.700     0.900     0.900 peak   487 spectrum    1 weight  0.10000E+01 volume  0.40630E-02 ppm1      4.269 ppm2      0.807 CV     1
 ASSI {  489}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HB  ))
      2.600     0.800     0.800 peak   489 spectrum    1 weight  0.10000E+01 volume  0.32261E-02 ppm1      4.269 ppm2      1.896 CV     1
 ASSI {  491}
   (( segid "    " and resid 124  and name HB  ))
   (  segid "    " and resid 119  and name HD1%)
      3.500     1.600     1.600 peak   491 spectrum    1 weight  0.10000E+01 volume  0.22585E-02 ppm1      1.892 ppm2      0.647 CV     1
 ASSI {  492}
   (( segid "    " and resid 124  and name HB  ))
   (  segid "    " and resid 124  and name HG1%)
      2.100     0.600     0.600 peak   492 spectrum    1 weight  0.10000E+01 volume  0.67128E-02 ppm1      1.892 ppm2      0.518 CV     1
 ASSI {  493}
   (( segid "    " and resid 124  and name HB  ))
   (  segid "    " and resid 130  and name HD1%)
      3.000     1.100     1.100 peak   493 spectrum    1 weight  0.10000E+01 volume  0.24723E-02 ppm1      1.890 ppm2      0.947 CV     1
 OR {  493}
   (( segid "    " and resid 124  and name HB  ))
   (  segid "    " and resid 130  and name HD2%)
 ASSI {  494}
   (( segid "    " and resid 124  and name HB  ))
   (  segid "    " and resid 125  and name HB% )
      4.500     2.500     1.500 peak   494 spectrum    1 weight  0.10000E+01 volume  0.12736E-02 ppm1      1.897 ppm2      1.467 CV     1
 ASSI {  495}
   (( segid "    " and resid 124  and name HB  ))
   (( segid "    " and resid 129  and name HG3 ))
      3.400     1.400     1.400 peak   495 spectrum    1 weight  0.10000E+01 volume  0.14881E-02 ppm1      1.892 ppm2      2.395 CV     1
 OR {  495}
   (( segid "    " and resid 124  and name HB  ))
   (( segid "    " and resid 129  and name HG2 ))
 ASSI {  498}
   (( segid "    " and resid 124  and name HB  ))
   (( segid "    " and resid 119  and name HA  ))
      4.300     2.400     1.700 peak   498 spectrum    1 weight  0.10000E+01 volume  0.10409E-02 ppm1      1.890 ppm2      4.155 CV     1
 ASSI {  499}
   (  segid "    " and resid 124  and name HG2%)
   (  segid "    " and resid 124  and name HG1%)
      1.700     0.400     0.500 peak   499 spectrum    1 weight  0.10000E+01 volume  0.31241E-01 ppm1      0.807 ppm2      0.520 CV     1
 ASSI {  500}
   (  segid "    " and resid 124  and name HG2%)
   (  segid "    " and resid 130  and name HD2%)
      1.600     0.300     0.600 peak   500 spectrum    1 weight  0.10000E+01 volume  0.42043E-01 ppm1      0.807 ppm2      0.938 CV     1
 OR {  500}
   (  segid "    " and resid 124  and name HG2%)
   (  segid "    " and resid 130  and name HD1%)
 ASSI {  501}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 129  and name HG2 ))
      2.200     0.600     0.600 peak   501 spectrum    1 weight  0.10000E+01 volume  0.57183E-02 ppm1      0.806 ppm2      2.392 CV     1
 OR {  501}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 129  and name HG3 ))
 ASSI {  503}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 124  and name HB  ))
      1.900     0.500     0.500 peak   503 spectrum    1 weight  0.10000E+01 volume  0.13885E-01 ppm1      0.807 ppm2      1.895 CV     1
 ASSI {  504}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 130  and name HG  ))
      2.400     0.700     0.700 peak   504 spectrum    1 weight  0.10000E+01 volume  0.85630E-02 ppm1      0.806 ppm2      1.632 CV     1
 OR {  504}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 130  and name HB3 ))
 ASSI {  510}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 129  and name HG3 ))
      3.900     1.900     1.900 peak   510 spectrum    1 weight  0.10000E+01 volume  0.19097E-02 ppm1      0.514 ppm2      2.393 CV     1
 OR {  510}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 129  and name HG2 ))
 ASSI {  515}
   (  segid "    " and resid 124  and name HG1%)
   (  segid "    " and resid 130  and name HD1%)
      1.800     0.400     0.400 peak   515 spectrum    1 weight  0.10000E+01 volume  0.19005E-01 ppm1      0.514 ppm2      0.947 CV     1
 OR {  515}
   (  segid "    " and resid 124  and name HG1%)
   (  segid "    " and resid 130  and name HD2%)
 ASSI {  518}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 119  and name HA  ))
      2.500     0.800     0.800 peak   518 spectrum    1 weight  0.10000E+01 volume  0.38708E-02 ppm1      0.515 ppm2      4.146 CV     1
 ASSI {  519}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 122  and name HA2 ))
      3.000     1.100     1.100 peak   519 spectrum    1 weight  0.10000E+01 volume  0.14949E-02 ppm1      0.514 ppm2      3.975 CV     1
 ASSI {  520}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 127  and name HA  ))
      3.600     1.600     1.600 peak   520 spectrum    1 weight  0.10000E+01 volume  0.17101E-02 ppm1      0.514 ppm2      3.737 CV     1
 ASSI {  521}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 115  and name HA  ))
      3.900     1.900     1.900 peak   521 spectrum    1 weight  0.10000E+01 volume  0.87850E-03 ppm1      0.516 ppm2      3.341 CV     1
 ASSI {  523}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 118  and name H   ))
      4.400     2.400     1.600 peak   523 spectrum    1 weight  0.10000E+01 volume  0.96796E-03 ppm1      0.515 ppm2      8.396 CV     1
 ASSI {  524}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 116  and name H   ))
      3.100     1.200     1.200 peak   524 spectrum    1 weight  0.10000E+01 volume  0.10387E-02 ppm1      0.514 ppm2      8.140 CV     1
 ASSI {  525}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 119  and name H   ))
      3.000     1.100     1.100 peak   525 spectrum    1 weight  0.10000E+01 volume  0.23542E-02 ppm1      0.514 ppm2      7.865 CV     1
 ASSI {  527}
   (  segid "    " and resid 124  and name HG1%)
   (  segid "    " and resid 88   and name HE% )
      2.900     1.100     1.100 peak   527 spectrum    1 weight  0.10000E+01 volume  0.29280E-02 ppm1      0.514 ppm2      7.211 CV     1
 ASSI {  531}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 126  and name H   ))
      2.100     0.500     0.500 peak   531 spectrum    1 weight  0.10000E+01 volume  0.57040E-02 ppm1      0.805 ppm2      7.597 CV     1
 ASSI {  532}
   (  segid "    " and resid 124  and name HG2%)
   (  segid "    " and resid 88   and name HE% )
      2.500     2.500     3.500 peak   532 spectrum    1 weight  0.10000E+01 volume  0.10437E-01 ppm1      0.806 ppm2      7.213 CV     1
 ASSI {  533}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 124  and name H   ))
      2.800     1.000     1.000 peak   533 spectrum    1 weight  0.10000E+01 volume  0.49021E-02 ppm1      0.805 ppm2      6.794 CV     1
 ASSI {  535}
   (( segid "    " and resid 124  and name HB  ))
   (( segid "    " and resid 126  and name H   ))
      4.100     2.200     1.900 peak   535 spectrum    1 weight  0.10000E+01 volume  0.16496E-02 ppm1      1.892 ppm2      7.624 CV     1
 ASSI {  536}
   (( segid "    " and resid 124  and name HB  ))
   (( segid "    " and resid 124  and name H   ))
      3.500     1.500     1.500 peak   536 spectrum    1 weight  0.10000E+01 volume  0.11996E-02 ppm1      1.892 ppm2      6.793 CV     1
 ASSI {  538}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 126  and name H   ))
      4.400     2.500     1.600 peak   538 spectrum    1 weight  0.10000E+01 volume  0.97130E-03 ppm1      4.265 ppm2      7.621 CV     1
 ASSI {  540}
   (( segid "    " and resid 123  and name HB3 ))
   (( segid "    " and resid 123  and name H   ))
      4.600     2.700     1.400 peak   540 spectrum    1 weight  0.10000E+01 volume  0.39297E-03 ppm1      0.612 ppm2      7.561 CV     1
 ASSI {  541}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 123  and name H   ))
      2.900     1.100     1.100 peak   541 spectrum    1 weight  0.10000E+01 volume  0.16418E-02 ppm1      3.962 ppm2      7.565 CV     1
 ASSI {  542}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 124  and name H   ))
      3.400     1.400     1.400 peak   542 spectrum    1 weight  0.10000E+01 volume  0.87534E-03 ppm1      3.959 ppm2      6.793 CV     1
 ASSI {  543}
   (  segid "    " and resid 123  and name HD2%)
   (( segid "    " and resid 123  and name H   ))
      3.600     1.600     1.600 peak   543 spectrum    1 weight  0.10000E+01 volume  0.23798E-02 ppm1      0.630 ppm2      7.561 CV     1
 ASSI {  547}
   (( segid "    " and resid 123  and name HA  ))
   (  segid "    " and resid 88   and name HE% )
      4.800     2.900     1.200 peak   547 spectrum    1 weight  0.10000E+01 volume  0.33539E-03 ppm1      3.959 ppm2      7.223 CV     1
 ASSI {  548}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 88   and name HZ  ))
      4.600     2.700     1.400 peak   548 spectrum    1 weight  0.10000E+01 volume  0.30436E-03 ppm1      3.973 ppm2      7.109 CV     1
 ASSI {  549}
   (( segid "    " and resid 123  and name HB2 ))
   (  segid "    " and resid 88   and name HE% )
      6.000     5.000     0.000 peak   549 spectrum    1 weight  0.10000E+01 volume  0.96487E-04 ppm1      1.065 ppm2      7.213 CV     1
 ASSI {  550}
   (( segid "    " and resid 123  and name HB3 ))
   (  segid "    " and resid 88   and name HE% )
      3.800     1.800     1.800 peak   550 spectrum    1 weight  0.10000E+01 volume  0.22150E-03 ppm1      0.622 ppm2      7.211 CV     1
 ASSI {  552}
   (  segid "    " and resid 123  and name HD2%)
   (( segid "    " and resid 123  and name HA  ))
      2.400     2.400     3.600 peak   552 spectrum    1 weight  0.10000E+01 volume  0.42744E-02 ppm1      0.631 ppm2      3.957 CV     1
 ASSI {  553}
   (  segid "    " and resid 123  and name HD2%)
   (( segid "    " and resid 85   and name HA  ))
      1.900     1.900     4.100 peak   553 spectrum    1 weight  0.10000E+01 volume  0.39246E-02 ppm1      0.631 ppm2      3.854 CV     1
 ASSI {  556}
   (  segid "    " and resid 123  and name HD2%)
   (( segid "    " and resid 88   and name HB3 ))
      2.300     0.700     0.700 peak   556 spectrum    1 weight  0.10000E+01 volume  0.10953E-02 ppm1      0.632 ppm2      3.191 CV     1
 ASSI {  559}
   (  segid "    " and resid 123  and name HD2%)
   (( segid "    " and resid 85   and name HG3 ))
      2.400     0.700     0.700 peak   559 spectrum    1 weight  0.10000E+01 volume  0.47743E-02 ppm1      0.631 ppm2      2.283 CV     1
 ASSI {  560}
   (  segid "    " and resid 123  and name HD2%)
   (( segid "    " and resid 123  and name HG  ))
      2.200     0.600     0.600 peak   560 spectrum    1 weight  0.10000E+01 volume  0.67578E-02 ppm1      0.631 ppm2      1.358 CV     1
 ASSI {  562}
   (  segid "    " and resid 123  and name HD1%)
   (( segid "    " and resid 88   and name HB2 ))
      3.500     1.500     1.500 peak   562 spectrum    1 weight  0.10000E+01 volume  0.16110E-02 ppm1      0.789 ppm2      2.978 CV     1
 ASSI {  563}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 61   and name HB2 ))
      4.400     2.400     1.600 peak   563 spectrum    1 weight  0.10000E+01 volume  0.79708E-03 ppm1      0.785 ppm2      2.703 CV     1
 OR {  563}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 61   and name HB3 ))
 ASSI {  565}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 55   and name HB  ))
      2.200     0.600     0.600 peak   565 spectrum    1 weight  0.10000E+01 volume  0.10174E-01 ppm1      0.782 ppm2      2.002 CV     1
 ASSI {  566}
   (  segid "    " and resid 55   and name HG2%)
   (  segid "    " and resid 60   and name HB% )
      2.800     1.000     1.000 peak   566 spectrum    1 weight  0.10000E+01 volume  0.10330E-01 ppm1      0.783 ppm2      1.238 CV     1
 ASSI {  569}
   (( segid "    " and resid 123  and name HG  ))
   (( segid "    " and resid 118  and name HA  ))
      5.900     4.400     0.100 peak   569 spectrum    1 weight  0.10000E+01 volume  0.94189E-04 ppm1      1.358 ppm2      3.653 CV     1
 ASSI {  572}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 123  and name HB3 ))
      2.300     0.600     0.600 peak   572 spectrum    1 weight  0.10000E+01 volume  0.15401E-02 ppm1      1.051 ppm2      0.626 CV     1
 OR {  572}
   (( segid "    " and resid 123  and name HB2 ))
   (  segid "    " and resid 123  and name HD2%)
 ASSI {  576}
   (( segid "    " and resid 123  and name HB3 ))
   (( segid "    " and resid 123  and name HB2 ))
      3.000     3.000     3.000 peak   576 spectrum    1 weight  0.10000E+01 volume  0.19734E-03 ppm1      0.627 ppm2      1.052 CV     1
 ASSI {  577}
   (( segid "    " and resid 123  and name HB3 ))
   (( segid "    " and resid 123  and name HG  ))
      4.300     2.300     1.700 peak   577 spectrum    1 weight  0.10000E+01 volume  0.22419E-03 ppm1      0.607 ppm2      1.347 CV     1
 ASSI {  578}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 123  and name HG  ))
      3.300     1.300     1.300 peak   578 spectrum    1 weight  0.10000E+01 volume  0.34494E-03 ppm1      1.048 ppm2      1.342 CV     1
 ASSI {  579}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 123  and name HA  ))
      3.800     1.800     1.800 peak   579 spectrum    1 weight  0.10000E+01 volume  0.47374E-03 ppm1      1.050 ppm2      3.965 CV     1
 ASSI {  580}
   (( segid "    " and resid 123  and name HB3 ))
   (( segid "    " and resid 123  and name HA  ))
      3.500     1.500     1.500 peak   580 spectrum    1 weight  0.10000E+01 volume  0.41317E-03 ppm1      0.624 ppm2      3.961 CV     1
 ASSI {  581}
   (( segid "    " and resid 123  and name HG  ))
   (( segid "    " and resid 122  and name H   ))
      4.700     2.800     1.300 peak   581 spectrum    1 weight  0.10000E+01 volume  0.32480E-03 ppm1      1.338 ppm2      7.830 CV     1
 ASSI {  584}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 56   and name H   ))
      2.700     0.900     0.900 peak   584 spectrum    1 weight  0.10000E+01 volume  0.34610E-02 ppm1      0.784 ppm2      8.093 CV     1
 ASSI {  586}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 55   and name H   ))
      2.400     0.700     0.700 peak   586 spectrum    1 weight  0.10000E+01 volume  0.69533E-02 ppm1      0.781 ppm2      7.494 CV     1
 ASSI {  588}
   (  segid "    " and resid 123  and name HD2%)
   (  segid "    " and resid 88   and name HE% )
      2.800     0.900     0.900 peak   588 spectrum    1 weight  0.10000E+01 volume  0.19121E-02 ppm1      0.632 ppm2      7.216 CV     1
 ASSI {  589}
   (  segid "    " and resid 123  and name HD2%)
   (  segid "    " and resid 88   and name HD% )
      3.000     1.200     1.200 peak   589 spectrum    1 weight  0.10000E+01 volume  0.24684E-02 ppm1      0.628 ppm2      7.044 CV     1
 OR {  589}
   (  segid "    " and resid 123  and name HD2%)
   (( segid "    " and resid 88   and name HZ  ))
 ASSI {  592}
   (( segid "    " and resid 122  and name HA3 ))
   (( segid "    " and resid 122  and name H   ))
      3.500     1.600     1.600 peak   592 spectrum    1 weight  0.10000E+01 volume  0.14209E-02 ppm1      3.780 ppm2      7.833 CV     1
 ASSI {  593}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 124  and name H   ))
      4.200     2.200     1.800 peak   593 spectrum    1 weight  0.10000E+01 volume  0.20472E-03 ppm1      3.994 ppm2      6.782 CV     1
 ASSI {  594}
   (( segid "    " and resid 122  and name HA3 ))
   (( segid "    " and resid 124  and name H   ))
      5.300     3.500     0.700 peak   594 spectrum    1 weight  0.10000E+01 volume  0.29362E-03 ppm1      3.783 ppm2      6.786 CV     1
 ASSI {  595}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 123  and name H   ))
      3.900     1.900     1.900 peak   595 spectrum    1 weight  0.10000E+01 volume  0.39537E-03 ppm1      4.001 ppm2      7.567 CV     1
 ASSI {  602}
   (( segid "    " and resid 29   and name HA3 ))
   (( segid "    " and resid 29   and name HA2 ))
      2.200     0.600     0.600 peak   602 spectrum    1 weight  0.10000E+01 volume  0.51068E-02 ppm1      3.750 ppm2      4.088 CV     1
 ASSI {  604}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 122  and name HA3 ))
      2.400     0.700     0.700 peak   604 spectrum    1 weight  0.10000E+01 volume  0.24952E-02 ppm1      4.018 ppm2      3.821 CV     1
 ASSI {  605}
   (( segid "    " and resid 121  and name HB3 ))
   (( segid "    " and resid 121  and name H   ))
      3.800     1.800     1.800 peak   605 spectrum    1 weight  0.10000E+01 volume  0.87797E-03 ppm1      1.447 ppm2      8.139 CV     1
 ASSI {  606}
   (( segid "    " and resid 121  and name HB2 ))
   (( segid "    " and resid 121  and name H   ))
      3.700     1.700     1.700 peak   606 spectrum    1 weight  0.10000E+01 volume  0.43250E-03 ppm1      1.625 ppm2      8.143 CV     1
 ASSI {  608}
   (( segid "    " and resid 121  and name HA  ))
   (  segid "    " and resid 121  and name HD1%)
      3.200     1.300     1.300 peak   608 spectrum    1 weight  0.10000E+01 volume  0.55822E-02 ppm1      4.151 ppm2      0.725 CV     1
 ASSI {  609}
   (( segid "    " and resid 121  and name HA  ))
   (  segid "    " and resid 121  and name HD2%)
      3.100     1.200     1.200 peak   609 spectrum    1 weight  0.10000E+01 volume  0.26719E-02 ppm1      4.153 ppm2      0.609 CV     1
 ASSI {  613}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HA  ))
      3.500     1.500     1.500 peak   613 spectrum    1 weight  0.10000E+01 volume  0.11202E-02 ppm1      1.561 ppm2      4.462 CV     1
 ASSI {  616}
   (( segid "    " and resid 121  and name HB3 ))
   (( segid "    " and resid 122  and name H   ))
      4.500     2.500     1.500 peak   616 spectrum    1 weight  0.10000E+01 volume  0.48344E-03 ppm1      1.442 ppm2      7.836 CV     1
 ASSI {  617}
   (( segid "    " and resid 121  and name HB3 ))
   (( segid "    " and resid 123  and name H   ))
      4.900     3.000     1.100 peak   617 spectrum    1 weight  0.10000E+01 volume  0.35844E-03 ppm1      1.446 ppm2      7.553 CV     1
 ASSI {  621}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 85   and name HE22))
      3.300     1.400     1.400 peak   621 spectrum    1 weight  0.10000E+01 volume  0.11923E-02 ppm1      0.729 ppm2      7.227 CV     1
 ASSI {  622}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 123  and name H   ))
      3.800     1.800     1.800 peak   622 spectrum    1 weight  0.10000E+01 volume  0.11833E-02 ppm1      0.726 ppm2      7.550 CV     1
 ASSI {  625}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 118  and name H   ))
      4.400     2.400     1.600 peak   625 spectrum    1 weight  0.10000E+01 volume  0.35299E-03 ppm1      0.725 ppm2      8.394 CV     1
 ASSI {  632}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 88   and name H   ))
      3.100     1.200     1.200 peak   632 spectrum    1 weight  0.10000E+01 volume  0.21891E-02 ppm1      0.601 ppm2      8.872 CV     1
 ASSI {  633}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 20   and name H   ))
      3.300     1.400     1.400 peak   633 spectrum    1 weight  0.10000E+01 volume  0.27110E-02 ppm1      0.599 ppm2      8.666 CV     1
 ASSI {  639}
   (  segid "    " and resid 121  and name HD2%)
   (( segid "    " and resid 121  and name HG  ))
      2.100     0.600     0.600 peak   639 spectrum    1 weight  0.10000E+01 volume  0.11325E-01 ppm1      0.596 ppm2      1.585 CV     1
 OR {  639}
   (  segid "    " and resid 121  and name HD2%)
   (( segid "    " and resid 121  and name HB2 ))
 ASSI {  645}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 39   and name HB3 ))
      3.000     1.100     1.100 peak   645 spectrum    1 weight  0.10000E+01 volume  0.25051E-02 ppm1      0.598 ppm2      2.859 CV     1
 ASSI {  647}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 20   and name HA  ))
      2.400     0.700     0.700 peak   647 spectrum    1 weight  0.10000E+01 volume  0.61865E-02 ppm1      0.599 ppm2      3.962 CV     1
 ASSI {  649}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 39   and name HB2 ))
      3.100     1.200     1.200 peak   649 spectrum    1 weight  0.10000E+01 volume  0.19060E-02 ppm1      0.599 ppm2      3.460 CV     1
 ASSI {  652}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 121  and name HG  ))
      2.000     0.500     0.500 peak   652 spectrum    1 weight  0.10000E+01 volume  0.99343E-02 ppm1      0.726 ppm2      1.589 CV     1
 OR {  652}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 121  and name HB2 ))
 ASSI {  653}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 121  and name HB3 ))
      2.400     0.700     0.700 peak   653 spectrum    1 weight  0.10000E+01 volume  0.78106E-02 ppm1      0.726 ppm2      1.457 CV     1
 ASSI {  655}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 85   and name HB2 ))
      3.400     1.400     1.400 peak   655 spectrum    1 weight  0.10000E+01 volume  0.15948E-02 ppm1      0.728 ppm2      2.264 CV     1
 OR {  655}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 85   and name HG3 ))
 OR {  655}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 85   and name HB3 ))
 ASSI {  656}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 81   and name HG2 ))
      2.600     2.600     3.400 peak   656 spectrum    1 weight  0.10000E+01 volume  0.61069E-03 ppm1      0.727 ppm2      2.837 CV     1
 ASSI {  657}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 88   and name HB3 ))
      4.900     3.000     1.100 peak   657 spectrum    1 weight  0.10000E+01 volume  0.34689E-03 ppm1      0.731 ppm2      3.198 CV     1
 ASSI {  659}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 118  and name HA  ))
      3.300     1.300     1.300 peak   659 spectrum    1 weight  0.10000E+01 volume  0.94104E-03 ppm1      0.726 ppm2      3.663 CV     1
 ASSI {  660}
   (( segid "    " and resid 121  and name HG  ))
   (  segid "    " and resid 121  and name HD2%)
      2.400     0.700     0.700 peak   660 spectrum    1 weight  0.10000E+01 volume  0.46040E-02 ppm1      1.571 ppm2      0.603 CV     1
 ASSI {  661}
   (( segid "    " and resid 75   and name HG  ))
   (( segid "    " and resid 74   and name HA  ))
      3.600     1.600     1.600 peak   661 spectrum    1 weight  0.10000E+01 volume  0.25151E-02 ppm1      1.584 ppm2      4.079 CV     1
 ASSI {  662}
   (( segid "    " and resid 75   and name HG  ))
   (( segid "    " and resid 75   and name HA  ))
      3.300     1.400     1.400 peak   662 spectrum    1 weight  0.10000E+01 volume  0.11980E-02 ppm1      1.585 ppm2      4.459 CV     1
 ASSI {  664}
   (( segid "    " and resid 59   and name HA  ))
   (  segid "    " and resid 21   and name HE% )
      4.500     2.600     1.500 peak   664 spectrum    1 weight  0.10000E+01 volume  0.37705E-03 ppm1      4.159 ppm2      6.834 CV     1
 ASSI {  667}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 115  and name HG2%)
      2.500     0.800     0.800 peak   667 spectrum    1 weight  0.10000E+01 volume  0.30708E-02 ppm1      4.065 ppm2      0.947 CV     1
 ASSI {  673}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 127  and name HD3 ))
      4.700     2.800     1.300 peak   673 spectrum    1 weight  0.10000E+01 volume  0.40248E-03 ppm1      4.044 ppm2      3.278 CV     1
 ASSI {  674}
   (  segid "    " and resid 23   and name HB% )
   (  segid "    " and resid 20   and name HD1%)
      3.100     1.200     1.200 peak   674 spectrum    1 weight  0.10000E+01 volume  0.26171E-02 ppm1      1.436 ppm2      0.697 CV     1
 ASSI {  675}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 116  and name HB2 ))
      3.700     1.700     1.700 peak   675 spectrum    1 weight  0.10000E+01 volume  0.11388E-02 ppm1      1.448 ppm2      2.821 CV     1
 ASSI {  678}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 21   and name HB3 ))
      4.000     2.000     2.000 peak   678 spectrum    1 weight  0.10000E+01 volume  0.66032E-03 ppm1      1.451 ppm2      3.004 CV     1
 OR {  678}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 21   and name HB2 ))
 ASSI {  682}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 22   and name HA  ))
      3.900     1.900     1.900 peak   682 spectrum    1 weight  0.10000E+01 volume  0.12304E-02 ppm1      1.435 ppm2      3.711 CV     1
 ASSI {  683}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 111  and name H   ))
      5.000     3.100     1.000 peak   683 spectrum    1 weight  0.10000E+01 volume  0.46431E-03 ppm1      1.444 ppm2      8.982 CV     1
 ASSI {  684}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 112  and name H   ))
      2.400     0.700     0.700 peak   684 spectrum    1 weight  0.10000E+01 volume  0.73985E-02 ppm1      1.444 ppm2      8.524 CV     1
 ASSI {  689}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 113  and name H   ))
      3.500     1.600     1.600 peak   689 spectrum    1 weight  0.10000E+01 volume  0.82300E-03 ppm1      4.061 ppm2      7.551 CV     1
 ASSI {  690}
   (  segid "    " and resid 120  and name HB% )
   (  segid "    " and resid 121  and name HD1%)
      3.200     1.300     1.300 peak   690 spectrum    1 weight  0.10000E+01 volume  0.35733E-02 ppm1      1.450 ppm2      0.716 CV     1
 ASSI {  691}
   (  segid "    " and resid 120  and name HB% )
   (  segid "    " and resid 121  and name HD2%)
      2.700     0.900     0.900 peak   691 spectrum    1 weight  0.10000E+01 volume  0.45333E-02 ppm1      1.450 ppm2      0.598 CV     1
 ASSI {  692}
   (  segid "    " and resid 112  and name HB% )
   (  segid "    " and resid 115  and name HG2%)
      3.100     1.200     1.200 peak   692 spectrum    1 weight  0.10000E+01 volume  0.63002E-02 ppm1      1.439 ppm2      0.958 CV     1
 ASSI {  693}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 116  and name HB3 ))
      3.900     1.900     1.900 peak   693 spectrum    1 weight  0.10000E+01 volume  0.10070E-02 ppm1      1.450 ppm2      2.666 CV     1
 ASSI {  694}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 113  and name H   ))
      2.800     1.000     1.000 peak   694 spectrum    1 weight  0.10000E+01 volume  0.40472E-02 ppm1      1.445 ppm2      7.546 CV     1
 ASSI {  696}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 114  and name HG12))
      1.900     1.900     4.100 peak   696 spectrum    1 weight  0.10000E+01 volume  0.35083E-02 ppm1      0.733 ppm2      1.220 CV     1
 ASSI {  697}
   (  segid "    " and resid 120  and name HB% )
   (( segid "    " and resid 118  and name HA  ))
      3.700     1.700     1.700 peak   697 spectrum    1 weight  0.10000E+01 volume  0.99632E-03 ppm1      1.443 ppm2      3.660 CV     1
 ASSI {  700}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name H   ))
      2.700     0.900     0.900 peak   700 spectrum    1 weight  0.10000E+01 volume  0.37235E-02 ppm1      3.968 ppm2      7.863 CV     1
 ASSI {  701}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 24   and name HD21))
      3.500     1.500     1.500 peak   701 spectrum    1 weight  0.10000E+01 volume  0.16649E-02 ppm1      3.960 ppm2      8.101 CV     1
 ASSI {  703}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 124  and name HG1%)
      1.700     0.400     0.500 peak   703 spectrum    1 weight  0.10000E+01 volume  0.20048E-01 ppm1      0.656 ppm2      0.527 CV     1
 ASSI {  705}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 129  and name HG2 ))
      4.300     2.300     1.700 peak   705 spectrum    1 weight  0.10000E+01 volume  0.10550E-02 ppm1      0.655 ppm2      2.387 CV     1
 OR {  705}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 129  and name HG3 ))
 ASSI {  709}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 130  and name HD2%)
      2.200     0.600     0.600 peak   709 spectrum    1 weight  0.10000E+01 volume  0.14335E-01 ppm1      0.657 ppm2      0.944 CV     1
 OR {  709}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 130  and name HD1%)
 ASSI {  710}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 127  and name HD3 ))
      3.700     1.700     1.700 peak   710 spectrum    1 weight  0.10000E+01 volume  0.14097E-02 ppm1      0.657 ppm2      3.282 CV     1
 ASSI {  713}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 119  and name HA  ))
      2.500     0.800     0.800 peak   713 spectrum    1 weight  0.10000E+01 volume  0.76859E-02 ppm1      0.656 ppm2      4.143 CV     1
 ASSI {  714}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 127  and name HA  ))
      2.600     0.900     0.900 peak   714 spectrum    1 weight  0.10000E+01 volume  0.26684E-02 ppm1      0.656 ppm2      3.746 CV     1
 ASSI {  715}
   (  segid "    " and resid 119  and name HD2%)
   (  segid "    " and resid 119  and name HD1%)
      1.800     0.400     0.400 peak   715 spectrum    1 weight  0.10000E+01 volume  0.39119E-01 ppm1      0.802 ppm2      0.669 CV     1
 ASSI {  716}
   (  segid "    " and resid 119  and name HD2%)
   (  segid "    " and resid 124  and name HG1%)
      3.200     1.200     1.200 peak   716 spectrum    1 weight  0.10000E+01 volume  0.91996E-02 ppm1      0.802 ppm2      0.522 CV     1
 ASSI {  719}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 21   and name HB2 ))
      2.500     0.800     0.800 peak   719 spectrum    1 weight  0.10000E+01 volume  0.22962E-02 ppm1      0.825 ppm2      3.037 CV     1
 OR {  719}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 21   and name HB3 ))
 ASSI {  722}
   (  segid "    " and resid 119  and name HD2%)
   (( segid "    " and resid 116  and name HB3 ))
      4.200     2.200     1.800 peak   722 spectrum    1 weight  0.10000E+01 volume  0.10813E-02 ppm1      0.803 ppm2      2.666 CV     1
 ASSI {  725}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 59   and name HA  ))
      3.400     1.500     1.500 peak   725 spectrum    1 weight  0.10000E+01 volume  0.37634E-02 ppm1      0.822 ppm2      4.194 CV     1
 ASSI {  729}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 127  and name H   ))
      3.400     1.500     1.500 peak   729 spectrum    1 weight  0.10000E+01 volume  0.10816E-02 ppm1      0.655 ppm2      9.028 CV     1
 ASSI {  730}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 125  and name H   ))
      4.500     2.500     1.500 peak   730 spectrum    1 weight  0.10000E+01 volume  0.98610E-03 ppm1      0.655 ppm2      8.860 CV     1
 ASSI {  732}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 118  and name H   ))
      4.300     2.300     1.700 peak   732 spectrum    1 weight  0.10000E+01 volume  0.51175E-03 ppm1      0.656 ppm2      8.394 CV     1
 ASSI {  734}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 119  and name H   ))
      2.200     0.600     0.600 peak   734 spectrum    1 weight  0.10000E+01 volume  0.37195E-02 ppm1      0.656 ppm2      7.871 CV     1
 ASSI {  736}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 88   and name HE% )
      5.000     3.200     1.000 peak   736 spectrum    1 weight  0.10000E+01 volume  0.45575E-03 ppm1      0.654 ppm2      7.218 CV     1
 ASSI {  740}
   (( segid "    " and resid 119  and name HG  ))
   (( segid "    " and resid 126  and name H   ))
      3.800     1.800     1.800 peak   740 spectrum    1 weight  0.10000E+01 volume  0.47760E-03 ppm1      1.540 ppm2      7.630 CV     1
 ASSI {  741}
   (( segid "    " and resid 119  and name HG  ))
   (( segid "    " and resid 119  and name H   ))
      3.400     1.400     1.400 peak   741 spectrum    1 weight  0.10000E+01 volume  0.26745E-02 ppm1      1.548 ppm2      7.874 CV     1
 ASSI {  744}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name H   ))
      3.200     1.300     1.300 peak   744 spectrum    1 weight  0.10000E+01 volume  0.22537E-02 ppm1      1.556 ppm2      8.588 CV     1
 ASSI {  748}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 9    and name HZ3 ))
      3.500     1.500     1.500 peak   748 spectrum    1 weight  0.10000E+01 volume  0.38861E-03 ppm1      1.781 ppm2      6.808 CV     1
 ASSI {  750}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 27   and name HA  ))
      3.500     1.500     1.500 peak   750 spectrum    1 weight  0.10000E+01 volume  0.22476E-02 ppm1      4.148 ppm2      3.906 CV     1
 ASSI {  753}
   (( segid "    " and resid 119  and name HG  ))
   (( segid "    " and resid 119  and name HA  ))
      2.700     0.900     0.900 peak   753 spectrum    1 weight  0.10000E+01 volume  0.21809E-02 ppm1      1.546 ppm2      4.140 CV     1
 ASSI {  754}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HE2 ))
      4.300     2.300     1.700 peak   754 spectrum    1 weight  0.10000E+01 volume  0.10194E-02 ppm1      4.149 ppm2      2.890 CV     1
 OR {  754}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HE3 ))
 ASSI {  757}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 28   and name HG2 ))
      2.400     0.700     0.700 peak   757 spectrum    1 weight  0.10000E+01 volume  0.79267E-02 ppm1      4.150 ppm2      2.270 CV     1
 OR {  757}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 28   and name HG3 ))
 ASSI {  758}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 28   and name HB2 ))
      2.300     0.600     0.600 peak   758 spectrum    1 weight  0.10000E+01 volume  0.10553E-01 ppm1      4.149 ppm2      1.991 CV     1
 OR {  758}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 28   and name HB3 ))
 ASSI {  759}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HD3 ))
      3.100     1.200     1.200 peak   759 spectrum    1 weight  0.10000E+01 volume  0.58145E-02 ppm1      4.148 ppm2      1.586 CV     1
 OR {  759}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HD2 ))
 ASSI {  763}
   (( segid "    " and resid 119  and name HB2 ))
   (  segid "    " and resid 124  and name HG1%)
      4.100     2.100     1.900 peak   763 spectrum    1 weight  0.10000E+01 volume  0.13322E-02 ppm1      1.761 ppm2      0.530 CV     1
 ASSI {  764}
   (( segid "    " and resid 119  and name HB2 ))
   (  segid "    " and resid 119  and name HD1%)
      2.700     0.900     0.900 peak   764 spectrum    1 weight  0.10000E+01 volume  0.28323E-02 ppm1      1.757 ppm2      0.655 CV     1
 ASSI {  765}
   (( segid "    " and resid 119  and name HB2 ))
   (  segid "    " and resid 119  and name HD2%)
      2.700     0.900     0.900 peak   765 spectrum    1 weight  0.10000E+01 volume  0.43415E-02 ppm1      1.753 ppm2      0.814 CV     1
 ASSI {  767}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HB3 ))
      2.000     0.500     0.500 peak   767 spectrum    1 weight  0.10000E+01 volume  0.58384E-02 ppm1      1.760 ppm2      1.546 CV     1
 OR {  767}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HG  ))
 ASSI {  768}
   (( segid "    " and resid 119  and name HG  ))
   (  segid "    " and resid 119  and name HD1%)
      2.100     0.600     0.600 peak   768 spectrum    1 weight  0.10000E+01 volume  0.71757E-02 ppm1      1.549 ppm2      0.660 CV     1
 ASSI {  769}
   (( segid "    " and resid 119  and name HG  ))
   (  segid "    " and resid 124  and name HG1%)
      2.800     1.000     1.000 peak   769 spectrum    1 weight  0.10000E+01 volume  0.30760E-02 ppm1      1.548 ppm2      0.520 CV     1
 ASSI {  773}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 118  and name H   ))
      3.300     1.300     1.300 peak   773 spectrum    1 weight  0.10000E+01 volume  0.33756E-03 ppm1      2.025 ppm2      8.398 CV     1
 ASSI {  774}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name H   ))
      3.100     1.200     1.200 peak   774 spectrum    1 weight  0.10000E+01 volume  0.62802E-03 ppm1      0.734 ppm2      8.297 CV     1
 ASSI {  779}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 117  and name H   ))
      3.200     1.200     1.200 peak   779 spectrum    1 weight  0.10000E+01 volume  0.11481E-02 ppm1      4.003 ppm2      7.539 CV     1
 ASSI {  784}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 117  and name H   ))
      3.200     1.300     1.300 peak   784 spectrum    1 weight  0.10000E+01 volume  0.10729E-02 ppm1      4.300 ppm2      7.532 CV     1
 ASSI {  785}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name H   ))
      2.700     0.900     0.900 peak   785 spectrum    1 weight  0.10000E+01 volume  0.25294E-02 ppm1      4.293 ppm2      8.117 CV     1
 ASSI {  787}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 118  and name H   ))
      4.100     2.100     1.900 peak   787 spectrum    1 weight  0.10000E+01 volume  0.30928E-03 ppm1      4.303 ppm2      8.371 CV     1
 ASSI {  794}
   (( segid "    " and resid 1    and name HB3 ))
   (( segid "    " and resid 1    and name HA  ))
      3.000     1.100     1.100 peak   794 spectrum    1 weight  0.10000E+01 volume  0.16225E-02 ppm1      2.662 ppm2      4.602 CV     1
 ASSI {  795}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HB3 ))
      3.200     1.200     1.200 peak   795 spectrum    1 weight  0.10000E+01 volume  0.21095E-02 ppm1      4.293 ppm2      2.671 CV     1
 ASSI {  796}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HB2 ))
      2.700     0.900     0.900 peak   796 spectrum    1 weight  0.10000E+01 volume  0.16592E-02 ppm1      4.293 ppm2      2.813 CV     1
 ASSI {  806}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 63   and name HG1%)
      3.500     1.500     1.500 peak   806 spectrum    1 weight  0.10000E+01 volume  0.13811E-02 ppm1      4.296 ppm2      0.914 CV     1
 OR {  806}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 63   and name HG2%)
 ASSI {  807}
   (( segid "    " and resid 116  and name HB3 ))
   (  segid "    " and resid 119  and name HD1%)
      5.400     3.700     0.600 peak   807 spectrum    1 weight  0.10000E+01 volume  0.33293E-03 ppm1      2.664 ppm2      0.640 CV     1
 ASSI {  811}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 124  and name HG1%)
      5.200     3.400     0.800 peak   811 spectrum    1 weight  0.10000E+01 volume  0.40295E-03 ppm1      4.290 ppm2      0.527 CV     1
 ASSI {  812}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 119  and name HD1%)
      2.900     1.100     1.100 peak   812 spectrum    1 weight  0.10000E+01 volume  0.10967E-02 ppm1      4.296 ppm2      0.666 CV     1
 ASSI {  814}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 118  and name HB2 ))
      3.000     1.200     1.200 peak   814 spectrum    1 weight  0.10000E+01 volume  0.60280E-03 ppm1      3.357 ppm2      2.017 CV     1
 ASSI {  817}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 130  and name HG  ))
      4.800     2.900     1.200 peak   817 spectrum    1 weight  0.10000E+01 volume  0.40580E-03 ppm1      3.354 ppm2      1.622 CV     1
 ASSI {  826}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 7    and name HG3 ))
      2.100     0.600     0.600 peak   826 spectrum    1 weight  0.10000E+01 volume  0.13379E-01 ppm1      2.235 ppm2      1.952 CV     1
 OR {  826}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 7    and name HG2 ))
 ASSI {  827}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 7    and name HB2 ))
      1.600     0.300     0.600 peak   827 spectrum    1 weight  0.10000E+01 volume  0.22481E-01 ppm1      2.236 ppm2      1.718 CV     1
 ASSI {  829}
   (( segid "    " and resid 7    and name HB3 ))
   (  segid "    " and resid 8    and name HG2%)
      4.200     2.200     1.800 peak   829 spectrum    1 weight  0.10000E+01 volume  0.15221E-02 ppm1      2.233 ppm2      1.254 CV     1
 ASSI {  835}
   (( segid "    " and resid 115  and name HB  ))
   (  segid "    " and resid 124  and name HG1%)
      4.500     2.500     1.500 peak   835 spectrum    1 weight  0.10000E+01 volume  0.56711E-03 ppm1      2.214 ppm2      0.525 CV     1
 ASSI {  841}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 130  and name HG  ))
      3.100     1.200     1.200 peak   841 spectrum    1 weight  0.10000E+01 volume  0.46110E-02 ppm1      1.125 ppm2      1.627 CV     1
 ASSI {  844}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 87   and name HG  ))
      2.200     0.600     0.600 peak   844 spectrum    1 weight  0.10000E+01 volume  0.84459E-02 ppm1      1.105 ppm2      2.171 CV     1
 OR {  844}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 87   and name HB2 ))
 ASSI {  847}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 8    and name HA  ))
      4.300     2.400     1.700 peak   847 spectrum    1 weight  0.10000E+01 volume  0.79888E-03 ppm1      2.233 ppm2      4.200 CV     1
 OR {  847}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 8    and name HB  ))
 ASSI {  848}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 7    and name HD2 ))
      3.800     1.800     1.800 peak   848 spectrum    1 weight  0.10000E+01 volume  0.18500E-02 ppm1      2.234 ppm2      3.815 CV     1
 ASSI {  849}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 7    and name HD3 ))
      3.600     1.700     1.700 peak   849 spectrum    1 weight  0.10000E+01 volume  0.18746E-02 ppm1      2.233 ppm2      3.556 CV     1
 ASSI {  851}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 115  and name HA  ))
      2.900     1.000     1.000 peak   851 spectrum    1 weight  0.10000E+01 volume  0.10669E-02 ppm1      2.220 ppm2      3.352 CV     1
 ASSI {  852}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 84   and name HA  ))
      2.700     0.900     0.900 peak   852 spectrum    1 weight  0.10000E+01 volume  0.43620E-02 ppm1      1.088 ppm2      4.122 CV     1
 ASSI {  853}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 112  and name HA  ))
      3.000     1.200     1.200 peak   853 spectrum    1 weight  0.10000E+01 volume  0.32475E-02 ppm1      1.125 ppm2      4.065 CV     1
 ASSI {  855}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 127  and name HA  ))
      4.400     2.400     1.600 peak   855 spectrum    1 weight  0.10000E+01 volume  0.83444E-03 ppm1      1.128 ppm2      3.725 CV     1
 ASSI {  856}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 115  and name HA  ))
      2.500     0.800     0.800 peak   856 spectrum    1 weight  0.10000E+01 volume  0.47232E-02 ppm1      1.127 ppm2      3.348 CV     1
 ASSI {  857}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 87   and name HA  ))
      2.400     0.700     0.700 peak   857 spectrum    1 weight  0.10000E+01 volume  0.43145E-02 ppm1      1.104 ppm2      4.255 CV     1
 ASSI {  859}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 101  and name HA  ))
      3.000     1.100     1.100 peak   859 spectrum    1 weight  0.10000E+01 volume  0.17733E-02 ppm1      1.102 ppm2      3.625 CV     1
 ASSI {  862}
   (  segid "    " and resid 63   and name HG1%)
   (  segid "    " and resid 51   and name HG2%)
      2.900     1.000     1.000 peak   862 spectrum    1 weight  0.10000E+01 volume  0.16413E-01 ppm1      0.939 ppm2      0.673 CV     1
 ASSI {  863}
   (  segid "    " and resid 115  and name HG2%)
   (  segid "    " and resid 115  and name HG1%)
      1.800     0.400     0.400 peak   863 spectrum    1 weight  0.10000E+01 volume  0.27103E-01 ppm1      0.957 ppm2      1.126 CV     1
 ASSI {  865}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 33   and name HB  ))
      2.000     0.500     0.500 peak   865 spectrum    1 weight  0.10000E+01 volume  0.90511E-02 ppm1      0.955 ppm2      2.335 CV     1
 ASSI {  867}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 22   and name HB2 ))
      2.700     0.900     0.900 peak   867 spectrum    1 weight  0.10000E+01 volume  0.11113E-01 ppm1      0.948 ppm2      1.904 CV     1
 ASSI {  870}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 115  and name HA  ))
      2.700     0.900     0.900 peak   870 spectrum    1 weight  0.10000E+01 volume  0.56487E-02 ppm1      0.958 ppm2      3.342 CV     1
 ASSI {  871}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 116  and name HB2 ))
      3.400     1.400     1.400 peak   871 spectrum    1 weight  0.10000E+01 volume  0.13718E-02 ppm1      0.960 ppm2      2.828 CV     1
 ASSI {  872}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 116  and name HB3 ))
      4.300     2.300     1.700 peak   872 spectrum    1 weight  0.10000E+01 volume  0.10065E-02 ppm1      0.951 ppm2      2.658 CV     1
 ASSI {  873}
   (  segid "    " and resid 27   and name HG1%)
   (( segid "    " and resid 24   and name HB2 ))
      3.700     1.700     1.700 peak   873 spectrum    1 weight  0.10000E+01 volume  0.30732E-02 ppm1      0.973 ppm2      2.489 CV     1
 ASSI {  874}
   (  segid "    " and resid 27   and name HG1%)
   (( segid "    " and resid 27   and name HB  ))
      2.000     0.500     0.500 peak   874 spectrum    1 weight  0.10000E+01 volume  0.18742E-01 ppm1      0.974 ppm2      2.108 CV     1
 ASSI {  875}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 127  and name HB3 ))
      2.500     0.800     0.800 peak   875 spectrum    1 weight  0.10000E+01 volume  0.89126E-02 ppm1      0.961 ppm2      1.862 CV     1
 OR {  875}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 127  and name HB2 ))
 ASSI {  876}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 127  and name HG2 ))
      2.100     0.600     0.600 peak   876 spectrum    1 weight  0.10000E+01 volume  0.81421E-02 ppm1      0.957 ppm2      1.743 CV     1
 ASSI {  878}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 63   and name HB  ))
      1.900     0.500     0.500 peak   878 spectrum    1 weight  0.10000E+01 volume  0.22337E-01 ppm1      0.940 ppm2      2.212 CV     1
 ASSI {  882}
   (  segid "    " and resid 27   and name HG1%)
   (( segid "    " and resid 27   and name HA  ))
      2.500     0.800     0.800 peak   882 spectrum    1 weight  0.10000E+01 volume  0.11301E-01 ppm1      0.974 ppm2      3.891 CV     1
 ASSI {  885}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 118  and name H   ))
      3.900     1.900     1.900 peak   885 spectrum    1 weight  0.10000E+01 volume  0.38206E-03 ppm1      3.355 ppm2      8.398 CV     1
 ASSI {  893}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 66   and name HD% )
      4.300     2.300     1.700 peak   893 spectrum    1 weight  0.10000E+01 volume  0.90733E-03 ppm1      2.211 ppm2      7.291 CV     1
 ASSI {  894}
   (( segid "    " and resid 97   and name HB  ))
   (  segid "    " and resid 88   and name HE% )
      4.300     2.300     1.700 peak   894 spectrum    1 weight  0.10000E+01 volume  0.55292E-03 ppm1      2.213 ppm2      7.191 CV     1
 ASSI {  896}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 115  and name H   ))
      2.100     0.600     0.600 peak   896 spectrum    1 weight  0.10000E+01 volume  0.57967E-02 ppm1      1.127 ppm2      8.553 CV     1
 ASSI {  903}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 88   and name H   ))
      4.300     2.300     1.700 peak   903 spectrum    1 weight  0.10000E+01 volume  0.97785E-03 ppm1      1.102 ppm2      8.893 CV     1
 ASSI {  904}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 87   and name H   ))
      3.700     1.700     1.700 peak   904 spectrum    1 weight  0.10000E+01 volume  0.23647E-02 ppm1      1.104 ppm2      8.672 CV     1
 ASSI {  905}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 90   and name H   ))
      4.200     2.200     1.800 peak   905 spectrum    1 weight  0.10000E+01 volume  0.11772E-02 ppm1      1.103 ppm2      7.908 CV     1
 ASSI {  907}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 107  and name H   ))
      5.500     3.800     0.500 peak   907 spectrum    1 weight  0.10000E+01 volume  0.49992E-03 ppm1      1.107 ppm2      7.642 CV     1
 ASSI {  909}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 104  and name H   ))
      3.800     1.800     1.800 peak   909 spectrum    1 weight  0.10000E+01 volume  0.13090E-02 ppm1      1.103 ppm2      7.366 CV     1
 ASSI {  910}
   (  segid "    " and resid 87   and name HD1%)
   (  segid "    " and resid 91   and name HD% )
      2.700     0.900     0.900 peak   910 spectrum    1 weight  0.10000E+01 volume  0.55698E-02 ppm1      1.103 ppm2      7.078 CV     1
 OR {  910}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 91   and name HZ  ))
 ASSI {  912}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 18   and name H   ))
      3.900     1.900     1.900 peak   912 spectrum    1 weight  0.10000E+01 volume  0.17108E-02 ppm1      0.955 ppm2      8.326 CV     1
 ASSI {  916}
   (  segid "    " and resid 27   and name HG1%)
   (( segid "    " and resid 28   and name H   ))
      3.000     1.100     1.100 peak   916 spectrum    1 weight  0.10000E+01 volume  0.60382E-02 ppm1      0.973 ppm2      8.616 CV     1
 ASSI {  919}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 116  and name H   ))
      2.300     0.700     0.700 peak   919 spectrum    1 weight  0.10000E+01 volume  0.41714E-02 ppm1      0.960 ppm2      8.105 CV     1
 ASSI {  923}
   (  segid "    " and resid 27   and name HG1%)
   (( segid "    " and resid 27   and name H   ))
      2.200     0.600     0.600 peak   923 spectrum    1 weight  0.10000E+01 volume  0.95521E-02 ppm1      0.975 ppm2      7.302 CV     1
 ASSI {  927}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 64   and name H   ))
      2.600     0.800     0.800 peak   927 spectrum    1 weight  0.10000E+01 volume  0.36500E-02 ppm1      0.938 ppm2      8.280 CV     1
 ASSI {  931}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 114  and name HG12))
      3.300     1.400     1.400 peak   931 spectrum    1 weight  0.10000E+01 volume  0.94235E-03 ppm1      2.257 ppm2      1.245 CV     1
 ASSI {  933}
   (( segid "    " and resid 114  and name HB  ))
   (  segid "    " and resid 114  and name HG2%)
      2.200     0.600     0.600 peak   933 spectrum    1 weight  0.10000E+01 volume  0.70044E-02 ppm1      2.260 ppm2      0.943 CV     1
 OR {  933}
   (( segid "    " and resid 114  and name HB  ))
   (  segid "    " and resid 114  and name HD1%)
 ASSI {  935}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 51   and name HG2%)
      3.800     1.800     1.800 peak   935 spectrum    1 weight  0.10000E+01 volume  0.19131E-02 ppm1      1.866 ppm2      0.668 CV     1
 OR {  935}
   (( segid "    " and resid 47   and name HB3 ))
   (  segid "    " and resid 51   and name HG2%)
 ASSI {  936}
   (( segid "    " and resid 114  and name HG13))
   (  segid "    " and resid 114  and name HD1%)
      2.200     0.600     0.600 peak   936 spectrum    1 weight  0.10000E+01 volume  0.92599E-02 ppm1      1.856 ppm2      0.953 CV     1
 OR {  936}
   (( segid "    " and resid 114  and name HG13))
   (  segid "    " and resid 114  and name HG2%)
 ASSI {  938}
   (( segid "    " and resid 114  and name HG13))
   (( segid "    " and resid 114  and name HG12))
      2.000     0.500     0.500 peak   938 spectrum    1 weight  0.10000E+01 volume  0.25842E-02 ppm1      1.856 ppm2      1.247 CV     1
 ASSI {  939}
   (( segid "    " and resid 114  and name HG12))
   (  segid "    " and resid 114  and name HD1%)
      2.200     0.600     0.600 peak   939 spectrum    1 weight  0.10000E+01 volume  0.55759E-02 ppm1      1.242 ppm2      0.954 CV     1
 OR {  939}
   (( segid "    " and resid 114  and name HG12))
   (  segid "    " and resid 114  and name HG2%)
 ASSI {  947}
   (( segid "    " and resid 114  and name HG13))
   (( segid "    " and resid 114  and name HA  ))
      2.800     1.000     1.000 peak   947 spectrum    1 weight  0.10000E+01 volume  0.17269E-02 ppm1      1.857 ppm2      3.888 CV     1
 ASSI {  948}
   (( segid "    " and resid 114  and name HG12))
   (( segid "    " and resid 111  and name HA  ))
      4.800     2.900     1.200 peak   948 spectrum    1 weight  0.10000E+01 volume  0.41207E-03 ppm1      1.244 ppm2      3.998 CV     1
 ASSI {  951}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 126  and name HA  ))
      4.700     2.700     1.300 peak   951 spectrum    1 weight  0.10000E+01 volume  0.72612E-03 ppm1      1.877 ppm2      4.558 CV     1
 OR {  951}
   (( segid "    " and resid 127  and name HB3 ))
   (( segid "    " and resid 126  and name HA  ))
 ASSI {  952}
   (  segid "    " and resid 36   and name HG2%)
   (  segid "    " and resid 20   and name HD2%)
      3.100     1.200     1.200 peak   952 spectrum    1 weight  0.10000E+01 volume  0.68668E-02 ppm1      0.971 ppm2      0.612 CV     1
 ASSI {  953}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 84   and name HD2%)
      2.300     0.700     0.700 peak   953 spectrum    1 weight  0.10000E+01 volume  0.58691E-02 ppm1      0.949 ppm2      0.610 CV     1
 ASSI {  954}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 118  and name HD1%)
      2.400     0.700     0.700 peak   954 spectrum    1 weight  0.10000E+01 volume  0.45012E-02 ppm1      0.947 ppm2      0.518 CV     1
 ASSI {  956}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 114  and name HG12))
      2.100     0.600     0.600 peak   956 spectrum    1 weight  0.10000E+01 volume  0.66098E-02 ppm1      0.951 ppm2      1.231 CV     1
 ASSI {  960}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 115  and name HA  ))
      3.000     1.100     1.100 peak   960 spectrum    1 weight  0.10000E+01 volume  0.13188E-02 ppm1      0.951 ppm2      3.349 CV     1
 ASSI {  961}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 114  and name HA  ))
      2.500     0.800     0.800 peak   961 spectrum    1 weight  0.10000E+01 volume  0.36996E-02 ppm1      0.950 ppm2      3.879 CV     1
 ASSI {  962}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 111  and name HA  ))
      3.000     1.200     1.200 peak   962 spectrum    1 weight  0.10000E+01 volume  0.35278E-02 ppm1      0.949 ppm2      3.991 CV     1
 ASSI {  965}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 114  and name H   ))
      3.300     1.300     1.300 peak   965 spectrum    1 weight  0.10000E+01 volume  0.34000E-02 ppm1      0.950 ppm2      8.099 CV     1
 ASSI {  966}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 115  and name H   ))
      2.800     1.000     1.000 peak   966 spectrum    1 weight  0.10000E+01 volume  0.26719E-02 ppm1      0.952 ppm2      8.561 CV     1
 ASSI {  968}
   (( segid "    " and resid 114  and name HG12))
   (( segid "    " and resid 76   and name HH2 ))
      3.000     1.100     1.100 peak   968 spectrum    1 weight  0.10000E+01 volume  0.56745E-03 ppm1      1.242 ppm2      6.876 CV     1
 ASSI {  969}
   (( segid "    " and resid 114  and name HG12))
   (( segid "    " and resid 76   and name HZ2 ))
      4.000     2.000     2.000 peak   969 spectrum    1 weight  0.10000E+01 volume  0.51860E-03 ppm1      1.240 ppm2      7.085 CV     1
 OR {  969}
   (( segid "    " and resid 114  and name HG12))
   (( segid "    " and resid 76   and name HZ3 ))
 ASSI {  970}
   (( segid "    " and resid 114  and name HG12))
   (( segid "    " and resid 114  and name H   ))
      4.100     2.100     1.900 peak   970 spectrum    1 weight  0.10000E+01 volume  0.94908E-03 ppm1      1.238 ppm2      8.096 CV     1
 ASSI {  971}
   (( segid "    " and resid 114  and name HG12))
   (( segid "    " and resid 115  and name H   ))
      4.700     2.800     1.300 peak   971 spectrum    1 weight  0.10000E+01 volume  0.44004E-03 ppm1      1.237 ppm2      8.552 CV     1
 ASSI {  972}
   (( segid "    " and resid 128  and name HB3 ))
   (( segid "    " and resid 128  and name H   ))
      2.800     1.000     1.000 peak   972 spectrum    1 weight  0.10000E+01 volume  0.28408E-02 ppm1      1.864 ppm2      8.605 CV     1
 OR {  972}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 128  and name H   ))
 ASSI {  973}
   (( segid "    " and resid 47   and name HB3 ))
   (( segid "    " and resid 48   and name H   ))
      2.800     1.000     1.000 peak   973 spectrum    1 weight  0.10000E+01 volume  0.19767E-02 ppm1      1.880 ppm2      8.332 CV     1
 OR {  973}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 48   and name H   ))
 ASSI {  976}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 114  and name H   ))
      2.900     1.000     1.000 peak   976 spectrum    1 weight  0.10000E+01 volume  0.11882E-02 ppm1      2.259 ppm2      8.097 CV     1
 ASSI {  977}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 115  and name H   ))
      4.300     2.300     1.700 peak   977 spectrum    1 weight  0.10000E+01 volume  0.20195E-03 ppm1      3.882 ppm2      8.551 CV     1
 ASSI {  978}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 115  and name H   ))
      2.800     1.000     1.000 peak   978 spectrum    1 weight  0.10000E+01 volume  0.10106E-02 ppm1      2.251 ppm2      8.553 CV     1
 ASSI {  979}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 111  and name H   ))
      2.900     2.900     3.100 peak   979 spectrum    1 weight  0.10000E+01 volume  0.26524E-03 ppm1      0.954 ppm2      8.986 CV     1
 ASSI {  982}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 114  and name H   ))
      3.200     1.300     1.300 peak   982 spectrum    1 weight  0.10000E+01 volume  0.26942E-02 ppm1      0.953 ppm2      8.096 CV     1
 ASSI {  983}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 109  and name H   ))
      2.200     2.200     3.800 peak   983 spectrum    1 weight  0.10000E+01 volume  0.14182E-02 ppm1      0.952 ppm2      7.628 CV     1
 ASSI {  985}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 76   and name HZ2 ))
      3.200     1.300     1.300 peak   985 spectrum    1 weight  0.10000E+01 volume  0.14989E-02 ppm1      0.953 ppm2      7.094 CV     1
 ASSI {  986}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 76   and name HH2 ))
      3.100     1.200     1.200 peak   986 spectrum    1 weight  0.10000E+01 volume  0.13754E-02 ppm1      0.954 ppm2      6.894 CV     1
 ASSI {  987}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 111  and name HA  ))
      2.600     0.900     0.900 peak   987 spectrum    1 weight  0.10000E+01 volume  0.40107E-02 ppm1      0.953 ppm2      4.013 CV     1
 ASSI {  988}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 114  and name HA  ))
      3.600     1.600     1.600 peak   988 spectrum    1 weight  0.10000E+01 volume  0.27941E-02 ppm1      0.952 ppm2      3.872 CV     1
 ASSI {  991}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 111  and name HD2 ))
      2.700     2.700     3.300 peak   991 spectrum    1 weight  0.10000E+01 volume  0.39560E-03 ppm1      0.957 ppm2      3.250 CV     1
 OR {  991}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 111  and name HD3 ))
 ASSI {  992}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 109  and name HD2 ))
      2.800     0.900     0.900 peak   992 spectrum    1 weight  0.10000E+01 volume  0.30984E-02 ppm1      0.953 ppm2      2.744 CV     1
 ASSI {  994}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 109  and name HD3 ))
      3.000     1.100     1.100 peak   994 spectrum    1 weight  0.10000E+01 volume  0.16896E-02 ppm1      0.954 ppm2      2.432 CV     1
 ASSI {  995}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 114  and name HB  ))
      2.300     0.700     0.700 peak   995 spectrum    1 weight  0.10000E+01 volume  0.51017E-02 ppm1      0.952 ppm2      2.232 CV     1
 ASSI {  996}
   (  segid "    " and resid 114  and name HD1%)
   (  segid "    " and resid 102  and name HE% )
      2.300     0.600     0.600 peak   996 spectrum    1 weight  0.10000E+01 volume  0.63057E-02 ppm1      0.953 ppm2      2.166 CV     1
 ASSI {  997}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 101  and name HB  ))
      2.900     1.000     1.000 peak   997 spectrum    1 weight  0.10000E+01 volume  0.27064E-02 ppm1      0.954 ppm2      2.040 CV     1
 ASSI {  998}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 114  and name HG13))
      2.200     0.600     0.600 peak   998 spectrum    1 weight  0.10000E+01 volume  0.73204E-02 ppm1      0.953 ppm2      1.857 CV     1
 ASSI { 1001}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 114  and name HG12))
      2.200     0.600     0.600 peak  1001 spectrum    1 weight  0.10000E+01 volume  0.69365E-02 ppm1      0.953 ppm2      1.241 CV     1
 ASSI { 1003}
   (  segid "    " and resid 114  and name HD1%)
   (  segid "    " and resid 84   and name HD2%)
      3.100     1.200     1.200 peak  1003 spectrum    1 weight  0.10000E+01 volume  0.25876E-02 ppm1      0.953 ppm2      0.607 CV     1
 ASSI { 1004}
   (  segid "    " and resid 114  and name HD1%)
   (  segid "    " and resid 118  and name HD1%)
      2.100     2.100     3.900 peak  1004 spectrum    1 weight  0.10000E+01 volume  0.17456E-02 ppm1      0.955 ppm2      0.537 CV     1
 ASSI { 1007}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 113  and name H   ))
      3.300     1.400     1.400 peak  1007 spectrum    1 weight  0.10000E+01 volume  0.10347E-02 ppm1      4.327 ppm2      7.543 CV     1
 ASSI { 1009}
   (( segid "    " and resid 113  and name HD3 ))
   (( segid "    " and resid 113  and name H   ))
      4.700     2.700     1.300 peak  1009 spectrum    1 weight  0.10000E+01 volume  0.69520E-03 ppm1      3.382 ppm2      7.549 CV     1
 OR { 1009}
   (( segid "    " and resid 113  and name HD2 ))
   (( segid "    " and resid 113  and name H   ))
 ASSI { 1010}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 113  and name HD2 ))
      3.900     1.900     1.900 peak  1010 spectrum    1 weight  0.10000E+01 volume  0.13233E-02 ppm1      4.323 ppm2      3.383 CV     1
 OR { 1010}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 113  and name HD3 ))
 ASSI { 1011}
   (( segid "    " and resid 113  and name HA  ))
   (  segid "    " and resid 112  and name HB% )
      3.300     1.300     1.300 peak  1011 spectrum    1 weight  0.10000E+01 volume  0.21314E-02 ppm1      4.316 ppm2      1.459 CV     1
 ASSI { 1013}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 113  and name HG3 ))
      3.000     1.100     1.100 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.19645E-02 ppm1      4.327 ppm2      1.916 CV     1
 OR { 1013}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 113  and name HG2 ))
 ASSI { 1014}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 113  and name HB2 ))
      3.000     1.100     1.100 peak  1014 spectrum    1 weight  0.10000E+01 volume  0.17274E-02 ppm1      4.324 ppm2      2.212 CV     1
 OR { 1014}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 113  and name HB3 ))
 ASSI { 1016}
   (( segid "    " and resid 113  and name HD3 ))
   (( segid "    " and resid 109  and name HD3 ))
      3.900     1.900     1.900 peak  1016 spectrum    1 weight  0.10000E+01 volume  0.43428E-03 ppm1      3.366 ppm2      2.388 CV     1
 OR { 1016}
   (( segid "    " and resid 113  and name HD2 ))
   (( segid "    " and resid 109  and name HD3 ))
 ASSI { 1018}
   (( segid "    " and resid 113  and name HD3 ))
   (( segid "    " and resid 113  and name HB3 ))
      3.200     1.300     1.300 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.13470E-02 ppm1      3.390 ppm2      2.210 CV     1
 OR { 1018}
   (( segid "    " and resid 113  and name HD3 ))
   (( segid "    " and resid 113  and name HB2 ))
 OR { 1018}
   (( segid "    " and resid 113  and name HD2 ))
   (( segid "    " and resid 113  and name HB3 ))
 OR { 1018}
   (( segid "    " and resid 113  and name HD2 ))
   (( segid "    " and resid 113  and name HB2 ))
 ASSI { 1019}
   (( segid "    " and resid 113  and name HD2 ))
   (( segid "    " and resid 113  and name HG2 ))
      2.500     0.800     0.800 peak  1019 spectrum    1 weight  0.10000E+01 volume  0.43999E-02 ppm1      3.370 ppm2      1.913 CV     1
 OR { 1019}
   (( segid "    " and resid 113  and name HD3 ))
   (( segid "    " and resid 113  and name HG2 ))
 OR { 1019}
   (( segid "    " and resid 113  and name HD2 ))
   (( segid "    " and resid 113  and name HG3 ))
 OR { 1019}
   (( segid "    " and resid 113  and name HD3 ))
   (( segid "    " and resid 113  and name HG3 ))
 ASSI { 1023}
   (( segid "    " and resid 113  and name HD2 ))
   (( segid "    " and resid 74   and name HA  ))
      4.300     2.300     1.700 peak  1023 spectrum    1 weight  0.10000E+01 volume  0.52076E-03 ppm1      3.383 ppm2      4.082 CV     1
 OR { 1023}
   (( segid "    " and resid 113  and name HD3 ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI { 1024}
   (( segid "    " and resid 113  and name HD2 ))
   (( segid "    " and resid 114  and name HA  ))
      4.200     2.200     1.800 peak  1024 spectrum    1 weight  0.10000E+01 volume  0.63308E-03 ppm1      3.390 ppm2      3.906 CV     1
 OR { 1024}
   (( segid "    " and resid 113  and name HD3 ))
   (( segid "    " and resid 114  and name HA  ))
 ASSI { 1036}
   (( segid "    " and resid 113  and name HD3 ))
   (( segid "    " and resid 114  and name H   ))
      4.700     2.800     1.300 peak  1036 spectrum    1 weight  0.10000E+01 volume  0.48281E-03 ppm1      3.376 ppm2      8.098 CV     1
 OR { 1036}
   (( segid "    " and resid 113  and name HD2 ))
   (( segid "    " and resid 114  and name H   ))
 ASSI { 1039}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name H   ))
      3.400     1.500     1.500 peak  1039 spectrum    1 weight  0.10000E+01 volume  0.64744E-03 ppm1      3.994 ppm2      8.993 CV     1
 ASSI { 1041}
   (( segid "    " and resid 111  and name HB2 ))
   (( segid "    " and resid 111  and name H   ))
      3.000     1.200     1.200 peak  1041 spectrum    1 weight  0.10000E+01 volume  0.90034E-03 ppm1      1.941 ppm2      9.000 CV     1
 ASSI { 1044}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 9    and name HZ3 ))
      3.700     1.700     1.700 peak  1044 spectrum    1 weight  0.10000E+01 volume  0.38815E-03 ppm1      3.983 ppm2      6.819 CV     1
 ASSI { 1048}
   (( segid "    " and resid 110  and name HB3 ))
   (( segid "    " and resid 111  and name H   ))
      4.000     2.000     2.000 peak  1048 spectrum    1 weight  0.10000E+01 volume  0.57337E-03 ppm1      3.992 ppm2      9.006 CV     1
 ASSI { 1051}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 102  and name HG2 ))
      4.300     2.300     1.700 peak  1051 spectrum    1 weight  0.10000E+01 volume  0.52851E-03 ppm1      4.444 ppm2      2.725 CV     1
 ASSI { 1052}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 102  and name HG3 ))
      4.500     2.600     1.500 peak  1052 spectrum    1 weight  0.10000E+01 volume  0.25263E-03 ppm1      4.443 ppm2      2.619 CV     1
 ASSI { 1053}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 110  and name HB3 ))
      3.300     1.400     1.400 peak  1053 spectrum    1 weight  0.10000E+01 volume  0.13804E-02 ppm1      4.446 ppm2      3.995 CV     1
 ASSI { 1057}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 64   and name H   ))
      3.000     1.100     1.100 peak  1057 spectrum    1 weight  0.10000E+01 volume  0.14304E-02 ppm1      4.001 ppm2      8.287 CV     1
 ASSI { 1059}
   (( segid "    " and resid 110  and name HB3 ))
   (( segid "    " and resid 110  and name HB2 ))
      2.700     0.900     0.900 peak  1059 spectrum    1 weight  0.10000E+01 volume  0.12194E-02 ppm1      3.987 ppm2      4.296 CV     1
 ASSI { 1062}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HB3 ))
      1.700     0.400     0.500 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.12570E-01 ppm1      4.001 ppm2      3.767 CV     1
 ASSI { 1067}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 109  and name H   ))
      3.800     1.800     1.800 peak  1067 spectrum    1 weight  0.10000E+01 volume  0.50677E-03 ppm1      1.785 ppm2      7.634 CV     1
 ASSI { 1068}
   (( segid "    " and resid 109  and name HB3 ))
   (( segid "    " and resid 109  and name H   ))
      3.900     1.900     1.900 peak  1068 spectrum    1 weight  0.10000E+01 volume  0.49411E-03 ppm1      1.486 ppm2      7.635 CV     1
 ASSI { 1070}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HG2 ))
      3.500     1.500     1.500 peak  1070 spectrum    1 weight  0.10000E+01 volume  0.10833E-02 ppm1      4.617 ppm2      1.380 CV     1
 ASSI { 1071}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HB3 ))
      3.000     1.100     1.100 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.20402E-02 ppm1      4.606 ppm2      1.476 CV     1
 OR { 1071}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HG3 ))
 ASSI { 1072}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HB2 ))
      3.000     1.200     1.200 peak  1072 spectrum    1 weight  0.10000E+01 volume  0.18286E-02 ppm1      4.613 ppm2      1.790 CV     1
 ASSI { 1073}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HD2 ))
      4.300     2.300     1.700 peak  1073 spectrum    1 weight  0.10000E+01 volume  0.89645E-03 ppm1      4.618 ppm2      2.787 CV     1
 ASSI { 1074}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HD3 ))
      4.500     2.600     1.500 peak  1074 spectrum    1 weight  0.10000E+01 volume  0.54768E-03 ppm1      4.612 ppm2      2.423 CV     1
 ASSI { 1076}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 114  and name H   ))
      4.200     2.200     1.800 peak  1076 spectrum    1 weight  0.10000E+01 volume  0.41626E-03 ppm1      1.760 ppm2      8.101 CV     1
 ASSI { 1084}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 17   and name H   ))
      4.700     2.700     1.300 peak  1084 spectrum    1 weight  0.10000E+01 volume  0.41074E-03 ppm1      1.493 ppm2      8.765 CV     1
 ASSI { 1085}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 109  and name H   ))
      4.400     2.400     1.600 peak  1085 spectrum    1 weight  0.10000E+01 volume  0.33946E-03 ppm1      2.783 ppm2      7.636 CV     1
 ASSI { 1086}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 76   and name HZ2 ))
      3.400     1.400     1.400 peak  1086 spectrum    1 weight  0.10000E+01 volume  0.83634E-03 ppm1      2.783 ppm2      7.096 CV     1
 ASSI { 1087}
   (( segid "    " and resid 109  and name HD3 ))
   (( segid "    " and resid 109  and name H   ))
      4.300     2.300     1.700 peak  1087 spectrum    1 weight  0.10000E+01 volume  0.39681E-03 ppm1      2.424 ppm2      7.639 CV     1
 ASSI { 1088}
   (( segid "    " and resid 109  and name HD3 ))
   (( segid "    " and resid 76   and name HZ2 ))
      3.500     1.500     1.500 peak  1088 spectrum    1 weight  0.10000E+01 volume  0.73649E-03 ppm1      2.424 ppm2      7.092 CV     1
 ASSI { 1089}
   (( segid "    " and resid 109  and name HD3 ))
   (( segid "    " and resid 76   and name HH2 ))
      4.000     2.000     2.000 peak  1089 spectrum    1 weight  0.10000E+01 volume  0.36432E-03 ppm1      2.426 ppm2      6.893 CV     1
 ASSI { 1090}
   (( segid "    " and resid 109  and name HD3 ))
   (( segid "    " and resid 109  and name HE  ))
      4.000     2.000     2.000 peak  1090 spectrum    1 weight  0.10000E+01 volume  0.25979E-03 ppm1      2.428 ppm2      6.497 CV     1
 ASSI { 1094}
   (( segid "    " and resid 109  and name HB3 ))
   (( segid "    " and resid 109  and name HD2 ))
      4.300     2.300     1.700 peak  1094 spectrum    1 weight  0.10000E+01 volume  0.38462E-03 ppm1      1.482 ppm2      2.782 CV     1
 ASSI { 1095}
   (( segid "    " and resid 109  and name HB3 ))
   (( segid "    " and resid 109  and name HD3 ))
      3.700     1.700     1.700 peak  1095 spectrum    1 weight  0.10000E+01 volume  0.33491E-03 ppm1      1.484 ppm2      2.428 CV     1
 ASSI { 1098}
   (( segid "    " and resid 109  and name HB3 ))
   (( segid "    " and resid 109  and name HB2 ))
      2.700     0.900     0.900 peak  1098 spectrum    1 weight  0.10000E+01 volume  0.83193E-03 ppm1      1.476 ppm2      1.781 CV     1
 ASSI { 1100}
   (( segid "    " and resid 84   and name HG  ))
   (  segid "    " and resid 84   and name HD2%)
      2.600     0.800     0.800 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.34847E-02 ppm1      1.466 ppm2      0.621 CV     1
 ASSI { 1101}
   (( segid "    " and resid 84   and name HG  ))
   (  segid "    " and resid 118  and name HD1%)
      2.900     1.100     1.100 peak  1101 spectrum    1 weight  0.10000E+01 volume  0.22873E-02 ppm1      1.464 ppm2      0.521 CV     1
 ASSI { 1103}
   (( segid "    " and resid 73   and name HG13))
   (( segid "    " and resid 73   and name HG12))
      1.400     0.200     0.800 peak  1103 spectrum    1 weight  0.10000E+01 volume  0.26156E-01 ppm1      1.387 ppm2      1.137 CV     1
 ASSI { 1108}
   (( segid "    " and resid 73   and name HG13))
   (( segid "    " and resid 81   and name HB3 ))
      3.100     1.200     1.200 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.12585E-02 ppm1      1.389 ppm2      1.984 CV     1
 ASSI { 1111}
   (( segid "    " and resid 109  and name HG3 ))
   (( segid "    " and resid 109  and name HD3 ))
      3.200     1.300     1.300 peak  1111 spectrum    1 weight  0.10000E+01 volume  0.11242E-02 ppm1      1.474 ppm2      2.423 CV     1
 ASSI { 1113}
   (( segid "    " and resid 109  and name HG3 ))
   (( segid "    " and resid 109  and name HD2 ))
      3.200     1.300     1.300 peak  1113 spectrum    1 weight  0.10000E+01 volume  0.82505E-03 ppm1      1.464 ppm2      2.785 CV     1
 ASSI { 1114}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 109  and name HD2 ))
      3.300     1.400     1.400 peak  1114 spectrum    1 weight  0.10000E+01 volume  0.85093E-03 ppm1      1.370 ppm2      2.787 CV     1
 ASSI { 1119}
   (( segid "    " and resid 59   and name HG  ))
   (( segid "    " and resid 59   and name HA  ))
      3.300     1.300     1.300 peak  1119 spectrum    1 weight  0.10000E+01 volume  0.15266E-02 ppm1      1.472 ppm2      4.192 CV     1
 ASSI { 1120}
   (( segid "    " and resid 109  and name HD2 ))
   (  segid "    " and resid 107  and name HB% )
      3.300     1.400     1.400 peak  1120 spectrum    1 weight  0.10000E+01 volume  0.78931E-03 ppm1      2.785 ppm2      1.161 CV     1
 ASSI { 1123}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 109  and name HB2 ))
      3.400     1.400     1.400 peak  1123 spectrum    1 weight  0.10000E+01 volume  0.12096E-02 ppm1      2.787 ppm2      1.783 CV     1
 ASSI { 1124}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 109  and name HG3 ))
      2.800     1.000     1.000 peak  1124 spectrum    1 weight  0.10000E+01 volume  0.22049E-02 ppm1      2.786 ppm2      1.474 CV     1
 OR { 1124}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 109  and name HB3 ))
 ASSI { 1126}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 109  and name HD3 ))
      2.000     0.500     0.500 peak  1126 spectrum    1 weight  0.10000E+01 volume  0.32203E-02 ppm1      2.787 ppm2      2.428 CV     1
 ASSI { 1127}
   (( segid "    " and resid 109  and name HD3 ))
   (( segid "    " and resid 109  and name HB2 ))
      3.500     1.500     1.500 peak  1127 spectrum    1 weight  0.10000E+01 volume  0.10939E-02 ppm1      2.425 ppm2      1.788 CV     1
 ASSI { 1128}
   (( segid "    " and resid 109  and name HD3 ))
   (( segid "    " and resid 109  and name HG3 ))
      2.800     1.000     1.000 peak  1128 spectrum    1 weight  0.10000E+01 volume  0.19262E-02 ppm1      2.425 ppm2      1.471 CV     1
 OR { 1128}
   (( segid "    " and resid 109  and name HD3 ))
   (( segid "    " and resid 109  and name HB3 ))
 ASSI { 1129}
   (( segid "    " and resid 109  and name HD3 ))
   (( segid "    " and resid 109  and name HG2 ))
      3.000     1.100     1.100 peak  1129 spectrum    1 weight  0.10000E+01 volume  0.16405E-02 ppm1      2.424 ppm2      1.379 CV     1
 ASSI { 1134}
   (( segid "    " and resid 108  and name HA  ))
   (  segid "    " and resid 105  and name HG2%)
      2.800     1.000     1.000 peak  1134 spectrum    1 weight  0.10000E+01 volume  0.29109E-02 ppm1      4.079 ppm2      1.037 CV     1
 OR { 1134}
   (( segid "    " and resid 108  and name HA  ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI { 1135}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 108  and name HB3 ))
      2.500     0.800     0.800 peak  1135 spectrum    1 weight  0.10000E+01 volume  0.47739E-02 ppm1      4.080 ppm2      1.735 CV     1
 OR { 1135}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 108  and name HB2 ))
 ASSI { 1136}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 108  and name HD3 ))
      3.000     1.100     1.100 peak  1136 spectrum    1 weight  0.10000E+01 volume  0.45399E-02 ppm1      4.079 ppm2      1.596 CV     1
 OR { 1136}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 108  and name HD2 ))
 ASSI { 1137}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 108  and name HE3 ))
      3.700     1.700     1.700 peak  1137 spectrum    1 weight  0.10000E+01 volume  0.38987E-03 ppm1      4.081 ppm2      3.004 CV     1
 OR { 1137}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 108  and name HE2 ))
 ASSI { 1139}
   (( segid "    " and resid 108  and name HB3 ))
   (( segid "    " and resid 109  and name H   ))
      3.800     1.800     1.800 peak  1139 spectrum    1 weight  0.10000E+01 volume  0.16402E-02 ppm1      1.732 ppm2      7.635 CV     1
 OR { 1139}
   (( segid "    " and resid 108  and name HB2 ))
   (( segid "    " and resid 109  and name H   ))
 ASSI { 1142}
   (( segid "    " and resid 7    and name HB2 ))
   (  segid "    " and resid 8    and name HG2%)
      4.300     2.400     1.700 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.12726E-02 ppm1      1.720 ppm2      1.260 CV     1
 ASSI { 1143}
   (( segid "    " and resid 7    and name HB2 ))
   (  segid "    " and resid 43   and name HG1%)
      2.700     0.900     0.900 peak  1143 spectrum    1 weight  0.10000E+01 volume  0.39028E-02 ppm1      1.719 ppm2      0.734 CV     1
 OR { 1143}
   (( segid "    " and resid 7    and name HB2 ))
   (  segid "    " and resid 43   and name HG2%)
 ASSI { 1144}
   (( segid "    " and resid 108  and name HB2 ))
   (  segid "    " and resid 107  and name HB% )
      4.300     2.300     1.700 peak  1144 spectrum    1 weight  0.10000E+01 volume  0.10971E-02 ppm1      1.731 ppm2      1.151 CV     1
 OR { 1144}
   (( segid "    " and resid 108  and name HB3 ))
   (  segid "    " and resid 107  and name HB% )
 ASSI { 1145}
   (( segid "    " and resid 108  and name HB3 ))
   (  segid "    " and resid 105  and name HG2%)
      3.800     1.800     1.800 peak  1145 spectrum    1 weight  0.10000E+01 volume  0.14779E-02 ppm1      1.727 ppm2      1.018 CV     1
 OR { 1145}
   (( segid "    " and resid 108  and name HB2 ))
   (  segid "    " and resid 105  and name HG2%)
 OR { 1145}
   (( segid "    " and resid 108  and name HB2 ))
   (  segid "    " and resid 105  and name HD1%)
 OR { 1145}
   (( segid "    " and resid 108  and name HB3 ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI { 1146}
   (( segid "    " and resid 64   and name HB3 ))
   (( segid "    " and resid 64   and name HG3 ))
      2.200     0.600     0.600 peak  1146 spectrum    1 weight  0.10000E+01 volume  0.11359E-01 ppm1      1.735 ppm2      1.438 CV     1
 OR { 1146}
   (( segid "    " and resid 64   and name HB3 ))
   (( segid "    " and resid 64   and name HG2 ))
 ASSI { 1148}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 5    and name HD3 ))
      2.500     0.800     0.800 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.57646E-02 ppm1      1.742 ppm2      3.201 CV     1
 OR { 1148}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 5    and name HD2 ))
 ASSI { 1152}
   (( segid "    " and resid 64   and name HB3 ))
   (( segid "    " and resid 64   and name HA  ))
      2.400     0.700     0.700 peak  1152 spectrum    1 weight  0.10000E+01 volume  0.44985E-02 ppm1      1.740 ppm2      4.105 CV     1
 ASSI { 1153}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 5    and name HA  ))
      2.500     0.800     0.800 peak  1153 spectrum    1 weight  0.10000E+01 volume  0.51341E-02 ppm1      1.742 ppm2      4.310 CV     1
 ASSI { 1155}
   (( segid "    " and resid 50   and name HG13))
   (  segid "    " and resid 50   and name HD1%)
      2.100     0.500     0.500 peak  1155 spectrum    1 weight  0.10000E+01 volume  0.10031E-01 ppm1      1.615 ppm2      0.900 CV     1
 OR { 1155}
   (( segid "    " and resid 50   and name HG13))
   (  segid "    " and resid 50   and name HG2%)
 ASSI { 1159}
   (( segid "    " and resid 108  and name HD2 ))
   (( segid "    " and resid 108  and name HE2 ))
      2.200     0.600     0.600 peak  1159 spectrum    1 weight  0.10000E+01 volume  0.11556E-01 ppm1      1.594 ppm2      2.986 CV     1
 OR { 1159}
   (( segid "    " and resid 108  and name HD3 ))
   (( segid "    " and resid 108  and name HE3 ))
 OR { 1159}
   (( segid "    " and resid 108  and name HD2 ))
   (( segid "    " and resid 108  and name HE3 ))
 OR { 1159}
   (( segid "    " and resid 108  and name HD3 ))
   (( segid "    " and resid 108  and name HE2 ))
 ASSI { 1160}
   (( segid "    " and resid 111  and name HG3 ))
   (( segid "    " and resid 111  and name HD3 ))
      2.800     1.000     1.000 peak  1160 spectrum    1 weight  0.10000E+01 volume  0.36672E-02 ppm1      1.625 ppm2      3.235 CV     1
 ASSI { 1167}
   (( segid "    " and resid 108  and name HD2 ))
   (( segid "    " and resid 108  and name H   ))
      3.700     1.700     1.700 peak  1167 spectrum    1 weight  0.10000E+01 volume  0.20502E-02 ppm1      1.596 ppm2      8.182 CV     1
 OR { 1167}
   (( segid "    " and resid 108  and name HD3 ))
   (( segid "    " and resid 108  and name H   ))
 ASSI { 1170}
   (( segid "    " and resid 107  and name HA  ))
   (  segid "    " and resid 107  and name HB% )
      2.300     0.700     0.700 peak  1170 spectrum    1 weight  0.10000E+01 volume  0.71385E-02 ppm1      4.459 ppm2      1.160 CV     1
 ASSI { 1171}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 108  and name HB2 ))
      4.200     2.300     1.800 peak  1171 spectrum    1 weight  0.10000E+01 volume  0.17721E-02 ppm1      4.461 ppm2      1.732 CV     1
 OR { 1171}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 108  and name HB3 ))
 ASSI { 1175}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 108  and name HE2 ))
      4.800     2.800     1.200 peak  1175 spectrum    1 weight  0.10000E+01 volume  0.25104E-03 ppm1      1.158 ppm2      2.978 CV     1
 OR { 1175}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 108  and name HE3 ))
 ASSI { 1177}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 80   and name HG2 ))
      3.900     1.900     1.900 peak  1177 spectrum    1 weight  0.10000E+01 volume  0.35463E-03 ppm1      1.155 ppm2      2.652 CV     1
 ASSI { 1179}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 109  and name HD3 ))
      3.500     1.500     1.500 peak  1179 spectrum    1 weight  0.10000E+01 volume  0.82125E-03 ppm1      1.157 ppm2      2.432 CV     1
 ASSI { 1180}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 114  and name HB  ))
      3.600     1.600     1.600 peak  1180 spectrum    1 weight  0.10000E+01 volume  0.58685E-03 ppm1      1.155 ppm2      2.273 CV     1
 ASSI { 1181}
   (  segid "    " and resid 107  and name HB% )
   (  segid "    " and resid 102  and name HE% )
      4.000     2.000     2.000 peak  1181 spectrum    1 weight  0.10000E+01 volume  0.68970E-03 ppm1      1.156 ppm2      2.161 CV     1
 ASSI { 1184}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 105  and name HG12))
      2.900     1.000     1.000 peak  1184 spectrum    1 weight  0.10000E+01 volume  0.25092E-02 ppm1      1.155 ppm2      1.586 CV     1
 ASSI { 1191}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 80   and name HE22))
      3.200     1.300     1.300 peak  1191 spectrum    1 weight  0.10000E+01 volume  0.12135E-02 ppm1      1.155 ppm2      6.598 CV     1
 ASSI { 1193}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 80   and name HE21))
      3.000     1.200     1.200 peak  1193 spectrum    1 weight  0.10000E+01 volume  0.15809E-02 ppm1      1.156 ppm2      7.453 CV     1
 ASSI { 1195}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 106  and name H   ))
      5.400     3.600     0.600 peak  1195 spectrum    1 weight  0.10000E+01 volume  0.34318E-03 ppm1      1.156 ppm2      9.156 CV     1
 ASSI { 1196}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 106  and name H   ))
      3.200     1.300     1.300 peak  1196 spectrum    1 weight  0.10000E+01 volume  0.10642E-02 ppm1      4.063 ppm2      9.157 CV     1
 ASSI { 1198}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 106  and name H   ))
      3.000     1.100     1.100 peak  1198 spectrum    1 weight  0.10000E+01 volume  0.26259E-02 ppm1      1.310 ppm2      9.156 CV     1
 ASSI { 1199}
   (( segid "    " and resid 106  and name HA  ))
   (  segid "    " and resid 107  and name HB% )
      4.300     2.400     1.700 peak  1199 spectrum    1 weight  0.10000E+01 volume  0.85099E-03 ppm1      4.060 ppm2      1.137 CV     1
 ASSI { 1201}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 105  and name HG12))
      4.600     2.600     1.400 peak  1201 spectrum    1 weight  0.10000E+01 volume  0.47997E-03 ppm1      4.060 ppm2      1.595 CV     1
 ASSI { 1202}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 105  and name HB  ))
      4.900     3.100     1.100 peak  1202 spectrum    1 weight  0.10000E+01 volume  0.43199E-03 ppm1      4.063 ppm2      1.975 CV     1
 ASSI { 1203}
   (( segid "    " and resid 106  and name HB  ))
   (  segid "    " and resid 106  and name HG2%)
      2.300     0.700     0.700 peak  1203 spectrum    1 weight  0.10000E+01 volume  0.86930E-02 ppm1      4.367 ppm2      1.315 CV     1
 ASSI { 1204}
   (( segid "    " and resid 106  and name HB  ))
   (  segid "    " and resid 107  and name HB% )
      4.400     2.500     1.600 peak  1204 spectrum    1 weight  0.10000E+01 volume  0.12886E-02 ppm1      4.366 ppm2      1.159 CV     1
 ASSI { 1205}
   (( segid "    " and resid 106  and name HB  ))
   (  segid "    " and resid 105  and name HG2%)
      4.500     2.500     1.500 peak  1205 spectrum    1 weight  0.10000E+01 volume  0.82288E-03 ppm1      4.366 ppm2      1.048 CV     1
 OR { 1205}
   (( segid "    " and resid 106  and name HB  ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI { 1206}
   (( segid "    " and resid 106  and name HB  ))
   (( segid "    " and resid 105  and name HB  ))
      5.200     3.400     0.800 peak  1206 spectrum    1 weight  0.10000E+01 volume  0.52838E-03 ppm1      4.370 ppm2      1.999 CV     1
 ASSI { 1207}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 108  and name HE2 ))
      3.900     1.900     1.900 peak  1207 spectrum    1 weight  0.10000E+01 volume  0.81539E-03 ppm1      1.311 ppm2      2.978 CV     1
 OR { 1207}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 108  and name HE3 ))
 ASSI { 1208}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 80   and name HG3 ))
      4.500     2.500     1.500 peak  1208 spectrum    1 weight  0.10000E+01 volume  0.37324E-03 ppm1      1.310 ppm2      2.827 CV     1
 ASSI { 1209}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 80   and name HG2 ))
      3.700     1.700     1.700 peak  1209 spectrum    1 weight  0.10000E+01 volume  0.45928E-03 ppm1      1.311 ppm2      2.649 CV     1
 ASSI { 1210}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 80   and name HB3 ))
      2.500     2.500     3.500 peak  1210 spectrum    1 weight  0.10000E+01 volume  0.63958E-03 ppm1      1.308 ppm2      2.529 CV     1
 ASSI { 1211}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 83   and name HB3 ))
      3.200     1.300     1.300 peak  1211 spectrum    1 weight  0.10000E+01 volume  0.10221E-02 ppm1      1.311 ppm2      2.194 CV     1
 ASSI { 1212}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 105  and name HB  ))
      4.500     2.600     1.500 peak  1212 spectrum    1 weight  0.10000E+01 volume  0.13103E-02 ppm1      1.310 ppm2      1.967 CV     1
 ASSI { 1213}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 106  and name HB  ))
      3.000     1.100     1.100 peak  1213 spectrum    1 weight  0.10000E+01 volume  0.20085E-02 ppm1      4.063 ppm2      4.369 CV     1
 ASSI { 1216}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 105  and name HA  ))
      4.000     2.000     2.000 peak  1216 spectrum    1 weight  0.10000E+01 volume  0.29294E-02 ppm1      1.308 ppm2      4.219 CV     1
 ASSI { 1217}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 106  and name HA  ))
      2.700     0.900     0.900 peak  1217 spectrum    1 weight  0.10000E+01 volume  0.86998E-02 ppm1      1.310 ppm2      4.064 CV     1
 ASSI { 1220}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 108  and name H   ))
      4.700     2.700     1.300 peak  1220 spectrum    1 weight  0.10000E+01 volume  0.58425E-03 ppm1      1.311 ppm2      8.174 CV     1
 ASSI { 1222}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 107  and name H   ))
      2.600     0.900     0.900 peak  1222 spectrum    1 weight  0.10000E+01 volume  0.28053E-02 ppm1      1.310 ppm2      7.633 CV     1
 ASSI { 1224}
   (( segid "    " and resid 105  and name HB  ))
   (( segid "    " and resid 106  and name H   ))
      5.200     3.400     0.800 peak  1224 spectrum    1 weight  0.10000E+01 volume  0.22651E-03 ppm1      1.954 ppm2      9.162 CV     1
 ASSI { 1225}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 32   and name H   ))
      3.300     3.300     2.700 peak  1225 spectrum    1 weight  0.10000E+01 volume  0.13673E-03 ppm1      1.005 ppm2      9.074 CV     1
 ASSI { 1226}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 9    and name H   ))
      2.300     0.700     0.700 peak  1226 spectrum    1 weight  0.10000E+01 volume  0.47638E-02 ppm1      4.239 ppm2      8.682 CV     1
 ASSI { 1228}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 106  and name H   ))
      4.100     2.100     1.900 peak  1228 spectrum    1 weight  0.10000E+01 volume  0.85635E-03 ppm1      1.031 ppm2      9.157 CV     1
 ASSI { 1229}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 106  and name H   ))
      5.000     3.200     1.000 peak  1229 spectrum    1 weight  0.10000E+01 volume  0.56573E-03 ppm1      1.048 ppm2      9.149 CV     1
 ASSI { 1230}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 107  and name H   ))
      3.400     1.500     1.500 peak  1230 spectrum    1 weight  0.10000E+01 volume  0.17760E-02 ppm1      1.048 ppm2      7.629 CV     1
 ASSI { 1231}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 9    and name HD1 ))
      3.700     1.700     1.700 peak  1231 spectrum    1 weight  0.10000E+01 volume  0.12452E-02 ppm1      4.239 ppm2      6.975 CV     1
 ASSI { 1234}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 8    and name H   ))
      3.500     1.500     1.500 peak  1234 spectrum    1 weight  0.10000E+01 volume  0.75068E-03 ppm1      4.239 ppm2      8.346 CV     1
 ASSI { 1239}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 107  and name H   ))
      2.900     1.100     1.100 peak  1239 spectrum    1 weight  0.10000E+01 volume  0.23291E-02 ppm1      1.031 ppm2      7.632 CV     1
 ASSI { 1240}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 105  and name H   ))
      2.500     0.800     0.800 peak  1240 spectrum    1 weight  0.10000E+01 volume  0.45299E-02 ppm1      1.031 ppm2      8.069 CV     1
 ASSI { 1241}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 102  and name H   ))
      3.900     1.900     1.900 peak  1241 spectrum    1 weight  0.10000E+01 volume  0.86051E-03 ppm1      1.030 ppm2      8.592 CV     1
 ASSI { 1242}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 80   and name HE21))
      3.600     1.700     1.700 peak  1242 spectrum    1 weight  0.10000E+01 volume  0.79016E-03 ppm1      1.030 ppm2      7.476 CV     1
 ASSI { 1243}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 104  and name H   ))
      4.000     2.000     2.000 peak  1243 spectrum    1 weight  0.10000E+01 volume  0.12025E-02 ppm1      1.030 ppm2      7.366 CV     1
 ASSI { 1246}
   (( segid "    " and resid 8    and name HA  ))
   (  segid "    " and resid 8    and name HG2%)
      2.500     0.800     0.800 peak  1246 spectrum    1 weight  0.10000E+01 volume  0.90336E-02 ppm1      4.239 ppm2      1.253 CV     1
 ASSI { 1247}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HG12))
      3.700     1.700     1.700 peak  1247 spectrum    1 weight  0.10000E+01 volume  0.63038E-03 ppm1      4.225 ppm2      1.584 CV     1
 ASSI { 1248}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HB  ))
      3.000     1.100     1.100 peak  1248 spectrum    1 weight  0.10000E+01 volume  0.90862E-03 ppm1      4.220 ppm2      1.965 CV     1
 ASSI { 1251}
   (( segid "    " and resid 105  and name HB  ))
   (  segid "    " and resid 105  and name HG2%)
      2.400     0.700     0.700 peak  1251 spectrum    1 weight  0.10000E+01 volume  0.54632E-02 ppm1      1.957 ppm2      1.038 CV     1
 OR { 1251}
   (( segid "    " and resid 105  and name HB  ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI { 1252}
   (( segid "    " and resid 105  and name HB  ))
   (( segid "    " and resid 105  and name HG13))
      3.200     1.300     1.300 peak  1252 spectrum    1 weight  0.10000E+01 volume  0.43919E-03 ppm1      1.953 ppm2      1.402 CV     1
 ASSI { 1253}
   (( segid "    " and resid 105  and name HB  ))
   (( segid "    " and resid 105  and name HG12))
      3.400     1.400     1.400 peak  1253 spectrum    1 weight  0.10000E+01 volume  0.76573E-03 ppm1      1.959 ppm2      1.571 CV     1
 ASSI { 1256}
   (( segid "    " and resid 103  and name HD2 ))
   (( segid "    " and resid 103  and name HG2 ))
      1.800     0.400     0.400 peak  1256 spectrum    1 weight  0.10000E+01 volume  0.44908E-01 ppm1      1.598 ppm2      1.449 CV     1
 OR { 1256}
   (( segid "    " and resid 103  and name HD3 ))
   (( segid "    " and resid 103  and name HG2 ))
 OR { 1256}
   (( segid "    " and resid 103  and name HD2 ))
   (( segid "    " and resid 103  and name HG3 ))
 OR { 1256}
   (( segid "    " and resid 103  and name HD3 ))
   (( segid "    " and resid 103  and name HG3 ))
 ASSI { 1257}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 105  and name HG12))
      2.200     0.600     0.600 peak  1257 spectrum    1 weight  0.10000E+01 volume  0.56884E-02 ppm1      1.051 ppm2      1.580 CV     1
 ASSI { 1260}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 105  and name HA  ))
      3.900     1.900     1.900 peak  1260 spectrum    1 weight  0.10000E+01 volume  0.17427E-02 ppm1      1.046 ppm2      4.216 CV     1
 ASSI { 1262}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 105  and name HG12))
      2.300     0.700     0.700 peak  1262 spectrum    1 weight  0.10000E+01 volume  0.61572E-02 ppm1      1.031 ppm2      1.589 CV     1
 ASSI { 1263}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 105  and name HG13))
      3.000     1.100     1.100 peak  1263 spectrum    1 weight  0.10000E+01 volume  0.60178E-02 ppm1      1.031 ppm2      1.424 CV     1
 ASSI { 1265}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 105  and name HB  ))
      2.300     0.700     0.700 peak  1265 spectrum    1 weight  0.10000E+01 volume  0.51797E-02 ppm1      1.031 ppm2      1.961 CV     1
 ASSI { 1266}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 108  and name HE3 ))
      3.500     1.500     1.500 peak  1266 spectrum    1 weight  0.10000E+01 volume  0.84087E-03 ppm1      1.031 ppm2      2.980 CV     1
 OR { 1266}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 108  and name HE2 ))
 ASSI { 1268}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 102  and name HG3 ))
      3.600     1.600     1.600 peak  1268 spectrum    1 weight  0.10000E+01 volume  0.12151E-02 ppm1      1.031 ppm2      2.587 CV     1
 ASSI { 1269}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 109  and name HD3 ))
      3.700     1.700     1.700 peak  1269 spectrum    1 weight  0.10000E+01 volume  0.98629E-03 ppm1      1.030 ppm2      2.422 CV     1
 ASSI { 1270}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 105  and name HA  ))
      3.400     1.400     1.400 peak  1270 spectrum    1 weight  0.10000E+01 volume  0.21892E-02 ppm1      1.031 ppm2      4.216 CV     1
 ASSI { 1272}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 101  and name HA  ))
      2.500     2.500     3.500 peak  1272 spectrum    1 weight  0.10000E+01 volume  0.78276E-03 ppm1      1.030 ppm2      3.619 CV     1
 ASSI { 1273}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 36   and name HG13))
      2.200     0.600     0.600 peak  1273 spectrum    1 weight  0.10000E+01 volume  0.54625E-02 ppm1      1.010 ppm2      2.107 CV     1
 OR { 1273}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 36   and name HB  ))
 ASSI { 1275}
   (( segid "    " and resid 103  and name HE2 ))
   (( segid "    " and resid 103  and name H   ))
      3.200     1.300     1.300 peak  1275 spectrum    1 weight  0.10000E+01 volume  0.16599E-02 ppm1      2.889 ppm2      7.483 CV     1
 OR { 1275}
   (( segid "    " and resid 103  and name HE3 ))
   (( segid "    " and resid 103  and name H   ))
 ASSI { 1277}
   (( segid "    " and resid 31   and name HB3 ))
   (( segid "    " and resid 34   and name H   ))
      3.300     1.300     1.300 peak  1277 spectrum    1 weight  0.10000E+01 volume  0.66651E-03 ppm1      2.885 ppm2      8.005 CV     1
 ASSI { 1278}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 103  and name H   ))
      4.600     2.600     1.400 peak  1278 spectrum    1 weight  0.10000E+01 volume  0.47777E-03 ppm1      2.600 ppm2      7.508 CV     1
 ASSI { 1279}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 100  and name H   ))
      2.800     2.800     3.200 peak  1279 spectrum    1 weight  0.10000E+01 volume  0.31616E-03 ppm1      2.619 ppm2      7.759 CV     1
 ASSI { 1282}
   (( segid "    " and resid 103  and name HE2 ))
   (( segid "    " and resid 103  and name HA  ))
      3.600     1.600     1.600 peak  1282 spectrum    1 weight  0.10000E+01 volume  0.16101E-02 ppm1      2.889 ppm2      4.154 CV     1
 ASSI { 1284}
   (( segid "    " and resid 104  and name HB3 ))
   (  segid "    " and resid 87   and name HD1%)
      2.900     1.000     1.000 peak  1284 spectrum    1 weight  0.10000E+01 volume  0.17415E-02 ppm1      2.899 ppm2      1.086 CV     1
 ASSI { 1285}
   (( segid "    " and resid 31   and name HB3 ))
   (  segid "    " and resid 33   and name HG1%)
      2.900     1.100     1.100 peak  1285 spectrum    1 weight  0.10000E+01 volume  0.18700E-02 ppm1      2.889 ppm2      0.973 CV     1
 OR { 1285}
   (( segid "    " and resid 31   and name HB3 ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI { 1286}
   (( segid "    " and resid 103  and name HE3 ))
   (( segid "    " and resid 103  and name HB3 ))
      2.800     1.000     1.000 peak  1286 spectrum    1 weight  0.10000E+01 volume  0.52453E-02 ppm1      2.889 ppm2      1.811 CV     1
 OR { 1286}
   (( segid "    " and resid 103  and name HE2 ))
   (( segid "    " and resid 103  and name HB3 ))
 OR { 1286}
   (( segid "    " and resid 103  and name HE3 ))
   (( segid "    " and resid 103  and name HB2 ))
 OR { 1286}
   (( segid "    " and resid 103  and name HE2 ))
   (( segid "    " and resid 103  and name HB2 ))
 ASSI { 1287}
   (( segid "    " and resid 103  and name HE3 ))
   (( segid "    " and resid 103  and name HD3 ))
      1.800     0.400     0.400 peak  1287 spectrum    1 weight  0.10000E+01 volume  0.33299E-01 ppm1      2.889 ppm2      1.587 CV     1
 OR { 1287}
   (( segid "    " and resid 103  and name HE2 ))
   (( segid "    " and resid 103  and name HD2 ))
 OR { 1287}
   (( segid "    " and resid 103  and name HE2 ))
   (( segid "    " and resid 103  and name HD3 ))
 OR { 1287}
   (( segid "    " and resid 103  and name HE3 ))
   (( segid "    " and resid 103  and name HD2 ))
 ASSI { 1288}
   (( segid "    " and resid 103  and name HE2 ))
   (( segid "    " and resid 103  and name HG3 ))
      2.000     0.500     0.500 peak  1288 spectrum    1 weight  0.10000E+01 volume  0.22077E-01 ppm1      2.889 ppm2      1.449 CV     1
 OR { 1288}
   (( segid "    " and resid 103  and name HE3 ))
   (( segid "    " and resid 103  and name HG3 ))
 OR { 1288}
   (( segid "    " and resid 103  and name HE2 ))
   (( segid "    " and resid 103  and name HG2 ))
 OR { 1288}
   (( segid "    " and resid 103  and name HE3 ))
   (( segid "    " and resid 103  and name HG2 ))
 ASSI { 1289}
   (( segid "    " and resid 31   and name HB3 ))
   (( segid "    " and resid 34   and name HG3 ))
      3.300     1.400     1.400 peak  1289 spectrum    1 weight  0.10000E+01 volume  0.10680E-02 ppm1      2.886 ppm2      2.239 CV     1
 OR { 1289}
   (( segid "    " and resid 31   and name HB3 ))
   (( segid "    " and resid 34   and name HB2 ))
 ASSI { 1291}
   (( segid "    " and resid 126  and name HB3 ))
   (( segid "    " and resid 125  and name H   ))
      5.200     3.400     0.800 peak  1291 spectrum    1 weight  0.10000E+01 volume  0.32529E-03 ppm1      1.964 ppm2      8.856 CV     1
 ASSI { 1292}
   (( segid "    " and resid 103  and name HD3 ))
   (( segid "    " and resid 103  and name H   ))
      3.700     1.700     1.700 peak  1292 spectrum    1 weight  0.10000E+01 volume  0.13907E-02 ppm1      1.597 ppm2      7.476 CV     1
 OR { 1292}
   (( segid "    " and resid 103  and name HD2 ))
   (( segid "    " and resid 103  and name H   ))
 ASSI { 1299}
   (( segid "    " and resid 27   and name HB  ))
   (( segid "    " and resid 28   and name H   ))
      3.600     1.600     1.600 peak  1299 spectrum    1 weight  0.10000E+01 volume  0.18289E-02 ppm1      2.113 ppm2      8.607 CV     1
 ASSI { 1300}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 111  and name H   ))
      3.100     1.200     1.200 peak  1300 spectrum    1 weight  0.10000E+01 volume  0.20345E-02 ppm1      2.159 ppm2      9.003 CV     1
 ASSI { 1301}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 102  and name H   ))
      3.100     1.200     1.200 peak  1301 spectrum    1 weight  0.10000E+01 volume  0.26373E-02 ppm1      2.159 ppm2      8.580 CV     1
 ASSI { 1302}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 110  and name H   ))
      4.000     2.000     2.000 peak  1302 spectrum    1 weight  0.10000E+01 volume  0.44163E-03 ppm1      2.158 ppm2      8.362 CV     1
 ASSI { 1304}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 99   and name H   ))
      4.600     2.600     1.400 peak  1304 spectrum    1 weight  0.10000E+01 volume  0.45611E-03 ppm1      2.158 ppm2      7.832 CV     1
 ASSI { 1305}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 109  and name H   ))
      3.300     1.400     1.400 peak  1305 spectrum    1 weight  0.10000E+01 volume  0.11818E-02 ppm1      2.159 ppm2      7.632 CV     1
 ASSI { 1306}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 103  and name H   ))
      4.200     2.200     1.800 peak  1306 spectrum    1 weight  0.10000E+01 volume  0.12340E-02 ppm1      2.158 ppm2      7.471 CV     1
 ASSI { 1307}
   (( segid "    " and resid 102  and name HG2 ))
   (( segid "    " and resid 102  and name H   ))
      2.500     0.800     0.800 peak  1307 spectrum    1 weight  0.10000E+01 volume  0.15072E-02 ppm1      2.735 ppm2      8.588 CV     1
 ASSI { 1313}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 110  and name HA  ))
      3.300     1.400     1.400 peak  1313 spectrum    1 weight  0.10000E+01 volume  0.12267E-02 ppm1      2.159 ppm2      4.447 CV     1
 ASSI { 1317}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 111  and name HD3 ))
      3.800     1.800     1.800 peak  1317 spectrum    1 weight  0.10000E+01 volume  0.20928E-02 ppm1      2.159 ppm2      3.241 CV     1
 ASSI { 1318}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 108  and name HE3 ))
      4.300     2.300     1.700 peak  1318 spectrum    1 weight  0.10000E+01 volume  0.42463E-03 ppm1      2.158 ppm2      3.032 CV     1
 ASSI { 1320}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 102  and name HG2 ))
      2.200     0.600     0.600 peak  1320 spectrum    1 weight  0.10000E+01 volume  0.56214E-02 ppm1      2.159 ppm2      2.738 CV     1
 ASSI { 1321}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 102  and name HG3 ))
      3.000     1.100     1.100 peak  1321 spectrum    1 weight  0.10000E+01 volume  0.56881E-02 ppm1      2.159 ppm2      2.585 CV     1
 ASSI { 1322}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 111  and name HB3 ))
      2.800     1.000     1.000 peak  1322 spectrum    1 weight  0.10000E+01 volume  0.77722E-02 ppm1      2.159 ppm2      1.899 CV     1
 OR { 1322}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 111  and name HB2 ))
 ASSI { 1324}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 111  and name HG3 ))
      2.700     0.900     0.900 peak  1324 spectrum    1 weight  0.10000E+01 volume  0.42556E-02 ppm1      2.159 ppm2      1.609 CV     1
 ASSI { 1326}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 114  and name HG12))
      4.200     2.200     1.800 peak  1326 spectrum    1 weight  0.10000E+01 volume  0.17232E-02 ppm1      2.160 ppm2      1.270 CV     1
 ASSI { 1330}
   (( segid "    " and resid 102  and name HG2 ))
   (  segid "    " and resid 102  and name HE% )
      2.500     0.800     0.800 peak  1330 spectrum    1 weight  0.10000E+01 volume  0.42147E-02 ppm1      2.737 ppm2      2.161 CV     1
 OR { 1330}
   (( segid "    " and resid 102  and name HG2 ))
   (( segid "    " and resid 102  and name HB2 ))
 OR { 1330}
   (( segid "    " and resid 102  and name HG2 ))
   (( segid "    " and resid 102  and name HB3 ))
 ASSI { 1331}
   (( segid "    " and resid 102  and name HG2 ))
   (( segid "    " and resid 102  and name HA  ))
      3.200     1.300     1.300 peak  1331 spectrum    1 weight  0.10000E+01 volume  0.13870E-02 ppm1      2.737 ppm2      4.037 CV     1
 ASSI { 1332}
   (( segid "    " and resid 102  and name HG3 ))
   (( segid "    " and resid 102  and name HA  ))
      3.800     1.800     1.800 peak  1332 spectrum    1 weight  0.10000E+01 volume  0.16009E-02 ppm1      2.582 ppm2      4.039 CV     1
 ASSI { 1333}
   (( segid "    " and resid 27   and name HB  ))
   (( segid "    " and resid 27   and name HA  ))
      2.700     0.900     0.900 peak  1333 spectrum    1 weight  0.10000E+01 volume  0.26653E-02 ppm1      2.110 ppm2      3.896 CV     1
 ASSI { 1337}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 128  and name HG3 ))
      2.900     1.000     1.000 peak  1337 spectrum    1 weight  0.10000E+01 volume  0.36874E-02 ppm1      4.047 ppm2      1.623 CV     1
 OR { 1337}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 128  and name HG2 ))
 ASSI { 1338}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 128  and name HB2 ))
      2.400     0.700     0.700 peak  1338 spectrum    1 weight  0.10000E+01 volume  0.73464E-02 ppm1      4.047 ppm2      1.877 CV     1
 OR { 1338}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 128  and name HB3 ))
 ASSI { 1340}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HB3 ))
      2.300     0.700     0.700 peak  1340 spectrum    1 weight  0.10000E+01 volume  0.64735E-02 ppm1      4.045 ppm2      2.169 CV     1
 OR { 1340}
   (( segid "    " and resid 102  and name HA  ))
   (  segid "    " and resid 102  and name HE% )
 ASSI { 1343}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 128  and name HD2 ))
      4.200     2.200     1.800 peak  1343 spectrum    1 weight  0.10000E+01 volume  0.13711E-02 ppm1      4.045 ppm2      3.205 CV     1
 OR { 1343}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 128  and name HD3 ))
 ASSI { 1344}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name H   ))
      3.500     1.500     1.500 peak  1344 spectrum    1 weight  0.10000E+01 volume  0.52989E-03 ppm1      3.625 ppm2      8.302 CV     1
 ASSI { 1346}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 101  and name H   ))
      3.800     1.800     1.800 peak  1346 spectrum    1 weight  0.10000E+01 volume  0.17940E-02 ppm1      1.022 ppm2      8.299 CV     1
 ASSI { 1347}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 101  and name H   ))
      3.900     1.900     1.900 peak  1347 spectrum    1 weight  0.10000E+01 volume  0.14422E-02 ppm1      0.985 ppm2      8.302 CV     1
 ASSI { 1350}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 102  and name H   ))
      3.100     1.200     1.200 peak  1350 spectrum    1 weight  0.10000E+01 volume  0.18902E-02 ppm1      0.984 ppm2      8.586 CV     1
 ASSI { 1353}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 21   and name H   ))
      3.700     1.700     1.700 peak  1353 spectrum    1 weight  0.10000E+01 volume  0.84722E-03 ppm1      1.012 ppm2      8.933 CV     1
 ASSI { 1354}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 100  and name H   ))
      4.900     3.100     1.100 peak  1354 spectrum    1 weight  0.10000E+01 volume  0.61193E-03 ppm1      0.989 ppm2      7.752 CV     1
 ASSI { 1359}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 36   and name H   ))
      3.500     1.500     1.500 peak  1359 spectrum    1 weight  0.10000E+01 volume  0.20302E-02 ppm1      1.011 ppm2      8.101 CV     1
 ASSI { 1362}
   (  segid "    " and resid 36   and name HD1%)
   (  segid "    " and resid 21   and name HD% )
      2.300     0.700     0.700 peak  1362 spectrum    1 weight  0.10000E+01 volume  0.26502E-02 ppm1      1.010 ppm2      6.899 CV     1
 ASSI { 1363}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 80   and name HE21))
      4.200     2.200     1.800 peak  1363 spectrum    1 weight  0.10000E+01 volume  0.45813E-03 ppm1      1.023 ppm2      7.482 CV     1
 ASSI { 1366}
   (  segid "    " and resid 36   and name HD1%)
   (  segid "    " and resid 54   and name HD1%)
      2.300     0.600     0.600 peak  1366 spectrum    1 weight  0.10000E+01 volume  0.36976E-02 ppm1      1.010 ppm2      0.421 CV     1
 OR { 1366}
   (  segid "    " and resid 36   and name HD1%)
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 1369}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 88   and name HB3 ))
      4.100     2.100     1.900 peak  1369 spectrum    1 weight  0.10000E+01 volume  0.96937E-03 ppm1      1.022 ppm2      3.177 CV     1
 ASSI { 1373}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 21   and name HB3 ))
      2.600     0.800     0.800 peak  1373 spectrum    1 weight  0.10000E+01 volume  0.15939E-02 ppm1      1.011 ppm2      3.040 CV     1
 OR { 1373}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 1377}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 101  and name HA  ))
      2.700     0.900     0.900 peak  1377 spectrum    1 weight  0.10000E+01 volume  0.24864E-02 ppm1      0.986 ppm2      3.626 CV     1
 ASSI { 1381}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 101  and name HB  ))
      2.300     0.600     0.600 peak  1381 spectrum    1 weight  0.10000E+01 volume  0.45295E-02 ppm1      0.984 ppm2      2.043 CV     1
 ASSI { 1384}
   (( segid "    " and resid 101  and name HB  ))
   (( segid "    " and resid 98   and name HA  ))
      3.000     1.100     1.100 peak  1384 spectrum    1 weight  0.10000E+01 volume  0.62444E-03 ppm1      2.043 ppm2      3.995 CV     1
 ASSI { 1387}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 87   and name HB3 ))
      4.100     2.100     1.900 peak  1387 spectrum    1 weight  0.10000E+01 volume  0.59713E-03 ppm1      3.633 ppm2      1.475 CV     1
 ASSI { 1388}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name H   ))
      3.100     1.200     1.200 peak  1388 spectrum    1 weight  0.10000E+01 volume  0.14770E-02 ppm1      3.940 ppm2      7.746 CV     1
 ASSI { 1390}
   (( segid "    " and resid 100  and name HB3 ))
   (( segid "    " and resid 100  and name H   ))
      4.500     2.500     1.500 peak  1390 spectrum    1 weight  0.10000E+01 volume  0.70547E-03 ppm1      0.994 ppm2      7.749 CV     1
 ASSI { 1392}
   (( segid "    " and resid 100  and name HD2 ))
   (( segid "    " and resid 100  and name HB2 ))
      3.600     1.600     1.600 peak  1392 spectrum    1 weight  0.10000E+01 volume  0.53637E-03 ppm1      7.077 ppm2      2.292 CV     1
 ASSI { 1395}
   (( segid "    " and resid 100  and name HD2 ))
   (( segid "    " and resid 100  and name HB3 ))
      4.000     2.000     2.000 peak  1395 spectrum    1 weight  0.10000E+01 volume  0.10883E-02 ppm1      7.077 ppm2      1.011 CV     1
 ASSI { 1396}
   (( segid "    " and resid 100  and name HD2 ))
   (( segid "    " and resid 100  and name HA  ))
      4.400     2.500     1.600 peak  1396 spectrum    1 weight  0.10000E+01 volume  0.35669E-03 ppm1      7.083 ppm2      3.945 CV     1
 ASSI { 1397}
   (( segid "    " and resid 100  and name HD2 ))
   (( segid "    " and resid 97   and name HA  ))
      4.100     2.100     1.900 peak  1397 spectrum    1 weight  0.10000E+01 volume  0.33349E-03 ppm1      7.081 ppm2      3.656 CV     1
 ASSI { 1399}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 103  and name HB3 ))
      2.700     0.900     0.900 peak  1399 spectrum    1 weight  0.10000E+01 volume  0.43523E-02 ppm1      3.942 ppm2      1.822 CV     1
 OR { 1399}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 103  and name HB2 ))
 ASSI { 1400}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 103  and name HE3 ))
      3.400     1.500     1.500 peak  1400 spectrum    1 weight  0.10000E+01 volume  0.11754E-02 ppm1      3.946 ppm2      2.893 CV     1
 OR { 1400}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 103  and name HE2 ))
 ASSI { 1402}
   (( segid "    " and resid 11   and name HG3 ))
   (( segid "    " and resid 12   and name H   ))
      4.800     2.900     1.200 peak  1402 spectrum    1 weight  0.10000E+01 volume  0.47217E-03 ppm1      2.295 ppm2      8.969 CV     1
 ASSI { 1405}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 91   and name HB3 ))
      3.400     1.400     1.400 peak  1405 spectrum    1 weight  0.10000E+01 volume  0.45903E-03 ppm1      2.296 ppm2      2.704 CV     1
 ASSI { 1407}
   (( segid "    " and resid 11   and name HG3 ))
   (( segid "    " and resid 11   and name HB3 ))
      2.500     0.800     0.800 peak  1407 spectrum    1 weight  0.10000E+01 volume  0.35134E-02 ppm1      2.289 ppm2      2.011 CV     1
 ASSI { 1410}
   (( segid "    " and resid 100  and name HB3 ))
   (( segid "    " and resid 100  and name HB2 ))
      2.500     0.800     0.800 peak  1410 spectrum    1 weight  0.10000E+01 volume  0.12013E-02 ppm1      1.011 ppm2      2.271 CV     1
 ASSI { 1415}
   (( segid "    " and resid 99   and name HA2 ))
   (( segid "    " and resid 99   and name HA3 ))
      2.800     1.000     1.000 peak  1415 spectrum    1 weight  0.10000E+01 volume  0.72651E-03 ppm1      3.826 ppm2      3.620 CV     1
 ASSI { 1418}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 98   and name HD2%)
      2.300     0.700     0.700 peak  1418 spectrum    1 weight  0.10000E+01 volume  0.64708E-02 ppm1      3.984 ppm2      0.865 CV     1
 OR { 1418}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 98   and name HD1%)
 ASSI { 1419}
   (( segid "    " and resid 20   and name HA  ))
   (  segid "    " and resid 20   and name HD1%)
      2.200     0.600     0.600 peak  1419 spectrum    1 weight  0.10000E+01 volume  0.66502E-02 ppm1      3.959 ppm2      0.669 CV     1
 ASSI { 1422}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HB2 ))
      2.400     0.700     0.700 peak  1422 spectrum    1 weight  0.10000E+01 volume  0.66480E-02 ppm1      3.969 ppm2      2.154 CV     1
 OR { 1422}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HG3 ))
 ASSI { 1423}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HG2 ))
      3.000     1.100     1.100 peak  1423 spectrum    1 weight  0.10000E+01 volume  0.54289E-02 ppm1      3.969 ppm2      1.994 CV     1
 OR { 1423}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 57   and name HE% )
 ASSI { 1424}
   (( segid "    " and resid 22   and name HB3 ))
   (  segid "    " and resid 22   and name HD1%)
      2.200     0.600     0.600 peak  1424 spectrum    1 weight  0.10000E+01 volume  0.11037E-01 ppm1      1.451 ppm2      0.946 CV     1
 OR { 1424}
   (( segid "    " and resid 22   and name HB3 ))
   (  segid "    " and resid 22   and name HD2%)
 ASSI { 1425}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 22   and name HG  ))
      3.100     1.200     1.200 peak  1425 spectrum    1 weight  0.10000E+01 volume  0.22646E-02 ppm1      1.451 ppm2      2.052 CV     1
 ASSI { 1426}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 102  and name HG2 ))
      4.300     2.300     1.700 peak  1426 spectrum    1 weight  0.10000E+01 volume  0.80949E-03 ppm1      1.440 ppm2      2.724 CV     1
 ASSI { 1427}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 111  and name HD2 ))
      4.100     2.100     1.900 peak  1427 spectrum    1 weight  0.10000E+01 volume  0.45597E-03 ppm1      1.424 ppm2      3.259 CV     1
 OR { 1427}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 111  and name HD3 ))
 ASSI { 1428}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 22   and name HA  ))
      2.500     0.800     0.800 peak  1428 spectrum    1 weight  0.10000E+01 volume  0.15826E-02 ppm1      1.450 ppm2      3.725 CV     1
 ASSI { 1431}
   (( segid "    " and resid 98   and name HB3 ))
   (( segid "    " and resid 111  and name HD3 ))
      3.100     1.200     1.200 peak  1431 spectrum    1 weight  0.10000E+01 volume  0.59073E-03 ppm1      1.833 ppm2      3.241 CV     1
 ASSI { 1433}
   (( segid "    " and resid 98   and name HB3 ))
   (( segid "    " and resid 98   and name HB2 ))
      1.900     0.400     0.400 peak  1433 spectrum    1 weight  0.10000E+01 volume  0.42432E-02 ppm1      1.842 ppm2      1.435 CV     1
 ASSI { 1434}
   (( segid "    " and resid 37   and name HB3 ))
   (  segid "    " and resid 37   and name HD2%)
      2.100     0.500     0.500 peak  1434 spectrum    1 weight  0.10000E+01 volume  0.85995E-02 ppm1      1.855 ppm2      0.837 CV     1
 OR { 1434}
   (( segid "    " and resid 37   and name HB3 ))
   (  segid "    " and resid 37   and name HD1%)
 ASSI { 1435}
   (( segid "    " and resid 98   and name HB3 ))
   (  segid "    " and resid 98   and name HD1%)
      2.300     0.700     0.700 peak  1435 spectrum    1 weight  0.10000E+01 volume  0.85806E-02 ppm1      1.834 ppm2      0.875 CV     1
 OR { 1435}
   (( segid "    " and resid 98   and name HB3 ))
   (  segid "    " and resid 98   and name HD2%)
 ASSI { 1437}
   (( segid "    " and resid 98   and name HG  ))
   (  segid "    " and resid 98   and name HD1%)
      1.900     0.500     0.500 peak  1437 spectrum    1 weight  0.10000E+01 volume  0.14052E-01 ppm1      1.723 ppm2      0.876 CV     1
 OR { 1437}
   (( segid "    " and resid 98   and name HG  ))
   (  segid "    " and resid 98   and name HD2%)
 ASSI { 1441}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 102  and name HG2 ))
      3.800     1.800     1.800 peak  1441 spectrum    1 weight  0.10000E+01 volume  0.10191E-02 ppm1      0.851 ppm2      2.744 CV     1
 ASSI { 1452}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 47   and name HA  ))
      3.400     1.400     1.400 peak  1452 spectrum    1 weight  0.10000E+01 volume  0.25733E-02 ppm1      0.852 ppm2      3.738 CV     1
 ASSI { 1455}
   (  segid "    " and resid 98   and name HD1%)
   (  segid "    " and resid 84   and name HD2%)
      3.300     1.400     1.400 peak  1455 spectrum    1 weight  0.10000E+01 volume  0.45514E-02 ppm1      0.894 ppm2      0.652 CV     1
 ASSI { 1459}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 102  and name HG2 ))
      3.300     1.400     1.400 peak  1459 spectrum    1 weight  0.10000E+01 volume  0.11831E-02 ppm1      0.892 ppm2      2.737 CV     1
 ASSI { 1463}
   (  segid "    " and resid 98   and name HD2%)
   (  segid "    " and resid 131  and name HE% )
      4.600     2.600     1.400 peak  1463 spectrum    1 weight  0.10000E+01 volume  0.11167E-02 ppm1      0.851 ppm2      6.739 CV     1
 ASSI { 1467}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 101  and name H   ))
      4.100     2.100     1.900 peak  1467 spectrum    1 weight  0.10000E+01 volume  0.12968E-02 ppm1      0.852 ppm2      8.324 CV     1
 ASSI { 1474}
   (( segid "    " and resid 98   and name HB3 ))
   (( segid "    " and resid 98   and name H   ))
      3.400     1.400     1.400 peak  1474 spectrum    1 weight  0.10000E+01 volume  0.27378E-02 ppm1      1.834 ppm2      8.576 CV     1
 ASSI { 1476}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 36   and name H   ))
      4.100     2.100     1.900 peak  1476 spectrum    1 weight  0.10000E+01 volume  0.11294E-02 ppm1      1.851 ppm2      8.122 CV     1
 ASSI { 1478}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 36   and name HG2%)
      2.200     0.600     0.600 peak  1478 spectrum    1 weight  0.10000E+01 volume  0.10482E-01 ppm1      3.661 ppm2      0.992 CV     1
 OR { 1478}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 36   and name HD1%)
 ASSI { 1479}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HB  ))
      2.700     0.900     0.900 peak  1479 spectrum    1 weight  0.10000E+01 volume  0.20000E-02 ppm1      3.664 ppm2      2.207 CV     1
 ASSI { 1480}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 44   and name HB2 ))
      1.700     0.400     0.500 peak  1480 spectrum    1 weight  0.10000E+01 volume  0.17637E-01 ppm1      2.187 ppm2      1.885 CV     1
 OR { 1480}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 44   and name HG3 ))
 ASSI { 1484}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 123  and name HB3 ))
      4.900     3.000     1.100 peak  1484 spectrum    1 weight  0.10000E+01 volume  0.15272E-02 ppm1      1.049 ppm2      0.652 CV     1
 OR { 1484}
   (  segid "    " and resid 97   and name HG1%)
   (  segid "    " and resid 123  and name HD2%)
 ASSI { 1486}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 97   and name HB  ))
      2.100     0.600     0.600 peak  1486 spectrum    1 weight  0.10000E+01 volume  0.76056E-02 ppm1      1.050 ppm2      2.209 CV     1
 ASSI { 1489}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 98   and name HB2 ))
      3.000     1.100     1.100 peak  1489 spectrum    1 weight  0.10000E+01 volume  0.39611E-02 ppm1      1.050 ppm2      1.441 CV     1
 ASSI { 1490}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 132  and name HE2 ))
      3.600     3.600     2.400 peak  1490 spectrum    1 weight  0.10000E+01 volume  0.65696E-03 ppm1      1.049 ppm2      3.029 CV     1
 OR { 1490}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 132  and name HE3 ))
 ASSI { 1491}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 88   and name HB2 ))
      4.200     2.200     1.800 peak  1491 spectrum    1 weight  0.10000E+01 volume  0.57424E-03 ppm1      1.051 ppm2      2.915 CV     1
 ASSI { 1493}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 91   and name HB3 ))
      4.800     2.900     1.200 peak  1493 spectrum    1 weight  0.10000E+01 volume  0.63860E-03 ppm1      1.051 ppm2      2.657 CV     1
 ASSI { 1495}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 130  and name HA  ))
      3.200     1.300     1.300 peak  1495 spectrum    1 weight  0.10000E+01 volume  0.13259E-02 ppm1      1.051 ppm2      4.298 CV     1
 ASSI { 1501}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 92   and name HB2 ))
      3.000     1.100     1.100 peak  1501 spectrum    1 weight  0.10000E+01 volume  0.56361E-02 ppm1      0.999 ppm2      1.501 CV     1
 ASSI { 1502}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 97   and name HB  ))
      2.100     0.600     0.600 peak  1502 spectrum    1 weight  0.10000E+01 volume  0.93101E-02 ppm1      1.000 ppm2      2.208 CV     1
 ASSI { 1504}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 51   and name HA  ))
      2.900     1.000     1.000 peak  1504 spectrum    1 weight  0.10000E+01 volume  0.21129E-02 ppm1      0.997 ppm2      3.010 CV     1
 ASSI { 1505}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 91   and name HB3 ))
      3.300     1.400     1.400 peak  1505 spectrum    1 weight  0.10000E+01 volume  0.14005E-02 ppm1      1.000 ppm2      2.687 CV     1
 ASSI { 1507}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 88   and name HA  ))
      2.300     0.700     0.700 peak  1507 spectrum    1 weight  0.10000E+01 volume  0.46974E-02 ppm1      1.001 ppm2      3.956 CV     1
 ASSI { 1509}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 91   and name HB2 ))
      2.900     1.000     1.000 peak  1509 spectrum    1 weight  0.10000E+01 volume  0.15409E-02 ppm1      1.000 ppm2      3.366 CV     1
 ASSI { 1510}
   (  segid "    " and resid 97   and name HG2%)
   (  segid "    " and resid 88   and name HE% )
      3.000     1.100     1.100 peak  1510 spectrum    1 weight  0.10000E+01 volume  0.33153E-02 ppm1      1.000 ppm2      7.183 CV     1
 ASSI { 1513}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 101  and name H   ))
      3.800     1.800     1.800 peak  1513 spectrum    1 weight  0.10000E+01 volume  0.13153E-02 ppm1      0.998 ppm2      8.321 CV     1
 ASSI { 1515}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 88   and name H   ))
      4.800     2.900     1.200 peak  1515 spectrum    1 weight  0.10000E+01 volume  0.55781E-03 ppm1      1.000 ppm2      8.898 CV     1
 ASSI { 1516}
   (  segid "    " and resid 97   and name HG1%)
   (  segid "    " and resid 88   and name HE% )
      2.600     0.800     0.800 peak  1516 spectrum    1 weight  0.10000E+01 volume  0.31646E-02 ppm1      1.050 ppm2      7.200 CV     1
 ASSI { 1517}
   (  segid "    " and resid 97   and name HG1%)
   (  segid "    " and resid 88   and name HD% )
      2.600     0.900     0.900 peak  1517 spectrum    1 weight  0.10000E+01 volume  0.28717E-02 ppm1      1.050 ppm2      7.063 CV     1
 OR { 1517}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 88   and name HZ  ))
 ASSI { 1520}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 101  and name H   ))
      4.500     2.600     1.500 peak  1520 spectrum    1 weight  0.10000E+01 volume  0.61930E-03 ppm1      1.052 ppm2      8.302 CV     1
 ASSI { 1521}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 88   and name H   ))
      5.900     4.300     0.100 peak  1521 spectrum    1 weight  0.10000E+01 volume  0.25891E-03 ppm1      1.046 ppm2      8.890 CV     1
 ASSI { 1528}
   (( segid "    " and resid 96   and name HB3 ))
   (( segid "    " and resid 100  and name HD2 ))
      4.400     2.400     1.600 peak  1528 spectrum    1 weight  0.10000E+01 volume  0.27649E-03 ppm1      2.567 ppm2      7.081 CV     1
 OR { 1528}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 100  and name HD2 ))
 ASSI { 1529}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 62   and name H   ))
      3.100     1.200     1.200 peak  1529 spectrum    1 weight  0.10000E+01 volume  0.25355E-02 ppm1      4.541 ppm2      7.865 CV     1
 ASSI { 1530}
   (( segid "    " and resid 79   and name HB3 ))
   (( segid "    " and resid 80   and name H   ))
      4.200     2.200     1.800 peak  1530 spectrum    1 weight  0.10000E+01 volume  0.66475E-03 ppm1      2.699 ppm2      7.868 CV     1
 ASSI { 1531}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 97   and name HG1%)
      4.100     2.100     1.900 peak  1531 spectrum    1 weight  0.10000E+01 volume  0.85625E-03 ppm1      4.531 ppm2      1.002 CV     1
 OR { 1531}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 97   and name HG2%)
 ASSI { 1532}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 60   and name HB% )
      4.100     2.100     1.900 peak  1532 spectrum    1 weight  0.10000E+01 volume  0.10926E-02 ppm1      4.542 ppm2      1.234 CV     1
 ASSI { 1533}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 132  and name HB3 ))
      3.200     3.200     2.800 peak  1533 spectrum    1 weight  0.10000E+01 volume  0.29622E-02 ppm1      4.538 ppm2      1.848 CV     1
 OR { 1533}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 132  and name HB2 ))
 ASSI { 1534}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 132  and name HD2 ))
      3.400     1.500     1.500 peak  1534 spectrum    1 weight  0.10000E+01 volume  0.20828E-02 ppm1      4.535 ppm2      1.737 CV     1
 OR { 1534}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 132  and name HD3 ))
 ASSI { 1535}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 95   and name HB3 ))
      2.500     0.800     0.800 peak  1535 spectrum    1 weight  0.10000E+01 volume  0.76117E-02 ppm1      4.537 ppm2      2.790 CV     1
 OR { 1535}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 95   and name HB2 ))
 ASSI { 1540}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 94   and name HB3 ))
      3.800     1.800     1.800 peak  1540 spectrum    1 weight  0.10000E+01 volume  0.66370E-03 ppm1      4.523 ppm2      4.178 CV     1
 ASSI { 1541}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 94   and name HB2 ))
      3.800     1.800     1.800 peak  1541 spectrum    1 weight  0.10000E+01 volume  0.46438E-03 ppm1      4.532 ppm2      4.013 CV     1
 ASSI { 1542}
   (( segid "    " and resid 24   and name HA  ))
   (  segid "    " and resid 27   and name HG1%)
      2.600     0.900     0.900 peak  1542 spectrum    1 weight  0.10000E+01 volume  0.69718E-02 ppm1      4.933 ppm2      0.980 CV     1
 ASSI { 1547}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 93   and name HB3 ))
      2.000     0.500     0.500 peak  1547 spectrum    1 weight  0.10000E+01 volume  0.91120E-02 ppm1      2.840 ppm2      2.473 CV     1
 ASSI { 1549}
   (( segid "    " and resid 93   and name HB3 ))
   (( segid "    " and resid 93   and name HA  ))
      3.900     1.900     1.900 peak  1549 spectrum    1 weight  0.10000E+01 volume  0.46775E-03 ppm1      2.472 ppm2      4.927 CV     1
 ASSI { 1553}
   (( segid "    " and resid 26   and name HB3 ))
   (( segid "    " and resid 25   and name HG3 ))
      3.700     1.700     1.700 peak  1553 spectrum    1 weight  0.10000E+01 volume  0.85217E-03 ppm1      2.483 ppm2      1.140 CV     1
 ASSI { 1555}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 64   and name HB2 ))
      5.200     3.400     0.800 peak  1555 spectrum    1 weight  0.10000E+01 volume  0.31202E-03 ppm1      2.481 ppm2      1.825 CV     1
 ASSI { 1561}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 92   and name H   ))
      3.800     1.800     1.800 peak  1561 spectrum    1 weight  0.10000E+01 volume  0.14623E-02 ppm1      1.528 ppm2      7.834 CV     1
 ASSI { 1563}
   (( segid "    " and resid 92   and name HD2 ))
   (( segid "    " and resid 92   and name HG3 ))
      2.500     0.800     0.800 peak  1563 spectrum    1 weight  0.10000E+01 volume  0.40664E-02 ppm1      2.910 ppm2      1.522 CV     1
 OR { 1563}
   (( segid "    " and resid 92   and name HD2 ))
   (( segid "    " and resid 92   and name HB2 ))
 ASSI { 1564}
   (( segid "    " and resid 92   and name HD2 ))
   (( segid "    " and resid 92   and name HG2 ))
      2.900     1.000     1.000 peak  1564 spectrum    1 weight  0.10000E+01 volume  0.22860E-02 ppm1      2.911 ppm2      1.272 CV     1
 ASSI { 1566}
   (( segid "    " and resid 92   and name HD2 ))
   (( segid "    " and resid 92   and name HB3 ))
      2.800     1.000     1.000 peak  1566 spectrum    1 weight  0.10000E+01 volume  0.21950E-02 ppm1      2.909 ppm2      1.102 CV     1
 ASSI { 1567}
   (( segid "    " and resid 92   and name HD3 ))
   (( segid "    " and resid 92   and name HG2 ))
      2.500     0.800     0.800 peak  1567 spectrum    1 weight  0.10000E+01 volume  0.23518E-02 ppm1      3.033 ppm2      1.272 CV     1
 ASSI { 1568}
   (( segid "    " and resid 92   and name HD3 ))
   (( segid "    " and resid 92   and name HB3 ))
      3.000     1.100     1.100 peak  1568 spectrum    1 weight  0.10000E+01 volume  0.19917E-02 ppm1      3.033 ppm2      1.090 CV     1
 ASSI { 1569}
   (( segid "    " and resid 92   and name HD3 ))
   (( segid "    " and resid 92   and name HB2 ))
      2.800     1.000     1.000 peak  1569 spectrum    1 weight  0.10000E+01 volume  0.34608E-02 ppm1      3.033 ppm2      1.531 CV     1
 OR { 1569}
   (( segid "    " and resid 92   and name HD3 ))
   (( segid "    " and resid 92   and name HG3 ))
 ASSI { 1570}
   (( segid "    " and resid 92   and name HD2 ))
   (( segid "    " and resid 89   and name HB3 ))
      4.200     2.200     1.800 peak  1570 spectrum    1 weight  0.10000E+01 volume  0.61376E-03 ppm1      2.904 ppm2      2.198 CV     1
 ASSI { 1571}
   (( segid "    " and resid 92   and name HD2 ))
   (( segid "    " and resid 89   and name HB2 ))
      5.200     3.400     0.800 peak  1571 spectrum    1 weight  0.10000E+01 volume  0.48013E-03 ppm1      2.911 ppm2      2.038 CV     1
 ASSI { 1573}
   (( segid "    " and resid 92   and name HD2 ))
   (( segid "    " and resid 92   and name HD3 ))
      1.600     0.300     0.600 peak  1573 spectrum    1 weight  0.10000E+01 volume  0.12179E-01 ppm1      2.910 ppm2      3.036 CV     1
 ASSI { 1574}
   (( segid "    " and resid 92   and name HD2 ))
   (( segid "    " and resid 89   and name HA  ))
      3.200     1.300     1.300 peak  1574 spectrum    1 weight  0.10000E+01 volume  0.13655E-02 ppm1      2.910 ppm2      3.745 CV     1
 ASSI { 1575}
   (( segid "    " and resid 92   and name HD2 ))
   (( segid "    " and resid 92   and name HA  ))
      4.400     2.400     1.600 peak  1575 spectrum    1 weight  0.10000E+01 volume  0.79140E-03 ppm1      2.910 ppm2      3.597 CV     1
 ASSI { 1576}
   (( segid "    " and resid 92   and name HD3 ))
   (( segid "    " and resid 89   and name HA  ))
      2.700     0.900     0.900 peak  1576 spectrum    1 weight  0.10000E+01 volume  0.15134E-02 ppm1      3.035 ppm2      3.743 CV     1
 ASSI { 1578}
   (( segid "    " and resid 92   and name HG2 ))
   (( segid "    " and resid 92   and name HB3 ))
      2.300     0.700     0.700 peak  1578 spectrum    1 weight  0.10000E+01 volume  0.41100E-02 ppm1      1.268 ppm2      1.094 CV     1
 ASSI { 1579}
   (( segid "    " and resid 92   and name HG2 ))
   (  segid "    " and resid 97   and name HG2%)
      3.300     1.300     1.300 peak  1579 spectrum    1 weight  0.10000E+01 volume  0.40012E-02 ppm1      1.265 ppm2      0.951 CV     1
 ASSI { 1580}
   (( segid "    " and resid 92   and name HG2 ))
   (( segid "    " and resid 92   and name HG3 ))
      1.800     0.400     0.400 peak  1580 spectrum    1 weight  0.10000E+01 volume  0.10288E-01 ppm1      1.272 ppm2      1.508 CV     1
 OR { 1580}
   (( segid "    " and resid 92   and name HG2 ))
   (( segid "    " and resid 92   and name HB2 ))
 ASSI { 1581}
   (( segid "    " and resid 92   and name HG2 ))
   (( segid "    " and resid 93   and name HB3 ))
      5.200     3.400     0.800 peak  1581 spectrum    1 weight  0.10000E+01 volume  0.30864E-03 ppm1      1.281 ppm2      2.457 CV     1
 ASSI { 1585}
   (( segid "    " and resid 92   and name HG2 ))
   (( segid "    " and resid 89   and name HA  ))
      3.500     1.500     1.500 peak  1585 spectrum    1 weight  0.10000E+01 volume  0.52963E-03 ppm1      1.268 ppm2      3.757 CV     1
 ASSI { 1586}
   (( segid "    " and resid 92   and name HG2 ))
   (( segid "    " and resid 92   and name HA  ))
      3.800     1.800     1.800 peak  1586 spectrum    1 weight  0.10000E+01 volume  0.10013E-02 ppm1      1.269 ppm2      3.599 CV     1
 ASSI { 1588}
   (( segid "    " and resid 92   and name HG3 ))
   (( segid "    " and resid 92   and name HB3 ))
      3.000     1.100     1.100 peak  1588 spectrum    1 weight  0.10000E+01 volume  0.34263E-02 ppm1      1.518 ppm2      1.094 CV     1
 ASSI { 1589}
   (( segid "    " and resid 48   and name HG3 ))
   (( segid "    " and resid 48   and name HG2 ))
      1.400     0.300     0.800 peak  1589 spectrum    1 weight  0.10000E+01 volume  0.29465E-01 ppm1      1.512 ppm2      1.337 CV     1
 ASSI { 1591}
   (( segid "    " and resid 48   and name HG3 ))
   (( segid "    " and resid 48   and name HE3 ))
      2.600     0.800     0.800 peak  1591 spectrum    1 weight  0.10000E+01 volume  0.10713E-01 ppm1      1.511 ppm2      2.977 CV     1
 OR { 1591}
   (( segid "    " and resid 48   and name HG3 ))
   (( segid "    " and resid 48   and name HE2 ))
 ASSI { 1592}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 134  and name HD3 ))
      3.600     1.600     1.600 peak  1592 spectrum    1 weight  0.10000E+01 volume  0.13179E-02 ppm1      1.514 ppm2      3.229 CV     1
 OR { 1592}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 134  and name HD2 ))
 OR { 1592}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 134  and name HD3 ))
 OR { 1592}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 134  and name HD2 ))
 ASSI { 1593}
   (( segid "    " and resid 48   and name HG3 ))
   (( segid "    " and resid 48   and name HA  ))
      2.800     1.000     1.000 peak  1593 spectrum    1 weight  0.10000E+01 volume  0.27778E-02 ppm1      1.513 ppm2      3.887 CV     1
 ASSI { 1594}
   (( segid "    " and resid 92   and name HG3 ))
   (( segid "    " and resid 89   and name HA  ))
      4.100     2.100     1.900 peak  1594 spectrum    1 weight  0.10000E+01 volume  0.12919E-02 ppm1      1.519 ppm2      3.740 CV     1
 ASSI { 1595}
   (( segid "    " and resid 92   and name HG3 ))
   (( segid "    " and resid 92   and name HA  ))
      3.600     1.600     1.600 peak  1595 spectrum    1 weight  0.10000E+01 volume  0.14521E-02 ppm1      1.520 ppm2      3.596 CV     1
 ASSI { 1598}
   (( segid "    " and resid 92   and name HB3 ))
   (( segid "    " and resid 92   and name HB2 ))
      2.100     0.500     0.500 peak  1598 spectrum    1 weight  0.10000E+01 volume  0.40650E-02 ppm1      1.096 ppm2      1.523 CV     1
 OR { 1598}
   (( segid "    " and resid 92   and name HB3 ))
   (( segid "    " and resid 92   and name HG3 ))
 ASSI { 1599}
   (( segid "    " and resid 92   and name HB3 ))
   (( segid "    " and resid 97   and name HB  ))
      4.500     2.500     1.500 peak  1599 spectrum    1 weight  0.10000E+01 volume  0.51151E-03 ppm1      1.106 ppm2      2.199 CV     1
 ASSI { 1602}
   (( segid "    " and resid 92   and name HB3 ))
   (( segid "    " and resid 89   and name HA  ))
      3.300     1.400     1.400 peak  1602 spectrum    1 weight  0.10000E+01 volume  0.58062E-03 ppm1      1.097 ppm2      3.738 CV     1
 ASSI { 1603}
   (( segid "    " and resid 92   and name HB3 ))
   (( segid "    " and resid 92   and name HA  ))
      2.900     1.100     1.100 peak  1603 spectrum    1 weight  0.10000E+01 volume  0.12510E-02 ppm1      1.097 ppm2      3.597 CV     1
 ASSI { 1604}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 92   and name HD3 ))
      3.300     1.400     1.400 peak  1604 spectrum    1 weight  0.10000E+01 volume  0.21359E-02 ppm1      1.525 ppm2      3.035 CV     1
 ASSI { 1605}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 92   and name HA  ))
      2.800     1.000     1.000 peak  1605 spectrum    1 weight  0.10000E+01 volume  0.16343E-02 ppm1      1.528 ppm2      3.595 CV     1
 ASSI { 1606}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 92   and name HG2 ))
      3.000     1.100     1.100 peak  1606 spectrum    1 weight  0.10000E+01 volume  0.31517E-02 ppm1      1.529 ppm2      1.268 CV     1
 ASSI { 1607}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 97   and name HG2%)
      2.700     0.900     0.900 peak  1607 spectrum    1 weight  0.10000E+01 volume  0.43963E-02 ppm1      3.594 ppm2      1.022 CV     1
 OR { 1607}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 97   and name HG1%)
 ASSI { 1609}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name HB2 ))
      2.700     0.900     0.900 peak  1609 spectrum    1 weight  0.10000E+01 volume  0.25504E-02 ppm1      3.593 ppm2      1.523 CV     1
 OR { 1609}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name HG3 ))
 ASSI { 1610}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 97   and name HB  ))
      2.900     1.100     1.100 peak  1610 spectrum    1 weight  0.10000E+01 volume  0.70820E-03 ppm1      3.593 ppm2      2.209 CV     1
 ASSI { 1611}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name HD3 ))
      5.400     3.600     0.600 peak  1611 spectrum    1 weight  0.10000E+01 volume  0.36275E-03 ppm1      3.596 ppm2      3.030 CV     1
 ASSI { 1614}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 88   and name HE% )
      4.700     2.800     1.300 peak  1614 spectrum    1 weight  0.10000E+01 volume  0.37967E-03 ppm1      3.598 ppm2      7.213 CV     1
 ASSI { 1617}
   (( segid "    " and resid 92   and name HB2 ))
   (  segid "    " and resid 88   and name HE% )
      3.800     1.900     1.900 peak  1617 spectrum    1 weight  0.10000E+01 volume  0.63870E-03 ppm1      1.526 ppm2      7.202 CV     1
 ASSI { 1618}
   (( segid "    " and resid 92   and name HB3 ))
   (  segid "    " and resid 88   and name HE% )
      3.600     1.600     1.600 peak  1618 spectrum    1 weight  0.10000E+01 volume  0.58975E-03 ppm1      1.099 ppm2      7.222 CV     1
 ASSI { 1621}
   (( segid "    " and resid 92   and name HG2 ))
   (  segid "    " and resid 88   and name HE% )
      4.300     2.300     1.700 peak  1621 spectrum    1 weight  0.10000E+01 volume  0.71003E-03 ppm1      1.261 ppm2      7.212 CV     1
 ASSI { 1624}
   (( segid "    " and resid 92   and name HG3 ))
   (  segid "    " and resid 88   and name HE% )
      4.500     2.500     1.500 peak  1624 spectrum    1 weight  0.10000E+01 volume  0.69616E-03 ppm1      1.519 ppm2      7.214 CV     1
 ASSI { 1626}
   (( segid "    " and resid 92   and name HD3 ))
   (  segid "    " and resid 88   and name HE% )
      3.200     1.300     1.300 peak  1626 spectrum    1 weight  0.10000E+01 volume  0.15782E-02 ppm1      3.033 ppm2      7.209 CV     1
 ASSI { 1627}
   (( segid "    " and resid 92   and name HD3 ))
   (  segid "    " and resid 88   and name HD% )
      2.500     2.500     3.500 peak  1627 spectrum    1 weight  0.10000E+01 volume  0.69880E-03 ppm1      3.034 ppm2      7.039 CV     1
 ASSI { 1628}
   (( segid "    " and resid 92   and name HD2 ))
   (  segid "    " and resid 88   and name HE% )
      3.000     1.100     1.100 peak  1628 spectrum    1 weight  0.10000E+01 volume  0.16737E-02 ppm1      2.911 ppm2      7.216 CV     1
 ASSI { 1629}
   (( segid "    " and resid 92   and name HD2 ))
   (( segid "    " and resid 88   and name HZ  ))
      3.200     1.300     1.300 peak  1629 spectrum    1 weight  0.10000E+01 volume  0.91826E-03 ppm1      2.905 ppm2      7.067 CV     1
 ASSI { 1632}
   (( segid "    " and resid 91   and name HB2 ))
   (  segid "    " and resid 91   and name HD% )
      3.300     1.300     1.300 peak  1632 spectrum    1 weight  0.10000E+01 volume  0.11177E-02 ppm1      3.371 ppm2      7.094 CV     1
 ASSI { 1633}
   (( segid "    " and resid 91   and name HB3 ))
   (  segid "    " and resid 91   and name HD% )
      3.500     1.500     1.500 peak  1633 spectrum    1 weight  0.10000E+01 volume  0.62911E-03 ppm1      2.691 ppm2      7.097 CV     1
 ASSI { 1637}
   (  segid "    " and resid 66   and name HE% )
   (  segid "    " and resid 66   and name HD% )
      1.900     0.500     0.500 peak  1637 spectrum    1 weight  0.10000E+01 volume  0.10222E-01 ppm1      7.091 ppm2      7.290 CV     1
 ASSI { 1639}
   (( segid "    " and resid 79   and name HB3 ))
   (  segid "    " and resid 82   and name HD1%)
      3.400     1.500     1.500 peak  1639 spectrum    1 weight  0.10000E+01 volume  0.17731E-02 ppm1      2.691 ppm2      0.987 CV     1
 OR { 1639}
   (( segid "    " and resid 79   and name HB3 ))
   (  segid "    " and resid 82   and name HD2%)
 ASSI { 1640}
   (( segid "    " and resid 116  and name HB3 ))
   (( segid "    " and resid 127  and name HB3 ))
      5.400     3.600     0.600 peak  1640 spectrum    1 weight  0.10000E+01 volume  0.67456E-03 ppm1      2.690 ppm2      1.823 CV     1
 OR { 1640}
   (( segid "    " and resid 116  and name HB3 ))
   (( segid "    " and resid 127  and name HB2 ))
 ASSI { 1642}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 66   and name HZ  ))
      2.000     0.500     0.500 peak  1642 spectrum    1 weight  0.10000E+01 volume  0.83065E-02 ppm1      7.090 ppm2      6.948 CV     1
 ASSI { 1645}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 33   and name H   ))
      4.000     2.000     2.000 peak  1645 spectrum    1 weight  0.10000E+01 volume  0.32753E-03 ppm1      7.296 ppm2      7.978 CV     1
 ASSI { 1649}
   (( segid "    " and resid 66   and name HZ  ))
   (  segid "    " and resid 66   and name HD% )
      3.500     1.500     1.500 peak  1649 spectrum    1 weight  0.10000E+01 volume  0.12030E-02 ppm1      6.934 ppm2      7.291 CV     1
 ASSI { 1653}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 65   and name HB3 ))
      3.100     1.200     1.200 peak  1653 spectrum    1 weight  0.10000E+01 volume  0.96441E-03 ppm1      7.092 ppm2      2.399 CV     1
 ASSI { 1656}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 90   and name HB2 ))
      3.400     1.400     1.400 peak  1656 spectrum    1 weight  0.10000E+01 volume  0.59530E-03 ppm1      7.077 ppm2      1.774 CV     1
 ASSI { 1657}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 54   and name HG  ))
      4.100     2.100     1.900 peak  1657 spectrum    1 weight  0.10000E+01 volume  0.78347E-03 ppm1      7.087 ppm2      1.679 CV     1
 ASSI { 1661}
   (  segid "    " and resid 66   and name HE% )
   (  segid "    " and resid 51   and name HG2%)
      2.700     0.900     0.900 peak  1661 spectrum    1 weight  0.10000E+01 volume  0.21227E-02 ppm1      7.090 ppm2      0.672 CV     1
 ASSI { 1662}
   (  segid "    " and resid 66   and name HE% )
   (  segid "    " and resid 60   and name HB% )
      2.700     0.900     0.900 peak  1662 spectrum    1 weight  0.10000E+01 volume  0.51972E-02 ppm1      7.091 ppm2      1.253 CV     1
 ASSI { 1663}
   (  segid "    " and resid 66   and name HE% )
   (  segid "    " and resid 54   and name HD1%)
      2.500     0.800     0.800 peak  1663 spectrum    1 weight  0.10000E+01 volume  0.24413E-02 ppm1      7.091 ppm2      0.436 CV     1
 ASSI { 1665}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 51   and name HG12))
      3.800     1.800     1.800 peak  1665 spectrum    1 weight  0.10000E+01 volume  0.62312E-03 ppm1      7.291 ppm2      1.495 CV     1
 ASSI { 1666}
   (  segid "    " and resid 66   and name HD% )
   (  segid "    " and resid 32   and name HG1%)
      2.900     1.000     1.000 peak  1666 spectrum    1 weight  0.10000E+01 volume  0.29414E-02 ppm1      7.294 ppm2      1.282 CV     1
 ASSI { 1667}
   (  segid "    " and resid 66   and name HD% )
   (  segid "    " and resid 33   and name HG1%)
      2.400     0.700     0.700 peak  1667 spectrum    1 weight  0.10000E+01 volume  0.51697E-02 ppm1      7.293 ppm2      0.945 CV     1
 OR { 1667}
   (  segid "    " and resid 66   and name HD% )
   (  segid "    " and resid 33   and name HG2%)
 ASSI { 1669}
   (  segid "    " and resid 66   and name HD% )
   (  segid "    " and resid 51   and name HG2%)
      2.600     0.800     0.800 peak  1669 spectrum    1 weight  0.10000E+01 volume  0.33203E-02 ppm1      7.294 ppm2      0.669 CV     1
 ASSI { 1670}
   (  segid "    " and resid 66   and name HD% )
   (  segid "    " and resid 54   and name HD1%)
      3.900     1.900     1.900 peak  1670 spectrum    1 weight  0.10000E+01 volume  0.95214E-03 ppm1      7.294 ppm2      0.438 CV     1
 ASSI { 1671}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 51   and name HG13))
      3.600     1.600     1.600 peak  1671 spectrum    1 weight  0.10000E+01 volume  0.42213E-03 ppm1      7.296 ppm2      0.096 CV     1
 ASSI { 1674}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 67   and name HB2 ))
      4.500     2.500     1.500 peak  1674 spectrum    1 weight  0.10000E+01 volume  0.30402E-03 ppm1      7.297 ppm2      2.080 CV     1
 ASSI { 1677}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 66   and name HB3 ))
      2.500     0.800     0.800 peak  1677 spectrum    1 weight  0.10000E+01 volume  0.21056E-02 ppm1      7.293 ppm2      3.368 CV     1
 ASSI { 1678}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 66   and name HB2 ))
      2.800     1.000     1.000 peak  1678 spectrum    1 weight  0.10000E+01 volume  0.22928E-02 ppm1      7.294 ppm2      2.898 CV     1
 ASSI { 1679}
   (( segid "    " and resid 66   and name HZ  ))
   (( segid "    " and resid 54   and name HB3 ))
      3.700     1.700     1.700 peak  1679 spectrum    1 weight  0.10000E+01 volume  0.48498E-03 ppm1      6.932 ppm2      1.946 CV     1
 ASSI { 1683}
   (( segid "    " and resid 66   and name HZ  ))
   (  segid "    " and resid 54   and name HD1%)
      3.100     1.200     1.200 peak  1683 spectrum    1 weight  0.10000E+01 volume  0.19404E-02 ppm1      6.933 ppm2      0.436 CV     1
 ASSI { 1684}
   (( segid "    " and resid 90   and name HG2 ))
   (  segid "    " and resid 91   and name HD% )
      4.200     2.200     1.800 peak  1684 spectrum    1 weight  0.10000E+01 volume  0.12612E-02 ppm1      1.027 ppm2      7.094 CV     1
 ASSI { 1686}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 49   and name H   ))
      3.900     1.900     1.900 peak  1686 spectrum    1 weight  0.10000E+01 volume  0.99450E-03 ppm1      1.685 ppm2      7.739 CV     1
 OR { 1686}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 49   and name H   ))
 ASSI { 1688}
   (( segid "    " and resid 90   and name HG2 ))
   (( segid "    " and resid 91   and name H   ))
      4.400     2.400     1.600 peak  1688 spectrum    1 weight  0.10000E+01 volume  0.70940E-03 ppm1      1.026 ppm2      7.751 CV     1
 ASSI { 1689}
   (( segid "    " and resid 90   and name HG2 ))
   (( segid "    " and resid 90   and name H   ))
      3.500     1.500     1.500 peak  1689 spectrum    1 weight  0.10000E+01 volume  0.11485E-02 ppm1      1.027 ppm2      7.908 CV     1
 ASSI { 1691}
   (( segid "    " and resid 90   and name HG2 ))
   (( segid "    " and resid 89   and name HG2 ))
      5.300     3.500     0.700 peak  1691 spectrum    1 weight  0.10000E+01 volume  0.17789E-03 ppm1      1.028 ppm2      2.431 CV     1
 ASSI { 1692}
   (( segid "    " and resid 90   and name HG2 ))
   (( segid "    " and resid 89   and name HB3 ))
      4.300     2.300     1.700 peak  1692 spectrum    1 weight  0.10000E+01 volume  0.48878E-03 ppm1      1.035 ppm2      2.170 CV     1
 ASSI { 1693}
   (( segid "    " and resid 90   and name HG2 ))
   (( segid "    " and resid 86   and name HB3 ))
      4.500     2.600     1.500 peak  1693 spectrum    1 weight  0.10000E+01 volume  0.53142E-03 ppm1      1.020 ppm2      2.007 CV     1
 OR { 1693}
   (( segid "    " and resid 90   and name HG2 ))
   (( segid "    " and resid 86   and name HB2 ))
 ASSI { 1694}
   (( segid "    " and resid 90   and name HG2 ))
   (( segid "    " and resid 90   and name HG3 ))
      1.700     0.400     0.500 peak  1694 spectrum    1 weight  0.10000E+01 volume  0.14133E-01 ppm1      1.026 ppm2      1.691 CV     1
 ASSI { 1695}
   (( segid "    " and resid 90   and name HG2 ))
   (( segid "    " and resid 90   and name HB3 ))
      2.900     1.100     1.100 peak  1695 spectrum    1 weight  0.10000E+01 volume  0.32945E-02 ppm1      1.026 ppm2      1.478 CV     1
 ASSI { 1697}
   (( segid "    " and resid 90   and name HG2 ))
   (( segid "    " and resid 87   and name HA  ))
      4.700     2.700     1.300 peak  1697 spectrum    1 weight  0.10000E+01 volume  0.57318E-03 ppm1      1.023 ppm2      4.245 CV     1
 ASSI { 1700}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 57   and name HB2 ))
      2.200     0.600     0.600 peak  1700 spectrum    1 weight  0.10000E+01 volume  0.33763E-02 ppm1      1.687 ppm2      2.164 CV     1
 OR { 1700}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 57   and name HG3 ))
 ASSI { 1701}
   (( segid "    " and resid 57   and name HB3 ))
   (  segid "    " and resid 57   and name HE% )
      2.400     0.700     0.700 peak  1701 spectrum    1 weight  0.10000E+01 volume  0.34364E-02 ppm1      1.687 ppm2      1.983 CV     1
 OR { 1701}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 57   and name HG2 ))
 ASSI { 1704}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 48   and name HE2 ))
      3.600     3.600     2.400 peak  1704 spectrum    1 weight  0.10000E+01 volume  0.15300E-02 ppm1      1.698 ppm2      3.008 CV     1
 OR { 1704}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 48   and name HE2 ))
 OR { 1704}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 48   and name HE3 ))
 OR { 1704}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 48   and name HE3 ))
 ASSI { 1706}
   (( segid "    " and resid 90   and name HG3 ))
   (( segid "    " and resid 86   and name HA  ))
      3.600     1.600     1.600 peak  1706 spectrum    1 weight  0.10000E+01 volume  0.51865E-03 ppm1      1.671 ppm2      4.127 CV     1
 ASSI { 1707}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 57   and name HA  ))
      3.300     1.400     1.400 peak  1707 spectrum    1 weight  0.10000E+01 volume  0.14831E-02 ppm1      1.684 ppm2      3.963 CV     1
 ASSI { 1708}
   (( segid "    " and resid 90   and name HG3 ))
   (( segid "    " and resid 90   and name HA  ))
      3.400     1.500     1.500 peak  1708 spectrum    1 weight  0.10000E+01 volume  0.35760E-02 ppm1      1.689 ppm2      3.742 CV     1
 ASSI { 1709}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 44   and name HA  ))
      4.300     2.300     1.700 peak  1709 spectrum    1 weight  0.10000E+01 volume  0.67512E-03 ppm1      1.691 ppm2      4.347 CV     1
 OR { 1709}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 44   and name HA  ))
 ASSI { 1710}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name H   ))
      3.900     1.900     1.900 peak  1710 spectrum    1 weight  0.10000E+01 volume  0.65178E-03 ppm1      1.686 ppm2      8.101 CV     1
 OR { 1710}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 45   and name H   ))
 ASSI { 1711}
   (( segid "    " and resid 90   and name HB3 ))
   (( segid "    " and resid 90   and name H   ))
      4.000     2.000     2.000 peak  1711 spectrum    1 weight  0.10000E+01 volume  0.15530E-02 ppm1      1.473 ppm2      7.910 CV     1
 ASSI { 1712}
   (( segid "    " and resid 90   and name HB3 ))
   (( segid "    " and resid 91   and name H   ))
      4.100     2.100     1.900 peak  1712 spectrum    1 weight  0.10000E+01 volume  0.72912E-03 ppm1      1.471 ppm2      7.743 CV     1
 ASSI { 1714}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name H   ))
      2.800     1.000     1.000 peak  1714 spectrum    1 weight  0.10000E+01 volume  0.28243E-02 ppm1      3.745 ppm2      7.904 CV     1
 ASSI { 1717}
   (( segid "    " and resid 89   and name HG3 ))
   (  segid "    " and resid 123  and name HD1%)
      3.600     1.600     1.600 peak  1717 spectrum    1 weight  0.10000E+01 volume  0.84082E-03 ppm1      2.519 ppm2      0.810 CV     1
 ASSI { 1722}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 89   and name HB2 ))
      2.300     0.700     0.700 peak  1722 spectrum    1 weight  0.10000E+01 volume  0.50395E-02 ppm1      2.518 ppm2      2.039 CV     1
 ASSI { 1728}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 88   and name HB3 ))
      4.000     2.000     2.000 peak  1728 spectrum    1 weight  0.10000E+01 volume  0.52420E-03 ppm1      2.510 ppm2      3.193 CV     1
 ASSI { 1730}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 92   and name HD2 ))
      4.900     3.000     1.100 peak  1730 spectrum    1 weight  0.10000E+01 volume  0.56477E-03 ppm1      2.517 ppm2      2.900 CV     1
 ASSI { 1731}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 92   and name HD3 ))
      4.000     2.000     2.000 peak  1731 spectrum    1 weight  0.10000E+01 volume  0.74355E-03 ppm1      2.397 ppm2      3.040 CV     1
 ASSI { 1732}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 89   and name HA  ))
      3.100     1.200     1.200 peak  1732 spectrum    1 weight  0.10000E+01 volume  0.26283E-02 ppm1      2.519 ppm2      3.746 CV     1
 ASSI { 1733}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 89   and name HA  ))
      2.700     0.900     0.900 peak  1733 spectrum    1 weight  0.10000E+01 volume  0.30541E-02 ppm1      2.395 ppm2      3.747 CV     1
 ASSI { 1735}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 86   and name HA  ))
      3.300     1.400     1.400 peak  1735 spectrum    1 weight  0.10000E+01 volume  0.92950E-03 ppm1      2.514 ppm2      4.124 CV     1
 ASSI { 1736}
   (( segid "    " and resid 89   and name HG3 ))
   (  segid "    " and resid 88   and name HE% )
      4.600     2.600     1.400 peak  1736 spectrum    1 weight  0.10000E+01 volume  0.66185E-03 ppm1      2.519 ppm2      7.216 CV     1
 ASSI { 1737}
   (( segid "    " and resid 89   and name HG3 ))
   (  segid "    " and resid 88   and name HD% )
      3.300     1.300     1.300 peak  1737 spectrum    1 weight  0.10000E+01 volume  0.89123E-03 ppm1      2.518 ppm2      7.035 CV     1
 ASSI { 1738}
   (( segid "    " and resid 89   and name HG2 ))
   (  segid "    " and resid 88   and name HE% )
      3.600     1.600     1.600 peak  1738 spectrum    1 weight  0.10000E+01 volume  0.85460E-03 ppm1      2.396 ppm2      7.225 CV     1
 ASSI { 1739}
   (( segid "    " and resid 89   and name HG2 ))
   (  segid "    " and resid 88   and name HD% )
      2.900     1.000     1.000 peak  1739 spectrum    1 weight  0.10000E+01 volume  0.11690E-02 ppm1      2.397 ppm2      7.039 CV     1
 ASSI { 1741}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 89   and name H   ))
      2.300     0.700     0.700 peak  1741 spectrum    1 weight  0.10000E+01 volume  0.25355E-02 ppm1      2.519 ppm2      8.180 CV     1
 ASSI { 1742}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 90   and name H   ))
      4.000     2.000     2.000 peak  1742 spectrum    1 weight  0.10000E+01 volume  0.90275E-03 ppm1      2.517 ppm2      7.912 CV     1
 ASSI { 1745}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 89   and name H   ))
      2.800     1.000     1.000 peak  1745 spectrum    1 weight  0.10000E+01 volume  0.29562E-02 ppm1      2.395 ppm2      8.180 CV     1
 ASSI { 1749}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 88   and name H   ))
      4.900     3.000     1.100 peak  1749 spectrum    1 weight  0.10000E+01 volume  0.32232E-03 ppm1      2.515 ppm2      8.890 CV     1
 ASSI { 1756}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 67   and name HG3 ))
      2.000     0.500     0.500 peak  1756 spectrum    1 weight  0.10000E+01 volume  0.18815E-01 ppm1      2.170 ppm2      2.419 CV     1
 OR { 1756}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 67   and name HG2 ))
 ASSI { 1757}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 67   and name HB2 ))
      1.400     0.200     0.800 peak  1757 spectrum    1 weight  0.10000E+01 volume  0.34599E-01 ppm1      2.169 ppm2      2.064 CV     1
 ASSI { 1759}
   (( segid "    " and resid 67   and name HB2 ))
   (  segid "    " and resid 63   and name HG2%)
      2.500     0.800     0.800 peak  1759 spectrum    1 weight  0.10000E+01 volume  0.28515E-02 ppm1      2.043 ppm2      0.978 CV     1
 ASSI { 1761}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name HG2 ))
      2.500     0.800     0.800 peak  1761 spectrum    1 weight  0.10000E+01 volume  0.44824E-02 ppm1      3.746 ppm2      1.024 CV     1
 ASSI { 1762}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 92   and name HG3 ))
      3.400     1.500     1.500 peak  1762 spectrum    1 weight  0.10000E+01 volume  0.40954E-02 ppm1      3.746 ppm2      1.499 CV     1
 OR { 1762}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 92   and name HB2 ))
 ASSI { 1763}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name HB2 ))
      2.900     1.100     1.100 peak  1763 spectrum    1 weight  0.10000E+01 volume  0.38437E-02 ppm1      3.744 ppm2      1.778 CV     1
 ASSI { 1766}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 89   and name HB3 ))
      2.400     0.700     0.700 peak  1766 spectrum    1 weight  0.10000E+01 volume  0.35102E-02 ppm1      3.750 ppm2      2.188 CV     1
 ASSI { 1767}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 89   and name HB2 ))
      3.000     1.100     1.100 peak  1767 spectrum    1 weight  0.10000E+01 volume  0.32923E-02 ppm1      3.746 ppm2      2.036 CV     1
 ASSI { 1771}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 88   and name HD% )
      3.300     1.400     1.400 peak  1771 spectrum    1 weight  0.10000E+01 volume  0.12864E-02 ppm1      3.939 ppm2      7.036 CV     1
 ASSI { 1778}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 88   and name HB3 ))
      3.500     1.500     1.500 peak  1778 spectrum    1 weight  0.10000E+01 volume  0.43361E-03 ppm1      7.044 ppm2      3.186 CV     1
 ASSI { 1779}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 88   and name HB2 ))
      3.100     1.200     1.200 peak  1779 spectrum    1 weight  0.10000E+01 volume  0.65745E-03 ppm1      7.041 ppm2      2.966 CV     1
 ASSI { 1781}
   (  segid "    " and resid 88   and name HD% )
   (  segid "    " and resid 123  and name HD2%)
      3.300     1.400     1.400 peak  1781 spectrum    1 weight  0.10000E+01 volume  0.10419E-02 ppm1      7.039 ppm2      0.631 CV     1
 OR { 1781}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 123  and name HB3 ))
 ASSI { 1787}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 123  and name HB3 ))
      3.300     1.400     1.400 peak  1787 spectrum    1 weight  0.10000E+01 volume  0.58461E-03 ppm1      7.205 ppm2      0.651 CV     1
 OR { 1787}
   (  segid "    " and resid 88   and name HE% )
   (  segid "    " and resid 123  and name HD2%)
 ASSI { 1798}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 89   and name H   ))
      3.800     1.800     1.800 peak  1798 spectrum    1 weight  0.10000E+01 volume  0.48306E-03 ppm1      3.942 ppm2      8.195 CV     1
 ASSI { 1799}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HB2 ))
      2.900     1.100     1.100 peak  1799 spectrum    1 weight  0.10000E+01 volume  0.77386E-03 ppm1      3.941 ppm2      2.964 CV     1
 ASSI { 1800}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HB3 ))
      3.600     1.600     1.600 peak  1800 spectrum    1 weight  0.10000E+01 volume  0.85818E-03 ppm1      3.939 ppm2      3.192 CV     1
 ASSI { 1804}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 118  and name HD1%)
      4.800     2.800     1.200 peak  1804 spectrum    1 weight  0.10000E+01 volume  0.49953E-03 ppm1      3.935 ppm2      0.517 CV     1
 ASSI { 1805}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 20   and name H   ))
      3.700     1.700     1.700 peak  1805 spectrum    1 weight  0.10000E+01 volume  0.75324E-03 ppm1      2.051 ppm2      8.670 CV     1
 ASSI { 1807}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 19   and name HG3 ))
      3.100     1.200     1.200 peak  1807 spectrum    1 weight  0.10000E+01 volume  0.10526E-02 ppm1      3.959 ppm2      2.344 CV     1
 ASSI { 1808}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HB3 ))
      2.300     0.700     0.700 peak  1808 spectrum    1 weight  0.10000E+01 volume  0.85333E-03 ppm1      1.143 ppm2      2.057 CV     1
 ASSI { 1809}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HG  ))
      3.700     1.700     1.700 peak  1809 spectrum    1 weight  0.10000E+01 volume  0.24616E-03 ppm1      1.146 ppm2      1.697 CV     1
 ASSI { 1810}
   (( segid "    " and resid 20   and name HB2 ))
   (  segid "    " and resid 20   and name HD2%)
      2.900     1.000     1.000 peak  1810 spectrum    1 weight  0.10000E+01 volume  0.18948E-02 ppm1      1.148 ppm2      0.645 CV     1
 OR { 1810}
   (( segid "    " and resid 20   and name HB2 ))
   (  segid "    " and resid 20   and name HD1%)
 ASSI { 1811}
   (( segid "    " and resid 20   and name HB2 ))
   (  segid "    " and resid 36   and name HG2%)
      3.700     1.700     1.700 peak  1811 spectrum    1 weight  0.10000E+01 volume  0.97505E-03 ppm1      1.153 ppm2      1.015 CV     1
 OR { 1811}
   (( segid "    " and resid 20   and name HB2 ))
   (  segid "    " and resid 36   and name HD1%)
 ASSI { 1812}
   (( segid "    " and resid 20   and name HB3 ))
   (  segid "    " and resid 20   and name HD1%)
      3.100     1.200     1.200 peak  1812 spectrum    1 weight  0.10000E+01 volume  0.16394E-02 ppm1      2.056 ppm2      0.629 CV     1
 OR { 1812}
   (( segid "    " and resid 20   and name HB3 ))
   (  segid "    " and resid 20   and name HD2%)
 ASSI { 1816}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 21   and name H   ))
      4.500     2.500     1.500 peak  1816 spectrum    1 weight  0.10000E+01 volume  0.24459E-03 ppm1      1.151 ppm2      8.930 CV     1
 ASSI { 1818}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 21   and name H   ))
      3.800     1.800     1.800 peak  1818 spectrum    1 weight  0.10000E+01 volume  0.54919E-03 ppm1      3.965 ppm2      8.933 CV     1
 ASSI { 1819}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name H   ))
      2.900     1.000     1.000 peak  1819 spectrum    1 weight  0.10000E+01 volume  0.18714E-02 ppm1      3.961 ppm2      8.655 CV     1
 ASSI { 1822}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 24   and name HD22))
      2.900     1.000     1.000 peak  1822 spectrum    1 weight  0.10000E+01 volume  0.35222E-02 ppm1      0.668 ppm2      7.483 CV     1
 ASSI { 1823}
   (  segid "    " and resid 20   and name HD1%)
   (  segid "    " and resid 21   and name HD% )
      5.400     3.600     0.600 peak  1823 spectrum    1 weight  0.10000E+01 volume  0.35630E-03 ppm1      0.664 ppm2      6.898 CV     1
 ASSI { 1826}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 39   and name HB3 ))
      3.300     1.400     1.400 peak  1826 spectrum    1 weight  0.10000E+01 volume  0.25073E-02 ppm1      0.668 ppm2      2.866 CV     1
 ASSI { 1828}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 20   and name HG  ))
      2.100     0.500     0.500 peak  1828 spectrum    1 weight  0.10000E+01 volume  0.87368E-02 ppm1      0.668 ppm2      1.690 CV     1
 ASSI { 1830}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 130  and name HD2%)
      2.400     0.700     0.700 peak  1830 spectrum    1 weight  0.10000E+01 volume  0.13546E-01 ppm1      0.675 ppm2      0.898 CV     1
 ASSI { 1831}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 20   and name HB2 ))
      3.000     1.100     1.100 peak  1831 spectrum    1 weight  0.10000E+01 volume  0.52149E-02 ppm1      0.669 ppm2      1.146 CV     1
 ASSI { 1832}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 24   and name HB2 ))
      3.700     1.700     1.700 peak  1832 spectrum    1 weight  0.10000E+01 volume  0.11972E-02 ppm1      0.668 ppm2      2.472 CV     1
 ASSI { 1834}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 36   and name HG12))
      3.400     1.400     1.400 peak  1834 spectrum    1 weight  0.10000E+01 volume  0.22252E-02 ppm1      0.669 ppm2      2.247 CV     1
 ASSI { 1835}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 36   and name HA  ))
      3.200     1.300     1.300 peak  1835 spectrum    1 weight  0.10000E+01 volume  0.21726E-02 ppm1      0.668 ppm2      3.660 CV     1
 ASSI { 1836}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 24   and name H   ))
      3.800     1.800     1.800 peak  1836 spectrum    1 weight  0.10000E+01 volume  0.13962E-02 ppm1      0.667 ppm2      7.293 CV     1
 ASSI { 1838}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 24   and name HD21))
      2.600     0.900     0.900 peak  1838 spectrum    1 weight  0.10000E+01 volume  0.26962E-02 ppm1      0.668 ppm2      8.105 CV     1
 ASSI { 1847}
   (( segid "    " and resid 127  and name HD2 ))
   (( segid "    " and resid 116  and name H   ))
      4.500     2.500     1.500 peak  1847 spectrum    1 weight  0.10000E+01 volume  0.32717E-03 ppm1      3.253 ppm2      8.125 CV     1
 OR { 1847}
   (( segid "    " and resid 127  and name HD3 ))
   (( segid "    " and resid 116  and name H   ))
 ASSI { 1848}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 87   and name H   ))
      4.500     2.500     1.500 peak  1848 spectrum    1 weight  0.10000E+01 volume  0.93432E-03 ppm1      1.802 ppm2      8.669 CV     1
 ASSI { 1850}
   (( segid "    " and resid 98   and name HG  ))
   (( segid "    " and resid 111  and name HE  ))
      4.500     2.600     1.500 peak  1850 spectrum    1 weight  0.10000E+01 volume  0.59501E-03 ppm1      1.666 ppm2      7.406 CV     1
 ASSI { 1854}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 30   and name H   ))
      5.100     3.300     0.900 peak  1854 spectrum    1 weight  0.10000E+01 volume  0.55112E-03 ppm1      1.992 ppm2      7.491 CV     1
 OR { 1854}
   (( segid "    " and resid 28   and name HB3 ))
   (( segid "    " and resid 30   and name H   ))
 ASSI { 1858}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 87   and name H   ))
      3.700     1.700     1.700 peak  1858 spectrum    1 weight  0.10000E+01 volume  0.61602E-03 ppm1      4.133 ppm2      8.690 CV     1
 ASSI { 1859}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HG2 ))
      2.900     1.000     1.000 peak  1859 spectrum    1 weight  0.10000E+01 volume  0.34494E-02 ppm1      4.139 ppm2      2.451 CV     1
 ASSI { 1860}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HG3 ))
      2.700     0.900     0.900 peak  1860 spectrum    1 weight  0.10000E+01 volume  0.47159E-02 ppm1      4.139 ppm2      2.300 CV     1
 ASSI { 1861}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HB2 ))
      2.600     0.800     0.800 peak  1861 spectrum    1 weight  0.10000E+01 volume  0.46765E-02 ppm1      4.139 ppm2      2.130 CV     1
 ASSI { 1862}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HB3 ))
      2.600     0.800     0.800 peak  1862 spectrum    1 weight  0.10000E+01 volume  0.69506E-02 ppm1      4.139 ppm2      1.984 CV     1
 ASSI { 1863}
   (( segid "    " and resid 12   and name HA  ))
   (  segid "    " and resid 15   and name HB% )
      2.600     0.800     0.800 peak  1863 spectrum    1 weight  0.10000E+01 volume  0.51546E-02 ppm1      4.140 ppm2      1.576 CV     1
 ASSI { 1866}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HD2 ))
      4.400     2.400     1.600 peak  1866 spectrum    1 weight  0.10000E+01 volume  0.10864E-02 ppm1      4.135 ppm2      3.228 CV     1
 OR { 1866}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HD3 ))
 ASSI { 1870}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 86   and name HA  ))
      2.600     0.800     0.800 peak  1870 spectrum    1 weight  0.10000E+01 volume  0.28944E-02 ppm1      1.804 ppm2      4.134 CV     1
 ASSI { 1871}
   (( segid "    " and resid 82   and name HG  ))
   (( segid "    " and resid 82   and name HA  ))
      3.500     1.500     1.500 peak  1871 spectrum    1 weight  0.10000E+01 volume  0.27211E-02 ppm1      1.808 ppm2      4.210 CV     1
 ASSI { 1872}
   (( segid "    " and resid 86   and name HG3 ))
   (( segid "    " and resid 86   and name HA  ))
      2.900     1.100     1.100 peak  1872 spectrum    1 weight  0.10000E+01 volume  0.33223E-02 ppm1      1.662 ppm2      4.126 CV     1
 ASSI { 1874}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 86   and name HB2 ))
      2.200     0.600     0.600 peak  1874 spectrum    1 weight  0.10000E+01 volume  0.93902E-02 ppm1      1.802 ppm2      2.010 CV     1
 OR { 1874}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 86   and name HB3 ))
 ASSI { 1876}
   (( segid "    " and resid 86   and name HG3 ))
   (( segid "    " and resid 86   and name HB3 ))
      2.100     0.500     0.500 peak  1876 spectrum    1 weight  0.10000E+01 volume  0.13039E-01 ppm1      1.661 ppm2      2.013 CV     1
 OR { 1876}
   (( segid "    " and resid 86   and name HG3 ))
   (( segid "    " and resid 86   and name HB2 ))
 ASSI { 1877}
   (( segid "    " and resid 82   and name HG  ))
   (  segid "    " and resid 82   and name HD1%)
      1.900     0.500     0.500 peak  1877 spectrum    1 weight  0.10000E+01 volume  0.19078E-01 ppm1      1.807 ppm2      0.962 CV     1
 OR { 1877}
   (( segid "    " and resid 82   and name HG  ))
   (  segid "    " and resid 82   and name HD2%)
 ASSI { 1881}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 86   and name H   ))
      3.800     1.800     1.800 peak  1881 spectrum    1 weight  0.10000E+01 volume  0.74752E-03 ppm1      2.486 ppm2      8.369 CV     1
 ASSI { 1882}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 86   and name H   ))
      4.100     2.100     1.900 peak  1882 spectrum    1 weight  0.10000E+01 volume  0.70063E-03 ppm1      2.310 ppm2      8.369 CV     1
 ASSI { 1883}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 85   and name H   ))
      3.900     1.900     1.900 peak  1883 spectrum    1 weight  0.10000E+01 volume  0.19824E-02 ppm1      2.490 ppm2      8.130 CV     1
 ASSI { 1884}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 85   and name H   ))
      3.800     1.800     1.800 peak  1884 spectrum    1 weight  0.10000E+01 volume  0.18101E-02 ppm1      2.310 ppm2      8.130 CV     1
 ASSI { 1885}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 85   and name HE21))
      3.000     1.200     1.200 peak  1885 spectrum    1 weight  0.10000E+01 volume  0.56466E-03 ppm1      2.223 ppm2      6.841 CV     1
 OR { 1885}
   (( segid "    " and resid 85   and name HB3 ))
   (( segid "    " and resid 85   and name HE21))
 ASSI { 1886}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 85   and name HE22))
      4.700     2.800     1.300 peak  1886 spectrum    1 weight  0.10000E+01 volume  0.62101E-03 ppm1      2.256 ppm2      7.228 CV     1
 OR { 1886}
   (( segid "    " and resid 85   and name HB3 ))
   (( segid "    " and resid 85   and name HE22))
 ASSI { 1891}
   (( segid "    " and resid 85   and name HB3 ))
   (( segid "    " and resid 86   and name H   ))
      2.800     1.000     1.000 peak  1891 spectrum    1 weight  0.10000E+01 volume  0.13667E-02 ppm1      2.249 ppm2      8.367 CV     1
 OR { 1891}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 86   and name H   ))
 ASSI { 1892}
   (( segid "    " and resid 85   and name HB3 ))
   (( segid "    " and resid 87   and name H   ))
      4.500     2.600     1.500 peak  1892 spectrum    1 weight  0.10000E+01 volume  0.38218E-03 ppm1      2.253 ppm2      8.668 CV     1
 OR { 1892}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 87   and name H   ))
 ASSI { 1895}
   (( segid "    " and resid 85   and name HG2 ))
   (  segid "    " and resid 88   and name HD% )
      5.700     4.000     0.300 peak  1895 spectrum    1 weight  0.10000E+01 volume  0.31687E-03 ppm1      2.491 ppm2      7.043 CV     1
 ASSI { 1896}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 85   and name HE21))
      3.200     1.300     1.300 peak  1896 spectrum    1 weight  0.10000E+01 volume  0.12577E-02 ppm1      2.310 ppm2      6.840 CV     1
 ASSI { 1900}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HG2 ))
      2.300     0.700     0.700 peak  1900 spectrum    1 weight  0.10000E+01 volume  0.65557E-02 ppm1      3.820 ppm2      2.223 CV     1
 ASSI { 1905}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 85   and name H   ))
      2.700     0.900     0.900 peak  1905 spectrum    1 weight  0.10000E+01 volume  0.25857E-02 ppm1      3.845 ppm2      8.133 CV     1
 ASSI { 1906}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 88   and name H   ))
      3.700     1.700     1.700 peak  1906 spectrum    1 weight  0.10000E+01 volume  0.51760E-03 ppm1      3.842 ppm2      8.903 CV     1
 ASSI { 1908}
   (( segid "    " and resid 85   and name HG2 ))
   (  segid "    " and resid 123  and name HD1%)
      3.800     1.800     1.800 peak  1908 spectrum    1 weight  0.10000E+01 volume  0.26719E-02 ppm1      2.490 ppm2      0.798 CV     1
 ASSI { 1909}
   (( segid "    " and resid 85   and name HG2 ))
   (  segid "    " and resid 123  and name HD2%)
      3.400     1.400     1.400 peak  1909 spectrum    1 weight  0.10000E+01 volume  0.35940E-02 ppm1      2.489 ppm2      0.624 CV     1
 OR { 1909}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 123  and name HB3 ))
 ASSI { 1910}
   (( segid "    " and resid 85   and name HG3 ))
   (  segid "    " and resid 82   and name HD2%)
      4.100     2.100     1.900 peak  1910 spectrum    1 weight  0.10000E+01 volume  0.16738E-02 ppm1      2.306 ppm2      0.953 CV     1
 OR { 1910}
   (( segid "    " and resid 85   and name HG3 ))
   (  segid "    " and resid 82   and name HD1%)
 ASSI { 1911}
   (( segid "    " and resid 85   and name HG3 ))
   (  segid "    " and resid 123  and name HD1%)
      2.300     0.700     0.700 peak  1911 spectrum    1 weight  0.10000E+01 volume  0.23624E-02 ppm1      2.309 ppm2      0.800 CV     1
 ASSI { 1912}
   (( segid "    " and resid 85   and name HG3 ))
   (  segid "    " and resid 123  and name HD2%)
      2.700     0.900     0.900 peak  1912 spectrum    1 weight  0.10000E+01 volume  0.33209E-02 ppm1      2.309 ppm2      0.626 CV     1
 OR { 1912}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 123  and name HB3 ))
 ASSI { 1917}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 118  and name HG  ))
      4.600     2.600     1.400 peak  1917 spectrum    1 weight  0.10000E+01 volume  0.11888E-02 ppm1      2.314 ppm2      1.899 CV     1
 ASSI { 1921}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 123  and name HG  ))
      4.500     2.500     1.500 peak  1921 spectrum    1 weight  0.10000E+01 volume  0.44606E-03 ppm1      2.314 ppm2      1.344 CV     1
 ASSI { 1922}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 85   and name HG3 ))
      1.600     0.300     0.600 peak  1922 spectrum    1 weight  0.10000E+01 volume  0.15853E-01 ppm1      2.489 ppm2      2.304 CV     1
 OR { 1922}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 85   and name HB2 ))
 ASSI { 1923}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 85   and name HG2 ))
      1.600     0.300     0.600 peak  1923 spectrum    1 weight  0.10000E+01 volume  0.13353E-01 ppm1      2.310 ppm2      2.487 CV     1
 ASSI { 1925}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 88   and name HB3 ))
      4.100     2.100     1.900 peak  1925 spectrum    1 weight  0.10000E+01 volume  0.43983E-03 ppm1      2.308 ppm2      3.199 CV     1
 ASSI { 1926}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 82   and name HA  ))
      4.200     2.200     1.800 peak  1926 spectrum    1 weight  0.10000E+01 volume  0.91473E-03 ppm1      2.490 ppm2      4.216 CV     1
 ASSI { 1927}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 85   and name HA  ))
      3.600     1.600     1.600 peak  1927 spectrum    1 weight  0.10000E+01 volume  0.20412E-02 ppm1      2.489 ppm2      3.847 CV     1
 ASSI { 1928}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 82   and name HA  ))
      4.600     2.600     1.400 peak  1928 spectrum    1 weight  0.10000E+01 volume  0.78615E-03 ppm1      2.311 ppm2      4.206 CV     1
 ASSI { 1930}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 85   and name HA  ))
      2.600     0.800     0.800 peak  1930 spectrum    1 weight  0.10000E+01 volume  0.18902E-02 ppm1      2.309 ppm2      3.845 CV     1
 ASSI { 1931}
   (( segid "    " and resid 85   and name HB3 ))
   (( segid "    " and resid 82   and name HA  ))
      3.100     1.200     1.200 peak  1931 spectrum    1 weight  0.10000E+01 volume  0.13467E-02 ppm1      2.237 ppm2      4.216 CV     1
 OR { 1931}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 82   and name HA  ))
 ASSI { 1932}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 85   and name HA  ))
      2.700     0.900     0.900 peak  1932 spectrum    1 weight  0.10000E+01 volume  0.23311E-02 ppm1      2.230 ppm2      3.844 CV     1
 OR { 1932}
   (( segid "    " and resid 85   and name HB3 ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI { 1933}
   (( segid "    " and resid 36   and name HG12))
   (( segid "    " and resid 36   and name HA  ))
      3.300     1.400     1.400 peak  1933 spectrum    1 weight  0.10000E+01 volume  0.57334E-03 ppm1      2.256 ppm2      3.636 CV     1
 ASSI { 1934}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HB3 ))
      2.300     0.700     0.700 peak  1934 spectrum    1 weight  0.10000E+01 volume  0.23870E-02 ppm1      2.206 ppm2      2.890 CV     1
 ASSI { 1936}
   (( segid "    " and resid 85   and name HB3 ))
   (( segid "    " and resid 82   and name HB3 ))
      3.800     1.800     1.800 peak  1936 spectrum    1 weight  0.10000E+01 volume  0.23147E-02 ppm1      2.225 ppm2      1.719 CV     1
 OR { 1936}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 82   and name HB3 ))
 ASSI { 1937}
   (( segid "    " and resid 36   and name HG12))
   (  segid "    " and resid 36   and name HD1%)
      2.200     0.600     0.600 peak  1937 spectrum    1 weight  0.10000E+01 volume  0.41599E-02 ppm1      2.256 ppm2      1.001 CV     1
 OR { 1937}
   (( segid "    " and resid 36   and name HG12))
   (  segid "    " and resid 36   and name HG2%)
 ASSI { 1941}
   (  segid "    " and resid 84   and name HD1%)
   (  segid "    " and resid 84   and name HD2%)
      2.300     0.600     0.600 peak  1941 spectrum    1 weight  0.10000E+01 volume  0.11581E-01 ppm1      1.087 ppm2      0.607 CV     1
 ASSI { 1944}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 9    and name HZ2 ))
      3.300     1.400     1.400 peak  1944 spectrum    1 weight  0.10000E+01 volume  0.17254E-02 ppm1      1.072 ppm2      6.902 CV     1
 ASSI { 1950}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 118  and name HB3 ))
      2.500     0.800     0.800 peak  1950 spectrum    1 weight  0.10000E+01 volume  0.73805E-03 ppm1      2.042 ppm2      1.571 CV     1
 ASSI { 1951}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 84   and name HG  ))
      3.400     1.500     1.500 peak  1951 spectrum    1 weight  0.10000E+01 volume  0.56239E-03 ppm1      2.049 ppm2      1.482 CV     1
 ASSI { 1953}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 84   and name HB3 ))
      2.400     0.700     0.700 peak  1953 spectrum    1 weight  0.10000E+01 volume  0.12352E-02 ppm1      1.814 ppm2      2.039 CV     1
 ASSI { 1965}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 56   and name HB3 ))
      3.400     1.400     1.400 peak  1965 spectrum    1 weight  0.10000E+01 volume  0.52486E-02 ppm1      4.018 ppm2      1.853 CV     1
 ASSI { 1968}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HB3 ))
      2.700     0.900     0.900 peak  1968 spectrum    1 weight  0.10000E+01 volume  0.18203E-02 ppm1      4.017 ppm2      2.897 CV     1
 ASSI { 1973}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 21   and name H   ))
      4.400     2.400     1.600 peak  1973 spectrum    1 weight  0.10000E+01 volume  0.30845E-03 ppm1      4.018 ppm2      8.941 CV     1
 ASSI { 1974}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 14   and name HA  ))
      3.100     1.200     1.200 peak  1974 spectrum    1 weight  0.10000E+01 volume  0.17536E-02 ppm1      2.375 ppm2      4.001 CV     1
 ASSI { 1975}
   (( segid "    " and resid 14   and name HB2 ))
   (  segid "    " and resid 15   and name HB% )
      4.200     2.200     1.800 peak  1975 spectrum    1 weight  0.10000E+01 volume  0.91085E-03 ppm1      2.388 ppm2      1.578 CV     1
 ASSI { 1977}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 13   and name HA  ))
      3.200     1.200     1.200 peak  1977 spectrum    1 weight  0.10000E+01 volume  0.12754E-02 ppm1      2.392 ppm2      4.250 CV     1
 OR { 1977}
   (( segid "    " and resid 13   and name HB3 ))
   (( segid "    " and resid 13   and name HA  ))
 ASSI { 1978}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 84   and name HA  ))
      4.000     2.000     2.000 peak  1978 spectrum    1 weight  0.10000E+01 volume  0.80326E-03 ppm1      2.394 ppm2      4.141 CV     1
 ASSI { 1979}
   (( segid "    " and resid 13   and name HB3 ))
   (( segid "    " and resid 9    and name HE3 ))
      2.900     1.100     1.100 peak  1979 spectrum    1 weight  0.10000E+01 volume  0.85390E-03 ppm1      2.400 ppm2      7.074 CV     1
 OR { 1979}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 9    and name HE3 ))
 ASSI { 1982}
   (( segid "    " and resid 12   and name HG2 ))
   (  segid "    " and resid 15   and name HB% )
      3.500     1.500     1.500 peak  1982 spectrum    1 weight  0.10000E+01 volume  0.22317E-02 ppm1      2.447 ppm2      1.574 CV     1
 ASSI { 1986}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 12   and name HG3 ))
      1.500     0.300     0.700 peak  1986 spectrum    1 weight  0.10000E+01 volume  0.48566E-01 ppm1      2.449 ppm2      2.299 CV     1
 ASSI { 1989}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 20   and name H   ))
      3.900     1.900     1.900 peak  1989 spectrum    1 weight  0.10000E+01 volume  0.12872E-02 ppm1      2.467 ppm2      8.668 CV     1
 ASSI { 1991}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 12   and name H   ))
      4.000     2.000     2.000 peak  1991 spectrum    1 weight  0.10000E+01 volume  0.13357E-02 ppm1      2.452 ppm2      8.967 CV     1
 ASSI { 1997}
   (( segid "    " and resid 37   and name HG  ))
   (  segid "    " and resid 66   and name HD% )
      5.000     3.100     1.000 peak  1997 spectrum    1 weight  0.10000E+01 volume  0.58780E-03 ppm1      1.693 ppm2      7.295 CV     1
 ASSI { 2001}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 85   and name HE22))
      4.600     2.600     1.400 peak  2001 spectrum    1 weight  0.10000E+01 volume  0.12734E-02 ppm1      0.974 ppm2      7.235 CV     1
 ASSI { 2002}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 88   and name H   ))
      4.000     2.000     2.000 peak  2002 spectrum    1 weight  0.10000E+01 volume  0.39516E-03 ppm1      0.931 ppm2      8.869 CV     1
 ASSI { 2003}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 79   and name HA  ))
      4.300     2.300     1.700 peak  2003 spectrum    1 weight  0.10000E+01 volume  0.12859E-02 ppm1      0.939 ppm2      4.508 CV     1
 ASSI { 2009}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HB3 ))
      1.900     0.400     0.400 peak  2009 spectrum    1 weight  0.10000E+01 volume  0.67111E-02 ppm1      1.917 ppm2      1.697 CV     1
 ASSI { 2012}
   (( segid "    " and resid 54   and name HB3 ))
   (  segid "    " and resid 54   and name HD1%)
      2.700     0.900     0.900 peak  2012 spectrum    1 weight  0.10000E+01 volume  0.21733E-02 ppm1      1.934 ppm2      0.418 CV     1
 OR { 2012}
   (( segid "    " and resid 54   and name HB3 ))
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 2015}
   (( segid "    " and resid 82   and name HB3 ))
   (( segid "    " and resid 79   and name HA  ))
      3.600     1.600     1.600 peak  2015 spectrum    1 weight  0.10000E+01 volume  0.44537E-03 ppm1      1.688 ppm2      4.532 CV     1
 ASSI { 2016}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HA  ))
      2.800     0.900     0.900 peak  2016 spectrum    1 weight  0.10000E+01 volume  0.17388E-02 ppm1      1.918 ppm2      4.220 CV     1
 ASSI { 2017}
   (( segid "    " and resid 54   and name HB3 ))
   (( segid "    " and resid 55   and name H   ))
      3.900     1.900     1.900 peak  2017 spectrum    1 weight  0.10000E+01 volume  0.52050E-03 ppm1      1.917 ppm2      7.496 CV     1
 ASSI { 2025}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 82   and name HB2 ))
      3.900     1.900     1.900 peak  2025 spectrum    1 weight  0.10000E+01 volume  0.11842E-02 ppm1      4.538 ppm2      1.923 CV     1
 ASSI { 2028}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HB2 ))
      3.600     1.600     1.600 peak  2028 spectrum    1 weight  0.10000E+01 volume  0.12835E-02 ppm1      4.543 ppm2      2.584 CV     1
 ASSI { 2030}
   (( segid "    " and resid 79   and name HB3 ))
   (( segid "    " and resid 79   and name HA  ))
      3.100     1.200     1.200 peak  2030 spectrum    1 weight  0.10000E+01 volume  0.14604E-02 ppm1      2.715 ppm2      4.549 CV     1
 ASSI { 2036}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 76   and name HH2 ))
      3.100     1.200     1.200 peak  2036 spectrum    1 weight  0.10000E+01 volume  0.90961E-03 ppm1      7.105 ppm2      6.888 CV     1
 ASSI { 2037}
   (  segid "    " and resid 21   and name HD% )
   (  segid "    " and resid 66   and name HE% )
      3.900     1.900     1.900 peak  2037 spectrum    1 weight  0.10000E+01 volume  0.93109E-03 ppm1      6.910 ppm2      7.093 CV     1
 ASSI { 2038}
   (( segid "    " and resid 76   and name HH2 ))
   (( segid "    " and resid 76   and name HZ3 ))
      3.000     1.200     1.200 peak  2038 spectrum    1 weight  0.10000E+01 volume  0.10021E-02 ppm1      6.893 ppm2      7.086 CV     1
 OR { 2038}
   (( segid "    " and resid 76   and name HH2 ))
   (( segid "    " and resid 76   and name HZ2 ))
 ASSI { 2039}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 76   and name HZ2 ))
      5.100     3.200     0.900 peak  2039 spectrum    1 weight  0.10000E+01 volume  0.35692E-03 ppm1      7.349 ppm2      7.099 CV     1
 ASSI { 2042}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 76   and name HE3 ))
      6.000     4.500     0.000 peak  2042 spectrum    1 weight  0.10000E+01 volume  0.10285E-03 ppm1      7.102 ppm2      7.366 CV     1
 OR { 2042}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 76   and name HD1 ))
 ASSI { 2043}
   (( segid "    " and resid 76   and name HH2 ))
   (( segid "    " and resid 76   and name HE3 ))
      5.400     3.700     0.600 peak  2043 spectrum    1 weight  0.10000E+01 volume  0.16943E-03 ppm1      6.898 ppm2      7.374 CV     1
 ASSI { 2050}
   (( segid "    " and resid 76   and name HD1 ))
   (  segid "    " and resid 74   and name HG1%)
      3.200     1.300     1.300 peak  2050 spectrum    1 weight  0.10000E+01 volume  0.16153E-02 ppm1      7.357 ppm2      0.893 CV     1
 OR { 2050}
   (( segid "    " and resid 76   and name HD1 ))
   (  segid "    " and resid 74   and name HG2%)
 ASSI { 2059}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 56   and name HG3 ))
      4.100     2.100     1.900 peak  2059 spectrum    1 weight  0.10000E+01 volume  0.40143E-03 ppm1      3.158 ppm2      2.146 CV     1
 ASSI { 2062}
   (( segid "    " and resid 72   and name HB2 ))
   (  segid "    " and resid 120  and name HB% )
      5.500     3.800     0.500 peak  2062 spectrum    1 weight  0.10000E+01 volume  0.36673E-03 ppm1      3.060 ppm2      1.471 CV     1
 ASSI { 2069}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 76   and name HB3 ))
      4.400     2.500     1.600 peak  2069 spectrum    1 weight  0.10000E+01 volume  0.29204E-03 ppm1      7.358 ppm2      3.095 CV     1
 OR { 2069}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 76   and name HB2 ))
 ASSI { 2072}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 109  and name HG2 ))
      4.300     2.400     1.700 peak  2072 spectrum    1 weight  0.10000E+01 volume  0.42714E-03 ppm1      7.102 ppm2      1.340 CV     1
 ASSI { 2073}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 114  and name HG12))
      4.000     2.000     2.000 peak  2073 spectrum    1 weight  0.10000E+01 volume  0.44698E-03 ppm1      7.107 ppm2      1.205 CV     1
 ASSI { 2074}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 114  and name HG13))
      4.400     2.500     1.600 peak  2074 spectrum    1 weight  0.10000E+01 volume  0.35178E-03 ppm1      7.104 ppm2      1.840 CV     1
 ASSI { 2075}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 84   and name HB3 ))
      4.900     3.000     1.100 peak  2075 spectrum    1 weight  0.10000E+01 volume  0.28013E-03 ppm1      7.114 ppm2      2.082 CV     1
 ASSI { 2079}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 80   and name HB2 ))
      6.000     5.000     0.000 peak  2079 spectrum    1 weight  0.10000E+01 volume  0.14689E-03 ppm1      3.145 ppm2      2.425 CV     1
 ASSI { 2080}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 80   and name HB3 ))
      4.500     2.500     1.500 peak  2080 spectrum    1 weight  0.10000E+01 volume  0.23345E-03 ppm1      3.150 ppm2      2.584 CV     1
 ASSI { 2081}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 114  and name HA  ))
      4.600     2.600     1.400 peak  2081 spectrum    1 weight  0.10000E+01 volume  0.51010E-03 ppm1      7.110 ppm2      3.869 CV     1
 ASSI { 2083}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 75   and name HA  ))
      4.700     2.700     1.300 peak  2083 spectrum    1 weight  0.10000E+01 volume  0.36336E-03 ppm1      7.358 ppm2      4.461 CV     1
 ASSI { 2085}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 71   and name HA  ))
      5.400     3.700     0.600 peak  2085 spectrum    1 weight  0.10000E+01 volume  0.30884E-03 ppm1      3.152 ppm2      4.321 CV     1
 ASSI { 2093}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 76   and name HE3 ))
      4.500     2.500     1.500 peak  2093 spectrum    1 weight  0.10000E+01 volume  0.20737E-03 ppm1      3.060 ppm2      7.360 CV     1
 OR { 2093}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 76   and name HD1 ))
 ASSI { 2100}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 76   and name HD1 ))
      3.600     1.600     1.600 peak  2100 spectrum    1 weight  0.10000E+01 volume  0.70998E-03 ppm1      4.936 ppm2      7.377 CV     1
 ASSI { 2101}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 11   and name HD2 ))
      3.200     1.300     1.300 peak  2101 spectrum    1 weight  0.10000E+01 volume  0.10230E-02 ppm1      4.940 ppm2      3.988 CV     1
 OR { 2101}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 11   and name HD3 ))
 ASSI { 2104}
   (( segid "    " and resid 75   and name HB3 ))
   (( segid "    " and resid 76   and name H   ))
      4.300     2.300     1.700 peak  2104 spectrum    1 weight  0.10000E+01 volume  0.98333E-03 ppm1      1.675 ppm2      8.655 CV     1
 ASSI { 2105}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 76   and name H   ))
      4.300     2.300     1.700 peak  2105 spectrum    1 weight  0.10000E+01 volume  0.10788E-02 ppm1      1.563 ppm2      8.654 CV     1
 ASSI { 2107}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name H   ))
      3.100     1.200     1.200 peak  2107 spectrum    1 weight  0.10000E+01 volume  0.13167E-02 ppm1      1.565 ppm2      8.387 CV     1
 ASSI { 2110}
   (( segid "    " and resid 138  and name HB3 ))
   (( segid "    " and resid 136  and name HE3 ))
      3.000     1.100     1.100 peak  2110 spectrum    1 weight  0.10000E+01 volume  0.20541E-02 ppm1      1.594 ppm2      2.971 CV     1
 OR { 2110}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 136  and name HE2 ))
 OR { 2110}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 136  and name HE3 ))
 ASSI { 2111}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 74   and name HA  ))
      4.300     2.300     1.700 peak  2111 spectrum    1 weight  0.10000E+01 volume  0.10665E-02 ppm1      1.562 ppm2      4.104 CV     1
 ASSI { 2113}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HB2 ))
      2.500     0.800     0.800 peak  2113 spectrum    1 weight  0.10000E+01 volume  0.40577E-02 ppm1      4.450 ppm2      1.909 CV     1
 OR { 2113}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HG  ))
 ASSI { 2114}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HB3 ))
      2.500     0.800     0.800 peak  2114 spectrum    1 weight  0.10000E+01 volume  0.36020E-02 ppm1      4.459 ppm2      1.661 CV     1
 OR { 2114}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HG  ))
 ASSI { 2116}
   (( segid "    " and resid 40   and name HA  ))
   (  segid "    " and resid 20   and name HD2%)
      3.100     1.200     1.200 peak  2116 spectrum    1 weight  0.10000E+01 volume  0.15480E-02 ppm1      4.450 ppm2      0.603 CV     1
 ASSI { 2121}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 74   and name H   ))
      2.200     0.600     0.600 peak  2121 spectrum    1 weight  0.10000E+01 volume  0.47313E-02 ppm1      0.873 ppm2      8.390 CV     1
 ASSI { 2123}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 117  and name HD3 ))
      3.900     1.900     1.900 peak  2123 spectrum    1 weight  0.10000E+01 volume  0.21548E-02 ppm1      0.873 ppm2      0.529 CV     1
 ASSI { 2125}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 109  and name HD3 ))
      2.900     1.100     1.100 peak  2125 spectrum    1 weight  0.10000E+01 volume  0.14850E-02 ppm1      0.879 ppm2      2.427 CV     1
 ASSI { 2127}
   (  segid "    " and resid 27   and name HG2%)
   (( segid "    " and resid 30   and name HB3 ))
      2.400     0.700     0.700 peak  2127 spectrum    1 weight  0.10000E+01 volume  0.66159E-02 ppm1      0.886 ppm2      1.857 CV     1
 ASSI { 2128}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 75   and name HG  ))
      3.800     1.800     1.800 peak  2128 spectrum    1 weight  0.10000E+01 volume  0.22985E-02 ppm1      0.872 ppm2      1.657 CV     1
 OR { 2128}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 75   and name HB3 ))
 ASSI { 2132}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 113  and name HD2 ))
      3.200     1.300     1.300 peak  2132 spectrum    1 weight  0.10000E+01 volume  0.16271E-02 ppm1      0.873 ppm2      3.385 CV     1
 OR { 2132}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 113  and name HD3 ))
 ASSI { 2134}
   (  segid "    " and resid 27   and name HG2%)
   (( segid "    " and resid 27   and name HA  ))
      2.500     0.800     0.800 peak  2134 spectrum    1 weight  0.10000E+01 volume  0.90272E-02 ppm1      0.887 ppm2      3.892 CV     1
 ASSI { 2136}
   (  segid "    " and resid 27   and name HG2%)
   (( segid "    " and resid 27   and name H   ))
      3.200     1.300     1.300 peak  2136 spectrum    1 weight  0.10000E+01 volume  0.41096E-02 ppm1      0.886 ppm2      7.311 CV     1
 ASSI { 2137}
   (  segid "    " and resid 27   and name HG2%)
   (( segid "    " and resid 30   and name H   ))
      3.300     1.400     1.400 peak  2137 spectrum    1 weight  0.10000E+01 volume  0.18936E-02 ppm1      0.885 ppm2      7.487 CV     1
 ASSI { 2140}
   (  segid "    " and resid 27   and name HG2%)
   (( segid "    " and resid 28   and name H   ))
      2.500     0.800     0.800 peak  2140 spectrum    1 weight  0.10000E+01 volume  0.62179E-02 ppm1      0.886 ppm2      8.628 CV     1
 ASSI { 2142}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 113  and name HD2 ))
      3.100     1.200     1.200 peak  2142 spectrum    1 weight  0.10000E+01 volume  0.19727E-02 ppm1      0.916 ppm2      3.385 CV     1
 OR { 2142}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 113  and name HD3 ))
 ASSI { 2143}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 74   and name HA  ))
      2.500     0.800     0.800 peak  2143 spectrum    1 weight  0.10000E+01 volume  0.11163E-01 ppm1      0.916 ppm2      4.103 CV     1
 ASSI { 2144}
   (( segid "    " and resid 74   and name HB  ))
   (( segid "    " and resid 74   and name HA  ))
      2.400     0.700     0.700 peak  2144 spectrum    1 weight  0.10000E+01 volume  0.42220E-02 ppm1      2.028 ppm2      4.107 CV     1
 ASSI { 2145}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 74   and name HB  ))
      1.900     0.400     0.400 peak  2145 spectrum    1 weight  0.10000E+01 volume  0.22162E-01 ppm1      0.915 ppm2      2.026 CV     1
 ASSI { 2148}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 75   and name HG  ))
      3.700     1.700     1.700 peak  2148 spectrum    1 weight  0.10000E+01 volume  0.21604E-02 ppm1      4.094 ppm2      1.579 CV     1
 OR { 2148}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 75   and name HB2 ))
 ASSI { 2149}
   (( segid "    " and resid 74   and name HA  ))
   (  segid "    " and resid 74   and name HG1%)
      2.400     0.700     0.700 peak  2149 spectrum    1 weight  0.10000E+01 volume  0.14750E-01 ppm1      4.094 ppm2      0.898 CV     1
 OR { 2149}
   (( segid "    " and resid 74   and name HA  ))
   (  segid "    " and resid 74   and name HG2%)
 ASSI { 2150}
   (( segid "    " and resid 74   and name HB  ))
   (  segid "    " and resid 74   and name HG2%)
      1.800     0.400     0.400 peak  2150 spectrum    1 weight  0.10000E+01 volume  0.24431E-01 ppm1      2.027 ppm2      0.898 CV     1
 OR { 2150}
   (( segid "    " and resid 74   and name HB  ))
   (  segid "    " and resid 74   and name HG1%)
 ASSI { 2152}
   (( segid "    " and resid 74   and name HB  ))
   (( segid "    " and resid 109  and name HD3 ))
      4.000     2.000     2.000 peak  2152 spectrum    1 weight  0.10000E+01 volume  0.65022E-03 ppm1      2.030 ppm2      2.396 CV     1
 ASSI { 2154}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 75   and name HG  ))
      3.100     1.200     1.200 peak  2154 spectrum    1 weight  0.10000E+01 volume  0.40574E-02 ppm1      0.916 ppm2      1.586 CV     1
 OR { 2154}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 75   and name HB2 ))
 ASSI { 2155}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 109  and name HG2 ))
      3.000     1.200     1.200 peak  2155 spectrum    1 weight  0.10000E+01 volume  0.39615E-02 ppm1      0.919 ppm2      1.404 CV     1
 ASSI { 2157}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 114  and name HG12))
      3.100     3.100     2.900 peak  2157 spectrum    1 weight  0.10000E+01 volume  0.45054E-02 ppm1      0.918 ppm2      1.236 CV     1
 ASSI { 2160}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 85   and name HB2 ))
      3.400     1.400     1.400 peak  2160 spectrum    1 weight  0.10000E+01 volume  0.98342E-03 ppm1      0.809 ppm2      2.259 CV     1
 OR { 2160}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 85   and name HB3 ))
 OR { 2160}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 85   and name HG3 ))
 ASSI { 2163}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 73   and name HG13))
      1.900     0.400     0.400 peak  2163 spectrum    1 weight  0.10000E+01 volume  0.19099E-01 ppm1      0.809 ppm2      1.395 CV     1
 ASSI { 2164}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 73   and name HG12))
      1.800     0.400     0.400 peak  2164 spectrum    1 weight  0.10000E+01 volume  0.22088E-01 ppm1      0.809 ppm2      1.140 CV     1
 ASSI { 2168}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 73   and name HB  ))
      1.900     0.500     0.500 peak  2168 spectrum    1 weight  0.10000E+01 volume  0.17955E-01 ppm1      0.830 ppm2      1.779 CV     1
 ASSI { 2170}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 73   and name HG13))
      2.700     0.900     0.900 peak  2170 spectrum    1 weight  0.10000E+01 volume  0.10565E-01 ppm1      0.830 ppm2      1.396 CV     1
 ASSI { 2171}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 114  and name HG12))
      2.800     1.000     1.000 peak  2171 spectrum    1 weight  0.10000E+01 volume  0.27211E-02 ppm1      0.829 ppm2      1.234 CV     1
 ASSI { 2173}
   (( segid "    " and resid 73   and name HB  ))
   (( segid "    " and resid 73   and name HG13))
      2.100     0.600     0.600 peak  2173 spectrum    1 weight  0.10000E+01 volume  0.66017E-02 ppm1      1.774 ppm2      1.395 CV     1
 ASSI { 2174}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HG13))
      3.200     1.300     1.300 peak  2174 spectrum    1 weight  0.10000E+01 volume  0.20187E-02 ppm1      4.142 ppm2      1.393 CV     1
 ASSI { 2177}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HB  ))
      2.700     0.900     0.900 peak  2177 spectrum    1 weight  0.10000E+01 volume  0.31823E-02 ppm1      4.140 ppm2      1.778 CV     1
 ASSI { 2181}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 74   and name H   ))
      4.700     2.800     1.300 peak  2181 spectrum    1 weight  0.10000E+01 volume  0.13720E-02 ppm1      0.810 ppm2      8.385 CV     1
 ASSI { 2183}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 74   and name H   ))
      2.100     0.600     0.600 peak  2183 spectrum    1 weight  0.10000E+01 volume  0.38904E-02 ppm1      0.830 ppm2      8.386 CV     1
 ASSI { 2186}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 109  and name H   ))
      3.400     1.400     1.400 peak  2186 spectrum    1 weight  0.10000E+01 volume  0.10669E-02 ppm1      1.371 ppm2      7.632 CV     1
 ASSI { 2187}
   (( segid "    " and resid 73   and name HB  ))
   (( segid "    " and resid 74   and name H   ))
      3.200     1.300     1.300 peak  2187 spectrum    1 weight  0.10000E+01 volume  0.15072E-02 ppm1      1.773 ppm2      8.390 CV     1
 ASSI { 2189}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 74   and name H   ))
      2.100     0.600     0.600 peak  2189 spectrum    1 weight  0.10000E+01 volume  0.58271E-02 ppm1      4.141 ppm2      8.388 CV     1
 ASSI { 2193}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 80   and name HE21))
      4.000     2.000     2.000 peak  2193 spectrum    1 weight  0.10000E+01 volume  0.45227E-03 ppm1      0.825 ppm2      7.456 CV     1
 ASSI { 2194}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 76   and name HE3 ))
      4.100     2.100     1.900 peak  2194 spectrum    1 weight  0.10000E+01 volume  0.33629E-03 ppm1      0.828 ppm2      7.366 CV     1
 ASSI { 2195}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 85   and name HE22))
      4.700     2.800     1.300 peak  2195 spectrum    1 weight  0.10000E+01 volume  0.68313E-03 ppm1      0.827 ppm2      7.232 CV     1
 ASSI { 2196}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 72   and name HD2 ))
      4.900     3.000     1.100 peak  2196 spectrum    1 weight  0.10000E+01 volume  0.44533E-03 ppm1      0.827 ppm2      7.002 CV     1
 ASSI { 2197}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 85   and name HE21))
      4.700     2.700     1.300 peak  2197 spectrum    1 weight  0.10000E+01 volume  0.45472E-03 ppm1      0.828 ppm2      6.837 CV     1
 ASSI { 2198}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 84   and name H   ))
      4.400     2.400     1.600 peak  2198 spectrum    1 weight  0.10000E+01 volume  0.34055E-03 ppm1      0.809 ppm2      7.988 CV     1
 ASSI { 2199}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 80   and name HE21))
      4.900     3.000     1.100 peak  2199 spectrum    1 weight  0.10000E+01 volume  0.21543E-03 ppm1      0.809 ppm2      7.451 CV     1
 ASSI { 2200}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 85   and name HE22))
      6.000     5.100     0.000 peak  2200 spectrum    1 weight  0.10000E+01 volume  0.39528E-04 ppm1      0.811 ppm2      7.239 CV     1
 ASSI { 2203}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 80   and name HE22))
      5.300     3.600     0.700 peak  2203 spectrum    1 weight  0.10000E+01 volume  0.24946E-03 ppm1      0.809 ppm2      6.601 CV     1
 ASSI { 2210}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 81   and name HG2 ))
      4.600     2.700     1.400 peak  2210 spectrum    1 weight  0.10000E+01 volume  0.32678E-03 ppm1      0.810 ppm2      2.807 CV     1
 ASSI { 2215}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 71   and name HA  ))
      4.800     2.900     1.200 peak  2215 spectrum    1 weight  0.10000E+01 volume  0.44745E-03 ppm1      0.809 ppm2      4.345 CV     1
 ASSI { 2217}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 113  and name HD2 ))
      5.300     3.500     0.700 peak  2217 spectrum    1 weight  0.10000E+01 volume  0.38177E-03 ppm1      0.826 ppm2      3.373 CV     1
 OR { 2217}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 113  and name HD3 ))
 ASSI { 2221}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
      4.800     2.900     1.200 peak  2221 spectrum    1 weight  0.10000E+01 volume  0.24503E-03 ppm1      4.138 ppm2      3.093 CV     1
 OR { 2221}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 72   and name HB3 ))
 ASSI { 2228}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 75   and name HA  ))
      4.300     2.300     1.700 peak  2228 spectrum    1 weight  0.10000E+01 volume  0.69089E-03 ppm1      0.829 ppm2      4.459 CV     1
 ASSI { 2229}
   (( segid "    " and resid 73   and name HB  ))
   (  segid "    " and resid 121  and name HD2%)
      4.700     2.700     1.300 peak  2229 spectrum    1 weight  0.10000E+01 volume  0.78761E-03 ppm1      1.768 ppm2      0.628 CV     1
 ASSI { 2231}
   (( segid "    " and resid 72   and name HE1 ))
   (( segid "    " and resid 72   and name HD2 ))
      5.200     3.400     0.800 peak  2231 spectrum    1 weight  0.10000E+01 volume  0.25154E-03 ppm1      7.992 ppm2      7.017 CV     1
 ASSI { 2235}
   (( segid "    " and resid 72   and name HD2 ))
   (( segid "    " and resid 72   and name HB3 ))
      2.900     1.100     1.100 peak  2235 spectrum    1 weight  0.10000E+01 volume  0.17015E-02 ppm1      7.007 ppm2      3.143 CV     1
 ASSI { 2236}
   (( segid "    " and resid 72   and name HD2 ))
   (( segid "    " and resid 72   and name HB2 ))
      3.500     1.500     1.500 peak  2236 spectrum    1 weight  0.10000E+01 volume  0.17763E-02 ppm1      7.007 ppm2      3.063 CV     1
 ASSI { 2239}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HB3 ))
      2.700     0.900     0.900 peak  2239 spectrum    1 weight  0.10000E+01 volume  0.57351E-02 ppm1      4.674 ppm2      3.130 CV     1
 ASSI { 2240}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
      2.400     0.700     0.700 peak  2240 spectrum    1 weight  0.10000E+01 volume  0.44136E-02 ppm1      4.674 ppm2      3.064 CV     1
 ASSI { 2242}
   (( segid "    " and resid 72   and name HE1 ))
   (( segid "    " and resid 75   and name HG  ))
      4.700     2.700     1.300 peak  2242 spectrum    1 weight  0.10000E+01 volume  0.24693E-03 ppm1      7.990 ppm2      1.644 CV     1
 OR { 2242}
   (( segid "    " and resid 72   and name HE1 ))
   (( segid "    " and resid 75   and name HB3 ))
 ASSI { 2243}
   (( segid "    " and resid 72   and name HE1 ))
   (  segid "    " and resid 120  and name HB% )
      5.200     3.400     0.800 peak  2243 spectrum    1 weight  0.10000E+01 volume  0.33651E-03 ppm1      7.990 ppm2      1.446 CV     1
 ASSI { 2244}
   (( segid "    " and resid 72   and name HE1 ))
   (( segid "    " and resid 117  and name HD2 ))
      5.300     3.500     0.700 peak  2244 spectrum    1 weight  0.10000E+01 volume  0.15159E-03 ppm1      7.988 ppm2      1.170 CV     1
 ASSI { 2248}
   (( segid "    " and resid 72   and name HD2 ))
   (( segid "    " and resid 117  and name HD2 ))
      3.900     1.900     1.900 peak  2248 spectrum    1 weight  0.10000E+01 volume  0.47683E-03 ppm1      7.007 ppm2      1.163 CV     1
 ASSI { 2249}
   (( segid "    " and resid 72   and name HD2 ))
   (  segid "    " and resid 120  and name HB% )
      3.800     1.800     1.800 peak  2249 spectrum    1 weight  0.10000E+01 volume  0.60331E-03 ppm1      7.005 ppm2      1.426 CV     1
 ASSI { 2252}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 73   and name HB  ))
      3.900     1.900     1.900 peak  2252 spectrum    1 weight  0.10000E+01 volume  0.20894E-02 ppm1      4.674 ppm2      1.769 CV     1
 ASSI { 2253}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 73   and name HD1%)
      4.100     2.100     1.900 peak  2253 spectrum    1 weight  0.10000E+01 volume  0.19749E-02 ppm1      4.677 ppm2      0.828 CV     1
 OR { 2253}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 73   and name HG2%)
 ASSI { 2257}
   (( segid "    " and resid 71   and name HB  ))
   (  segid "    " and resid 73   and name HD1%)
      3.600     1.600     1.600 peak  2257 spectrum    1 weight  0.10000E+01 volume  0.10051E-02 ppm1      4.170 ppm2      0.823 CV     1
 OR { 2257}
   (( segid "    " and resid 71   and name HB  ))
   (  segid "    " and resid 73   and name HG2%)
 ASSI { 2258}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 71   and name HG2%)
      2.300     0.700     0.700 peak  2258 spectrum    1 weight  0.10000E+01 volume  0.12908E-01 ppm1      4.320 ppm2      1.170 CV     1
 ASSI { 2259}
   (( segid "    " and resid 71   and name HB  ))
   (  segid "    " and resid 71   and name HG2%)
      1.900     0.500     0.500 peak  2259 spectrum    1 weight  0.10000E+01 volume  0.23900E-01 ppm1      4.171 ppm2      1.170 CV     1
 ASSI { 2263}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 121  and name HB2 ))
      3.500     1.500     1.500 peak  2263 spectrum    1 weight  0.10000E+01 volume  0.30930E-02 ppm1      4.310 ppm2      1.635 CV     1
 ASSI { 2265}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
      5.400     3.600     0.600 peak  2265 spectrum    1 weight  0.10000E+01 volume  0.43815E-03 ppm1      4.320 ppm2      3.047 CV     1
 ASSI { 2267}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 71   and name HA  ))
      2.100     0.600     0.600 peak  2267 spectrum    1 weight  0.10000E+01 volume  0.80423E-02 ppm1      4.171 ppm2      4.314 CV     1
 ASSI { 2273}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 76   and name HB3 ))
      4.400     2.400     1.600 peak  2273 spectrum    1 weight  0.10000E+01 volume  0.87592E-03 ppm1      1.166 ppm2      3.033 CV     1
 ASSI { 2275}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 71   and name H   ))
      4.100     2.100     1.900 peak  2275 spectrum    1 weight  0.10000E+01 volume  0.46432E-03 ppm1      4.171 ppm2      8.099 CV     1
 ASSI { 2279}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 48   and name H   ))
      3.700     1.700     1.700 peak  2279 spectrum    1 weight  0.10000E+01 volume  0.52325E-03 ppm1      1.173 ppm2      8.337 CV     1
 ASSI { 2280}
   (( segid "    " and resid 70   and name HA3 ))
   (  segid "    " and resid 63   and name HG1%)
      3.400     1.400     1.400 peak  2280 spectrum    1 weight  0.10000E+01 volume  0.97945E-03 ppm1      4.026 ppm2      0.927 CV     1
 OR { 2280}
   (( segid "    " and resid 70   and name HA2 ))
   (  segid "    " and resid 63   and name HG1%)
 ASSI { 2282}
   (( segid "    " and resid 70   and name HA2 ))
   (  segid "    " and resid 71   and name HG2%)
      3.900     1.900     1.900 peak  2282 spectrum    1 weight  0.10000E+01 volume  0.12067E-02 ppm1      4.018 ppm2      1.165 CV     1
 OR { 2282}
   (( segid "    " and resid 70   and name HA3 ))
   (  segid "    " and resid 71   and name HG2%)
 ASSI { 2295}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HB3 ))
      2.200     0.600     0.600 peak  2295 spectrum    1 weight  0.10000E+01 volume  0.78512E-02 ppm1      4.402 ppm2      2.167 CV     1
 ASSI { 2296}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HB2 ))
      2.700     0.900     0.900 peak  2296 spectrum    1 weight  0.10000E+01 volume  0.71485E-02 ppm1      4.402 ppm2      2.058 CV     1
 ASSI { 2298}
   (( segid "    " and resid 67   and name HG2 ))
   (  segid "    " and resid 37   and name HD2%)
      4.100     2.100     1.900 peak  2298 spectrum    1 weight  0.10000E+01 volume  0.75029E-03 ppm1      2.396 ppm2      0.815 CV     1
 OR { 2298}
   (( segid "    " and resid 67   and name HG3 ))
   (  segid "    " and resid 37   and name HD2%)
 ASSI { 2300}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 45   and name HB2 ))
      2.700     0.900     0.900 peak  2300 spectrum    1 weight  0.10000E+01 volume  0.34654E-02 ppm1      2.158 ppm2      1.708 CV     1
 OR { 2300}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 45   and name HB2 ))
 OR { 2300}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 45   and name HB3 ))
 OR { 2300}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 45   and name HB3 ))
 ASSI { 2302}
   (( segid "    " and resid 14   and name HB3 ))
   (( segid "    " and resid 14   and name HG2 ))
      2.900     1.000     1.000 peak  2302 spectrum    1 weight  0.10000E+01 volume  0.17228E-02 ppm1      2.081 ppm2      2.853 CV     1
 ASSI { 2303}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 131  and name HB2 ))
      4.200     2.200     1.800 peak  2303 spectrum    1 weight  0.10000E+01 volume  0.74114E-03 ppm1      4.409 ppm2      2.865 CV     1
 ASSI { 2305}
   (( segid "    " and resid 67   and name HG2 ))
   (( segid "    " and resid 64   and name HA  ))
      3.600     1.600     1.600 peak  2305 spectrum    1 weight  0.10000E+01 volume  0.18542E-02 ppm1      2.408 ppm2      4.109 CV     1
 OR { 2305}
   (( segid "    " and resid 67   and name HG3 ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI { 2313}
   (( segid "    " and resid 67   and name HG2 ))
   (  segid "    " and resid 66   and name HD% )
      4.300     2.300     1.700 peak  2313 spectrum    1 weight  0.10000E+01 volume  0.41945E-03 ppm1      2.414 ppm2      7.285 CV     1
 OR { 2313}
   (( segid "    " and resid 67   and name HG3 ))
   (  segid "    " and resid 66   and name HD% )
 ASSI { 2317}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 66   and name HD% )
      3.300     1.400     1.400 peak  2317 spectrum    1 weight  0.10000E+01 volume  0.32726E-02 ppm1      4.575 ppm2      7.293 CV     1
 ASSI { 2322}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 66   and name HE% )
      4.600     2.600     1.400 peak  2322 spectrum    1 weight  0.10000E+01 volume  0.75068E-03 ppm1      4.580 ppm2      7.069 CV     1
 ASSI { 2326}
   (( segid "    " and resid 66   and name HB3 ))
   (  segid "    " and resid 51   and name HG2%)
      4.500     2.500     1.500 peak  2326 spectrum    1 weight  0.10000E+01 volume  0.10986E-02 ppm1      3.370 ppm2      0.673 CV     1
 ASSI { 2328}
   (( segid "    " and resid 66   and name HB3 ))
   (( segid "    " and resid 67   and name HG3 ))
      4.900     3.000     1.100 peak  2328 spectrum    1 weight  0.10000E+01 volume  0.46139E-03 ppm1      3.367 ppm2      2.418 CV     1
 OR { 2328}
   (( segid "    " and resid 66   and name HB3 ))
   (( segid "    " and resid 67   and name HG2 ))
 ASSI { 2329}
   (( segid "    " and resid 66   and name HB3 ))
   (( segid "    " and resid 66   and name HB2 ))
      2.000     0.500     0.500 peak  2329 spectrum    1 weight  0.10000E+01 volume  0.34089E-02 ppm1      3.368 ppm2      2.896 CV     1
 ASSI { 2332}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 51   and name HG2%)
      3.400     1.500     1.500 peak  2332 spectrum    1 weight  0.10000E+01 volume  0.14351E-02 ppm1      2.895 ppm2      0.667 CV     1
 ASSI { 2334}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 33   and name HG1%)
      3.600     1.600     1.600 peak  2334 spectrum    1 weight  0.10000E+01 volume  0.16652E-02 ppm1      2.896 ppm2      0.955 CV     1
 OR { 2334}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI { 2335}
   (( segid "    " and resid 66   and name HB3 ))
   (( segid "    " and resid 63   and name HA  ))
      5.200     3.400     0.800 peak  2335 spectrum    1 weight  0.10000E+01 volume  0.40915E-03 ppm1      3.367 ppm2      3.963 CV     1
 ASSI { 2338}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 55   and name HG1%)
      2.400     0.700     0.700 peak  2338 spectrum    1 weight  0.10000E+01 volume  0.54309E-02 ppm1      4.584 ppm2      0.800 CV     1
 OR { 2338}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI { 2340}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 67   and name HG3 ))
      4.200     2.200     1.800 peak  2340 spectrum    1 weight  0.10000E+01 volume  0.81270E-03 ppm1      4.576 ppm2      2.411 CV     1
 OR { 2340}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 67   and name HG2 ))
 ASSI { 2341}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HB2 ))
      3.300     1.400     1.400 peak  2341 spectrum    1 weight  0.10000E+01 volume  0.19773E-02 ppm1      4.575 ppm2      2.895 CV     1
 ASSI { 2342}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HB3 ))
      2.600     0.800     0.800 peak  2342 spectrum    1 weight  0.10000E+01 volume  0.25292E-02 ppm1      4.580 ppm2      3.375 CV     1
 ASSI { 2345}
   (( segid "    " and resid 91   and name HZ  ))
   (( segid "    " and resid 91   and name HB3 ))
      5.200     3.400     0.800 peak  2345 spectrum    1 weight  0.10000E+01 volume  0.31029E-03 ppm1      7.094 ppm2      2.681 CV     1
 ASSI { 2346}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 71   and name HG2%)
      3.900     1.900     1.900 peak  2346 spectrum    1 weight  0.10000E+01 volume  0.71424E-03 ppm1      4.399 ppm2      1.175 CV     1
 ASSI { 2347}
   (( segid "    " and resid 65   and name HB3 ))
   (  segid "    " and resid 55   and name HG1%)
      4.100     2.100     1.900 peak  2347 spectrum    1 weight  0.10000E+01 volume  0.51100E-03 ppm1      2.410 ppm2      0.801 CV     1
 ASSI { 2349}
   (( segid "    " and resid 65   and name HB3 ))
   (  segid "    " and resid 60   and name HB% )
      2.900     1.100     1.100 peak  2349 spectrum    1 weight  0.10000E+01 volume  0.15415E-02 ppm1      2.410 ppm2      1.239 CV     1
 ASSI { 2350}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 64   and name HB3 ))
      5.100     3.300     0.900 peak  2350 spectrum    1 weight  0.10000E+01 volume  0.46278E-03 ppm1      2.415 ppm2      1.709 CV     1
 OR { 2350}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 64   and name HD2 ))
 OR { 2350}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 64   and name HD3 ))
 ASSI { 2351}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 61   and name HB3 ))
      4.300     2.300     1.700 peak  2351 spectrum    1 weight  0.10000E+01 volume  0.74094E-03 ppm1      4.416 ppm2      2.708 CV     1
 OR { 2351}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 61   and name HB2 ))
 ASSI { 2352}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 70   and name HA2 ))
      3.700     1.700     1.700 peak  2352 spectrum    1 weight  0.10000E+01 volume  0.18820E-02 ppm1      4.400 ppm2      4.034 CV     1
 OR { 2352}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 70   and name HA3 ))
 ASSI { 2353}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 64   and name HA  ))
      5.800     4.200     0.200 peak  2353 spectrum    1 weight  0.10000E+01 volume  0.14809E-03 ppm1      2.414 ppm2      4.111 CV     1
 ASSI { 2355}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 65   and name HA  ))
      3.400     1.500     1.500 peak  2355 spectrum    1 weight  0.10000E+01 volume  0.16843E-02 ppm1      2.404 ppm2      4.413 CV     1
 ASSI { 2357}
   (( segid "    " and resid 65   and name HB3 ))
   (  segid "    " and resid 66   and name HD% )
      3.600     1.600     1.600 peak  2357 spectrum    1 weight  0.10000E+01 volume  0.52870E-03 ppm1      2.415 ppm2      7.291 CV     1
 ASSI { 2358}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 66   and name H   ))
      3.100     1.200     1.200 peak  2358 spectrum    1 weight  0.10000E+01 volume  0.78883E-03 ppm1      2.413 ppm2      7.516 CV     1
 ASSI { 2367}
   (( segid "    " and resid 64   and name HB3 ))
   (  segid "    " and resid 63   and name HG1%)
      3.900     1.900     1.900 peak  2367 spectrum    1 weight  0.10000E+01 volume  0.23907E-02 ppm1      1.734 ppm2      0.950 CV     1
 OR { 2367}
   (( segid "    " and resid 64   and name HB3 ))
   (  segid "    " and resid 63   and name HG2%)
 ASSI { 2368}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HG2 ))
      2.400     0.700     0.700 peak  2368 spectrum    1 weight  0.10000E+01 volume  0.53790E-02 ppm1      1.830 ppm2      1.434 CV     1
 OR { 2368}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HG3 ))
 ASSI { 2369}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HE2 ))
      4.000     2.000     2.000 peak  2369 spectrum    1 weight  0.10000E+01 volume  0.17580E-02 ppm1      1.829 ppm2      2.977 CV     1
 OR { 2369}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HE3 ))
 ASSI { 2370}
   (( segid "    " and resid 108  and name HB3 ))
   (( segid "    " and resid 108  and name HE3 ))
      3.700     1.800     1.800 peak  2370 spectrum    1 weight  0.10000E+01 volume  0.13351E-02 ppm1      1.728 ppm2      2.972 CV     1
 OR { 2370}
   (( segid "    " and resid 108  and name HB2 ))
   (( segid "    " and resid 108  and name HE3 ))
 OR { 2370}
   (( segid "    " and resid 108  and name HB3 ))
   (( segid "    " and resid 108  and name HE2 ))
 OR { 2370}
   (( segid "    " and resid 108  and name HB2 ))
   (( segid "    " and resid 108  and name HE2 ))
 ASSI { 2371}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HA  ))
      2.900     1.000     1.000 peak  2371 spectrum    1 weight  0.10000E+01 volume  0.37722E-02 ppm1      1.826 ppm2      4.106 CV     1
 ASSI { 2372}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HA  ))
      2.400     0.700     0.700 peak  2372 spectrum    1 weight  0.10000E+01 volume  0.31954E-02 ppm1      1.727 ppm2      3.886 CV     1
 ASSI { 2374}
   (( segid "    " and resid 64   and name HG3 ))
   (  segid "    " and resid 63   and name HG1%)
      2.600     0.900     0.900 peak  2374 spectrum    1 weight  0.10000E+01 volume  0.52239E-02 ppm1      1.409 ppm2      0.958 CV     1
 OR { 2374}
   (( segid "    " and resid 64   and name HG2 ))
   (  segid "    " and resid 63   and name HG1%)
 OR { 2374}
   (( segid "    " and resid 64   and name HG3 ))
   (  segid "    " and resid 63   and name HG2%)
 OR { 2374}
   (( segid "    " and resid 64   and name HG2 ))
   (  segid "    " and resid 63   and name HG2%)
 ASSI { 2375}
   (( segid "    " and resid 64   and name HD2 ))
   (( segid "    " and resid 64   and name HA  ))
      2.900     1.100     1.100 peak  2375 spectrum    1 weight  0.10000E+01 volume  0.31349E-02 ppm1      1.665 ppm2      4.105 CV     1
 OR { 2375}
   (( segid "    " and resid 64   and name HD3 ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI { 2376}
   (( segid "    " and resid 64   and name HE3 ))
   (( segid "    " and resid 64   and name HA  ))
      3.800     1.800     1.800 peak  2376 spectrum    1 weight  0.10000E+01 volume  0.18444E-02 ppm1      2.979 ppm2      4.091 CV     1
 OR { 2376}
   (( segid "    " and resid 64   and name HE2 ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI { 2377}
   (( segid "    " and resid 25   and name HE2 ))
   (( segid "    " and resid 22   and name HA  ))
      3.200     1.300     1.300 peak  2377 spectrum    1 weight  0.10000E+01 volume  0.23785E-02 ppm1      2.975 ppm2      3.707 CV     1
 OR { 2377}
   (( segid "    " and resid 25   and name HE3 ))
   (( segid "    " and resid 22   and name HA  ))
 ASSI { 2382}
   (( segid "    " and resid 64   and name HD2 ))
   (( segid "    " and resid 65   and name H   ))
      4.200     2.200     1.800 peak  2382 spectrum    1 weight  0.10000E+01 volume  0.81083E-03 ppm1      1.663 ppm2      7.692 CV     1
 OR { 2382}
   (( segid "    " and resid 64   and name HD3 ))
   (( segid "    " and resid 65   and name H   ))
 ASSI { 2383}
   (( segid "    " and resid 64   and name HD2 ))
   (( segid "    " and resid 64   and name H   ))
      3.300     1.300     1.300 peak  2383 spectrum    1 weight  0.10000E+01 volume  0.18408E-02 ppm1      1.667 ppm2      8.285 CV     1
 OR { 2383}
   (( segid "    " and resid 64   and name HD3 ))
   (( segid "    " and resid 64   and name H   ))
 ASSI { 2384}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 52   and name HD2 ))
      4.100     2.100     1.900 peak  2384 spectrum    1 weight  0.10000E+01 volume  0.77128E-03 ppm1      1.692 ppm2      7.068 CV     1
 OR { 2384}
   (( segid "    " and resid 48   and name HD3 ))
   (( segid "    " and resid 52   and name HD2 ))
 ASSI { 2386}
   (( segid "    " and resid 30   and name HB3 ))
   (( segid "    " and resid 30   and name HE21))
      3.300     1.300     1.300 peak  2386 spectrum    1 weight  0.10000E+01 volume  0.67565E-03 ppm1      1.845 ppm2      7.031 CV     1
 ASSI { 2387}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 52   and name HD2 ))
      4.800     2.900     1.200 peak  2387 spectrum    1 weight  0.10000E+01 volume  0.26334E-03 ppm1      1.728 ppm2      7.060 CV     1
 ASSI { 2389}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 63   and name H   ))
      4.600     2.700     1.400 peak  2389 spectrum    1 weight  0.10000E+01 volume  0.38759E-03 ppm1      1.833 ppm2      8.637 CV     1
 ASSI { 2390}
   (( segid "    " and resid 64   and name HB3 ))
   (( segid "    " and resid 63   and name H   ))
      6.000     4.400     0.000 peak  2390 spectrum    1 weight  0.10000E+01 volume  0.32870E-03 ppm1      1.749 ppm2      8.654 CV     1
 ASSI { 2391}
   (( segid "    " and resid 25   and name HE2 ))
   (( segid "    " and resid 25   and name H   ))
      5.100     3.300     0.900 peak  2391 spectrum    1 weight  0.10000E+01 volume  0.56538E-03 ppm1      2.965 ppm2      8.043 CV     1
 OR { 2391}
   (( segid "    " and resid 25   and name HE3 ))
   (( segid "    " and resid 25   and name H   ))
 ASSI { 2393}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 55   and name HG1%)
      2.300     0.700     0.700 peak  2393 spectrum    1 weight  0.10000E+01 volume  0.12958E-01 ppm1      3.967 ppm2      0.803 CV     1
 OR { 2393}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI { 2395}
   (( segid "    " and resid 32   and name HA  ))
   (  segid "    " and resid 32   and name HG1%)
      3.000     1.100     1.100 peak  2395 spectrum    1 weight  0.10000E+01 volume  0.49824E-02 ppm1      3.964 ppm2      1.281 CV     1
 ASSI { 2396}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HB  ))
      2.500     0.800     0.800 peak  2396 spectrum    1 weight  0.10000E+01 volume  0.39572E-02 ppm1      3.964 ppm2      2.363 CV     1
 ASSI { 2397}
   (  segid "    " and resid 63   and name HG2%)
   (  segid "    " and resid 51   and name HG2%)
      2.200     0.600     0.600 peak  2397 spectrum    1 weight  0.10000E+01 volume  0.94218E-02 ppm1      0.962 ppm2      0.678 CV     1
 ASSI { 2398}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 64   and name HG3 ))
      2.800     1.000     1.000 peak  2398 spectrum    1 weight  0.10000E+01 volume  0.72341E-02 ppm1      0.963 ppm2      1.441 CV     1
 OR { 2398}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 64   and name HG2 ))
 ASSI { 2401}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 67   and name HG2 ))
      3.400     1.400     1.400 peak  2401 spectrum    1 weight  0.10000E+01 volume  0.17573E-02 ppm1      0.964 ppm2      2.416 CV     1
 OR { 2401}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 67   and name HG3 ))
 ASSI { 2403}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 66   and name HB2 ))
      4.300     2.300     1.700 peak  2403 spectrum    1 weight  0.10000E+01 volume  0.61310E-03 ppm1      0.961 ppm2      2.874 CV     1
 ASSI { 2404}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 68   and name HD2 ))
      3.900     1.900     1.900 peak  2404 spectrum    1 weight  0.10000E+01 volume  0.67649E-03 ppm1      0.965 ppm2      3.232 CV     1
 OR { 2404}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 68   and name HD3 ))
 ASSI { 2405}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 66   and name HB3 ))
      5.500     3.700     0.500 peak  2405 spectrum    1 weight  0.10000E+01 volume  0.52335E-03 ppm1      0.967 ppm2      3.358 CV     1
 ASSI { 2406}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 62   and name HB3 ))
      4.400     2.400     1.600 peak  2406 spectrum    1 weight  0.10000E+01 volume  0.13901E-02 ppm1      0.964 ppm2      3.776 CV     1
 ASSI { 2407}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 63   and name HA  ))
      2.300     0.600     0.600 peak  2407 spectrum    1 weight  0.10000E+01 volume  0.90165E-02 ppm1      0.963 ppm2      3.964 CV     1
 ASSI { 2411}
   (  segid "    " and resid 63   and name HG2%)
   (  segid "    " and resid 66   and name HD% )
      3.600     1.600     1.600 peak  2411 spectrum    1 weight  0.10000E+01 volume  0.12743E-02 ppm1      0.964 ppm2      7.292 CV     1
 ASSI { 2412}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 66   and name H   ))
      4.000     2.000     2.000 peak  2412 spectrum    1 weight  0.10000E+01 volume  0.10890E-02 ppm1      0.964 ppm2      7.505 CV     1
 ASSI { 2413}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 67   and name H   ))
      3.400     1.400     1.400 peak  2413 spectrum    1 weight  0.10000E+01 volume  0.13993E-02 ppm1      0.963 ppm2      7.832 CV     1
 ASSI { 2414}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 65   and name H   ))
      3.900     1.900     1.900 peak  2414 spectrum    1 weight  0.10000E+01 volume  0.10285E-02 ppm1      0.964 ppm2      7.698 CV     1
 ASSI { 2415}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 64   and name H   ))
      2.900     1.100     1.100 peak  2415 spectrum    1 weight  0.10000E+01 volume  0.44700E-02 ppm1      0.963 ppm2      8.283 CV     1
 ASSI { 2416}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 63   and name H   ))
      3.200     1.300     1.300 peak  2416 spectrum    1 weight  0.10000E+01 volume  0.65127E-02 ppm1      0.963 ppm2      8.662 CV     1
 ASSI { 2418}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name H   ))
      2.800     1.000     1.000 peak  2418 spectrum    1 weight  0.10000E+01 volume  0.22466E-02 ppm1      3.966 ppm2      7.493 CV     1
 ASSI { 2424}
   (( segid "    " and resid 62   and name HB3 ))
   (( segid "    " and resid 63   and name H   ))
      2.600     0.800     0.800 peak  2424 spectrum    1 weight  0.10000E+01 volume  0.17257E-02 ppm1      3.764 ppm2      8.659 CV     1
 ASSI { 2426}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB3 ))
      2.700     0.900     0.900 peak  2426 spectrum    1 weight  0.10000E+01 volume  0.20343E-02 ppm1      4.585 ppm2      3.768 CV     1
 ASSI { 2430}
   (( segid "    " and resid 62   and name HB3 ))
   (( segid "    " and resid 64   and name HE2 ))
      4.400     2.400     1.600 peak  2430 spectrum    1 weight  0.10000E+01 volume  0.34725E-03 ppm1      3.769 ppm2      2.970 CV     1
 OR { 2430}
   (( segid "    " and resid 62   and name HB3 ))
   (( segid "    " and resid 64   and name HE3 ))
 ASSI { 2431}
   (( segid "    " and resid 62   and name HB3 ))
   (( segid "    " and resid 61   and name HB2 ))
      4.300     2.300     1.700 peak  2431 spectrum    1 weight  0.10000E+01 volume  0.89713E-03 ppm1      3.763 ppm2      2.705 CV     1
 OR { 2431}
   (( segid "    " and resid 62   and name HB3 ))
   (( segid "    " and resid 61   and name HB3 ))
 ASSI { 2432}
   (( segid "    " and resid 62   and name HB3 ))
   (( segid "    " and resid 65   and name HB3 ))
      5.100     3.300     0.900 peak  2432 spectrum    1 weight  0.10000E+01 volume  0.49292E-03 ppm1      3.757 ppm2      2.398 CV     1
 ASSI { 2433}
   (( segid "    " and resid 62   and name HB3 ))
   (  segid "    " and resid 60   and name HB% )
      4.700     2.800     1.300 peak  2433 spectrum    1 weight  0.10000E+01 volume  0.73510E-03 ppm1      3.764 ppm2      1.244 CV     1
 ASSI { 2434}
   (( segid "    " and resid 62   and name HB3 ))
   (( segid "    " and resid 64   and name HG2 ))
      3.400     1.500     1.500 peak  2434 spectrum    1 weight  0.10000E+01 volume  0.13910E-02 ppm1      3.765 ppm2      1.442 CV     1
 OR { 2434}
   (( segid "    " and resid 62   and name HB3 ))
   (( segid "    " and resid 64   and name HG3 ))
 ASSI { 2435}
   (( segid "    " and resid 62   and name HB3 ))
   (  segid "    " and resid 55   and name HG1%)
      3.400     1.500     1.500 peak  2435 spectrum    1 weight  0.10000E+01 volume  0.32795E-02 ppm1      3.764 ppm2      0.808 CV     1
 OR { 2435}
   (( segid "    " and resid 62   and name HB3 ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI { 2436}
   (( segid "    " and resid 62   and name HB3 ))
   (  segid "    " and resid 51   and name HG2%)
      4.500     2.500     1.500 peak  2436 spectrum    1 weight  0.10000E+01 volume  0.94126E-03 ppm1      3.765 ppm2      0.690 CV     1
 ASSI { 2437}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HB  ))
      2.600     0.900     0.900 peak  2437 spectrum    1 weight  0.10000E+01 volume  0.28596E-02 ppm1      3.968 ppm2      2.004 CV     1
 ASSI { 2440}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 63   and name H   ))
      2.600     0.900     0.900 peak  2440 spectrum    1 weight  0.10000E+01 volume  0.24180E-02 ppm1      4.585 ppm2      8.660 CV     1
 ASSI { 2442}
   (( segid "    " and resid 31   and name HB2 ))
   (  segid "    " and resid 33   and name HG1%)
      4.400     2.400     1.600 peak  2442 spectrum    1 weight  0.10000E+01 volume  0.86521E-03 ppm1      2.701 ppm2      0.955 CV     1
 OR { 2442}
   (( segid "    " and resid 31   and name HB2 ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI { 2452}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 55   and name HG1%)
      3.300     1.300     1.300 peak  2452 spectrum    1 weight  0.10000E+01 volume  0.23914E-02 ppm1      4.542 ppm2      0.812 CV     1
 OR { 2452}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI { 2453}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 61   and name HB2 ))
      2.400     0.700     0.700 peak  2453 spectrum    1 weight  0.10000E+01 volume  0.95317E-02 ppm1      4.542 ppm2      2.705 CV     1
 OR { 2453}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 61   and name HB3 ))
 ASSI { 2454}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 62   and name HB3 ))
      5.000     3.200     1.000 peak  2454 spectrum    1 weight  0.10000E+01 volume  0.28257E-03 ppm1      4.531 ppm2      3.763 CV     1
 ASSI { 2456}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 61   and name H   ))
      2.800     1.000     1.000 peak  2456 spectrum    1 weight  0.10000E+01 volume  0.27188E-02 ppm1      4.544 ppm2      8.638 CV     1
 ASSI { 2459}
   (( segid "    " and resid 61   and name HB3 ))
   (( segid "    " and resid 65   and name H   ))
      5.000     3.100     1.000 peak  2459 spectrum    1 weight  0.10000E+01 volume  0.31534E-03 ppm1      2.717 ppm2      7.702 CV     1
 OR { 2459}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 65   and name H   ))
 ASSI { 2460}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 65   and name H   ))
      5.600     3.900     0.400 peak  2460 spectrum    1 weight  0.10000E+01 volume  0.20402E-03 ppm1      4.540 ppm2      7.713 CV     1
 ASSI { 2461}
   (( segid "    " and resid 60   and name HA  ))
   (  segid "    " and resid 55   and name HG1%)
      4.300     2.300     1.700 peak  2461 spectrum    1 weight  0.10000E+01 volume  0.10930E-02 ppm1      4.526 ppm2      0.798 CV     1
 ASSI { 2463}
   (( segid "    " and resid 60   and name HA  ))
   (  segid "    " and resid 60   and name HB% )
      2.300     0.600     0.600 peak  2463 spectrum    1 weight  0.10000E+01 volume  0.76302E-02 ppm1      4.530 ppm2      1.240 CV     1
 ASSI { 2464}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 44   and name HG2 ))
      3.500     1.500     1.500 peak  2464 spectrum    1 weight  0.10000E+01 volume  0.68451E-03 ppm1      4.530 ppm2      2.081 CV     1
 ASSI { 2465}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 55   and name HB  ))
      4.100     2.100     1.900 peak  2465 spectrum    1 weight  0.10000E+01 volume  0.11002E-02 ppm1      4.529 ppm2      2.019 CV     1
 ASSI { 2466}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 61   and name HB3 ))
      4.200     2.200     1.800 peak  2466 spectrum    1 weight  0.10000E+01 volume  0.13656E-02 ppm1      4.532 ppm2      2.709 CV     1
 OR { 2466}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 61   and name HB2 ))
 ASSI { 2467}
   (  segid "    " and resid 60   and name HB% )
   (  segid "    " and resid 54   and name HD1%)
      2.900     1.100     1.100 peak  2467 spectrum    1 weight  0.10000E+01 volume  0.39279E-02 ppm1      1.233 ppm2      0.426 CV     1
 ASSI { 2469}
   (  segid "    " and resid 42   and name HG2%)
   (  segid "    " and resid 40   and name HD2%)
      2.100     0.600     0.600 peak  2469 spectrum    1 weight  0.10000E+01 volume  0.11254E-01 ppm1      1.243 ppm2      0.975 CV     1
 OR { 2469}
   (  segid "    " and resid 42   and name HG2%)
   (  segid "    " and resid 40   and name HD1%)
 ASSI { 2470}
   (  segid "    " and resid 42   and name HG2%)
   (  segid "    " and resid 40   and name HD2%)
      2.100     0.600     0.600 peak  2470 spectrum    1 weight  0.10000E+01 volume  0.11870E-01 ppm1      1.239 ppm2      0.920 CV     1
 ASSI { 2472}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 13   and name HG3 ))
      2.200     0.600     0.600 peak  2472 spectrum    1 weight  0.10000E+01 volume  0.59004E-02 ppm1      1.240 ppm2      2.419 CV     1
 OR { 2472}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 13   and name HG2 ))
 ASSI { 2473}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 45   and name HD2 ))
      3.400     1.400     1.400 peak  2473 spectrum    1 weight  0.10000E+01 volume  0.27293E-02 ppm1      1.244 ppm2      2.300 CV     1
 ASSI { 2475}
   (( segid "    " and resid 25   and name HG2 ))
   (( segid "    " and resid 25   and name HE2 ))
      2.700     0.900     0.900 peak  2475 spectrum    1 weight  0.10000E+01 volume  0.27505E-02 ppm1      1.233 ppm2      2.985 CV     1
 OR { 2475}
   (( segid "    " and resid 25   and name HG2 ))
   (( segid "    " and resid 25   and name HE3 ))
 ASSI { 2476}
   (  segid "    " and resid 60   and name HB% )
   (( segid "    " and resid 61   and name HB3 ))
      3.900     1.900     1.900 peak  2476 spectrum    1 weight  0.10000E+01 volume  0.23554E-02 ppm1      1.234 ppm2      2.708 CV     1
 OR { 2476}
   (  segid "    " and resid 60   and name HB% )
   (( segid "    " and resid 61   and name HB2 ))
 ASSI { 2477}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 45   and name HD3 ))
      3.100     1.200     1.200 peak  2477 spectrum    1 weight  0.10000E+01 volume  0.21835E-02 ppm1      1.243 ppm2      2.834 CV     1
 ASSI { 2478}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 47   and name HD3 ))
      4.000     2.000     2.000 peak  2478 spectrum    1 weight  0.10000E+01 volume  0.92824E-03 ppm1      1.248 ppm2      3.199 CV     1
 ASSI { 2479}
   (  segid "    " and resid 60   and name HB% )
   (( segid "    " and resid 55   and name HA  ))
      2.500     0.800     0.800 peak  2479 spectrum    1 weight  0.10000E+01 volume  0.45090E-02 ppm1      1.234 ppm2      3.967 CV     1
 ASSI { 2480}
   (  segid "    " and resid 60   and name HB% )
   (( segid "    " and resid 54   and name HA  ))
      2.100     2.100     3.900 peak  2480 spectrum    1 weight  0.10000E+01 volume  0.18327E-02 ppm1      1.233 ppm2      3.705 CV     1
 ASSI { 2483}
   (  segid "    " and resid 60   and name HB% )
   (  segid "    " and resid 66   and name HD% )
      3.400     1.500     1.500 peak  2483 spectrum    1 weight  0.10000E+01 volume  0.26546E-02 ppm1      1.233 ppm2      7.291 CV     1
 ASSI { 2485}
   (  segid "    " and resid 60   and name HB% )
   (( segid "    " and resid 66   and name HZ  ))
      2.100     0.600     0.600 peak  2485 spectrum    1 weight  0.10000E+01 volume  0.59491E-02 ppm1      1.233 ppm2      6.935 CV     1
 ASSI { 2487}
   (( segid "    " and resid 25   and name HG2 ))
   (( segid "    " and resid 25   and name H   ))
      2.400     0.700     0.700 peak  2487 spectrum    1 weight  0.10000E+01 volume  0.23355E-02 ppm1      1.232 ppm2      8.041 CV     1
 ASSI { 2488}
   (  segid "    " and resid 60   and name HB% )
   (( segid "    " and resid 62   and name H   ))
      3.100     1.200     1.200 peak  2488 spectrum    1 weight  0.10000E+01 volume  0.27391E-02 ppm1      1.234 ppm2      7.866 CV     1
 ASSI { 2489}
   (  segid "    " and resid 60   and name HB% )
   (( segid "    " and resid 55   and name H   ))
      3.000     1.100     1.100 peak  2489 spectrum    1 weight  0.10000E+01 volume  0.20121E-02 ppm1      1.234 ppm2      7.492 CV     1
 ASSI { 2491}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 43   and name H   ))
      2.400     0.700     0.700 peak  2491 spectrum    1 weight  0.10000E+01 volume  0.31534E-02 ppm1      1.240 ppm2      7.976 CV     1
 ASSI { 2492}
   (  segid "    " and resid 60   and name HB% )
   (( segid "    " and resid 61   and name H   ))
      2.400     0.700     0.700 peak  2492 spectrum    1 weight  0.10000E+01 volume  0.44827E-02 ppm1      1.234 ppm2      8.638 CV     1
 ASSI { 2493}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 9    and name H   ))
      3.300     1.400     1.400 peak  2493 spectrum    1 weight  0.10000E+01 volume  0.46400E-02 ppm1      1.249 ppm2      8.675 CV     1
 ASSI { 2494}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 61   and name H   ))
      2.700     0.900     0.900 peak  2494 spectrum    1 weight  0.10000E+01 volume  0.28690E-02 ppm1      4.529 ppm2      8.639 CV     1
 ASSI { 2495}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 62   and name H   ))
      5.000     3.100     1.000 peak  2495 spectrum    1 weight  0.10000E+01 volume  0.51225E-03 ppm1      4.528 ppm2      7.854 CV     1
 ASSI { 2498}
   (( segid "    " and resid 59   and name HB3 ))
   (  segid "    " and resid 54   and name HD2%)
      3.300     1.300     1.300 peak  2498 spectrum    1 weight  0.10000E+01 volume  0.65138E-03 ppm1      1.370 ppm2      0.395 CV     1
 ASSI { 2499}
   (( segid "    " and resid 59   and name HB2 ))
   (  segid "    " and resid 54   and name HD2%)
      3.500     1.500     1.500 peak  2499 spectrum    1 weight  0.10000E+01 volume  0.60037E-03 ppm1      1.267 ppm2      0.395 CV     1
 ASSI { 2500}
   (  segid "    " and resid 59   and name HD2%)
   (  segid "    " and resid 54   and name HD2%)
      1.800     1.800     4.200 peak  2500 spectrum    1 weight  0.10000E+01 volume  0.56770E-02 ppm1      0.932 ppm2      0.390 CV     1
 ASSI { 2501}
   (  segid "    " and resid 59   and name HD1%)
   (  segid "    " and resid 54   and name HD2%)
      1.900     0.400     0.400 peak  2501 spectrum    1 weight  0.10000E+01 volume  0.10737E-01 ppm1      0.826 ppm2      0.393 CV     1
 ASSI { 2502}
   (( segid "    " and resid 59   and name HA  ))
   (  segid "    " and resid 59   and name HD2%)
      2.100     0.600     0.600 peak  2502 spectrum    1 weight  0.10000E+01 volume  0.10485E-01 ppm1      4.200 ppm2      0.937 CV     1
 ASSI { 2504}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 15   and name HB% )
      2.000     0.500     0.500 peak  2504 spectrum    1 weight  0.10000E+01 volume  0.12144E-01 ppm1      4.203 ppm2      1.576 CV     1
 ASSI { 2510}
   (( segid "    " and resid 59   and name HB2 ))
   (  segid "    " and resid 59   and name HD2%)
      3.600     1.600     1.600 peak  2510 spectrum    1 weight  0.10000E+01 volume  0.19657E-02 ppm1      1.275 ppm2      0.939 CV     1
 ASSI { 2512}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HB3 ))
      2.100     0.600     0.600 peak  2512 spectrum    1 weight  0.10000E+01 volume  0.18739E-02 ppm1      1.269 ppm2      1.405 CV     1
 ASSI { 2513}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 57   and name HB3 ))
      3.600     1.600     1.600 peak  2513 spectrum    1 weight  0.10000E+01 volume  0.39187E-03 ppm1      1.262 ppm2      1.655 CV     1
 ASSI { 2516}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 59   and name HB2 ))
      2.300     0.700     0.700 peak  2516 spectrum    1 weight  0.10000E+01 volume  0.82269E-02 ppm1      0.824 ppm2      1.262 CV     1
 ASSI { 2520}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 50   and name HB  ))
      2.100     0.600     0.600 peak  2520 spectrum    1 weight  0.10000E+01 volume  0.74031E-02 ppm1      0.823 ppm2      2.152 CV     1
 ASSI { 2523}
   (( segid "    " and resid 59   and name HB3 ))
   (( segid "    " and resid 59   and name HA  ))
      3.200     1.300     1.300 peak  2523 spectrum    1 weight  0.10000E+01 volume  0.77994E-03 ppm1      1.392 ppm2      4.209 CV     1
 ASSI { 2524}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HA  ))
      3.600     1.700     1.700 peak  2524 spectrum    1 weight  0.10000E+01 volume  0.56139E-03 ppm1      1.267 ppm2      4.196 CV     1
 ASSI { 2525}
   (( segid "    " and resid 59   and name HA  ))
   (  segid "    " and resid 21   and name HE% )
      4.300     2.300     1.700 peak  2525 spectrum    1 weight  0.10000E+01 volume  0.69318E-03 ppm1      4.205 ppm2      6.868 CV     1
 OR { 2525}
   (( segid "    " and resid 59   and name HA  ))
   (  segid "    " and resid 21   and name HD% )
 ASSI { 2531}
   (( segid "    " and resid 59   and name HB3 ))
   (  segid "    " and resid 21   and name HD% )
      3.500     1.600     1.600 peak  2531 spectrum    1 weight  0.10000E+01 volume  0.47799E-03 ppm1      1.370 ppm2      6.869 CV     1
 OR { 2531}
   (( segid "    " and resid 59   and name HB3 ))
   (  segid "    " and resid 21   and name HE% )
 ASSI { 2532}
   (( segid "    " and resid 59   and name HB2 ))
   (  segid "    " and resid 21   and name HE% )
      4.600     2.600     1.400 peak  2532 spectrum    1 weight  0.10000E+01 volume  0.49267E-03 ppm1      1.261 ppm2      6.873 CV     1
 OR { 2532}
   (( segid "    " and resid 59   and name HB2 ))
   (  segid "    " and resid 21   and name HD% )
 ASSI { 2536}
   (  segid "    " and resid 59   and name HD1%)
   (  segid "    " and resid 21   and name HD% )
      2.700     0.900     0.900 peak  2536 spectrum    1 weight  0.10000E+01 volume  0.32958E-02 ppm1      0.826 ppm2      6.892 CV     1
 OR { 2536}
   (  segid "    " and resid 59   and name HD1%)
   (  segid "    " and resid 21   and name HE% )
 ASSI { 2543}
   (( segid "    " and resid 58   and name HA2 ))
   (( segid "    " and resid 58   and name H   ))
      2.800     1.000     1.000 peak  2543 spectrum    1 weight  0.10000E+01 volume  0.20659E-02 ppm1      3.909 ppm2      7.912 CV     1
 ASSI { 2544}
   (( segid "    " and resid 29   and name HA2 ))
   (  segid "    " and resid 27   and name HG2%)
      4.200     2.200     1.800 peak  2544 spectrum    1 weight  0.10000E+01 volume  0.83844E-03 ppm1      4.085 ppm2      0.911 CV     1
 ASSI { 2546}
   (( segid "    " and resid 58   and name HA2 ))
   (  segid "    " and resid 59   and name HD2%)
      5.600     3.900     0.400 peak  2546 spectrum    1 weight  0.10000E+01 volume  0.22361E-03 ppm1      3.917 ppm2      0.926 CV     1
 ASSI { 2548}
   (( segid "    " and resid 29   and name HA2 ))
   (( segid "    " and resid 28   and name HB2 ))
      4.400     2.400     1.600 peak  2548 spectrum    1 weight  0.10000E+01 volume  0.85014E-03 ppm1      4.082 ppm2      1.996 CV     1
 OR { 2548}
   (( segid "    " and resid 29   and name HA2 ))
   (( segid "    " and resid 28   and name HB3 ))
 ASSI { 2549}
   (( segid "    " and resid 29   and name HA2 ))
   (( segid "    " and resid 30   and name HG3 ))
      3.800     1.800     1.800 peak  2549 spectrum    1 weight  0.10000E+01 volume  0.90163E-03 ppm1      4.093 ppm2      2.254 CV     1
 ASSI { 2550}
   (( segid "    " and resid 58   and name HA2 ))
   (( segid "    " and resid 58   and name HA3 ))
      2.500     0.800     0.800 peak  2550 spectrum    1 weight  0.10000E+01 volume  0.23972E-02 ppm1      3.891 ppm2      4.050 CV     1
 ASSI { 2552}
   (( segid "    " and resid 58   and name HA2 ))
   (( segid "    " and resid 60   and name H   ))
      4.100     2.100     1.900 peak  2552 spectrum    1 weight  0.10000E+01 volume  0.34240E-03 ppm1      3.894 ppm2      7.062 CV     1
 ASSI { 2553}
   (( segid "    " and resid 29   and name HA2 ))
   (( segid "    " and resid 30   and name H   ))
      3.500     1.500     1.500 peak  2553 spectrum    1 weight  0.10000E+01 volume  0.89316E-03 ppm1      4.089 ppm2      7.488 CV     1
 ASSI { 2555}
   (( segid "    " and resid 58   and name HA2 ))
   (( segid "    " and resid 59   and name H   ))
      3.900     1.900     1.900 peak  2555 spectrum    1 weight  0.10000E+01 volume  0.57122E-03 ppm1      3.915 ppm2      7.666 CV     1
 ASSI { 2556}
   (( segid "    " and resid 29   and name HA2 ))
   (( segid "    " and resid 29   and name H   ))
      3.400     1.400     1.400 peak  2556 spectrum    1 weight  0.10000E+01 volume  0.65645E-03 ppm1      4.089 ppm2      8.847 CV     1
 ASSI { 2560}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 57   and name HA  ))
      3.000     1.100     1.100 peak  2560 spectrum    1 weight  0.10000E+01 volume  0.15189E-02 ppm1      2.161 ppm2      3.971 CV     1
 ASSI { 2561}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 54   and name HA  ))
      4.200     2.200     1.800 peak  2561 spectrum    1 weight  0.10000E+01 volume  0.36918E-03 ppm1      2.175 ppm2      3.694 CV     1
 ASSI { 2562}
   (( segid "    " and resid 57   and name HB2 ))
   (  segid "    " and resid 59   and name HD1%)
      4.900     3.000     1.100 peak  2562 spectrum    1 weight  0.10000E+01 volume  0.91826E-03 ppm1      2.164 ppm2      0.827 CV     1
 ASSI { 2563}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 57   and name HB3 ))
      2.200     0.600     0.600 peak  2563 spectrum    1 weight  0.10000E+01 volume  0.23612E-02 ppm1      2.158 ppm2      1.692 CV     1
 ASSI { 2564}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 57   and name HG2 ))
      2.800     0.900     0.900 peak  2564 spectrum    1 weight  0.10000E+01 volume  0.41755E-02 ppm1      2.159 ppm2      1.986 CV     1
 OR { 2564}
   (( segid "    " and resid 57   and name HB2 ))
   (  segid "    " and resid 57   and name HE% )
 ASSI { 2565}
   (( segid "    " and resid 55   and name HB  ))
   (  segid "    " and resid 55   and name HG1%)
      2.200     0.600     0.600 peak  2565 spectrum    1 weight  0.10000E+01 volume  0.98812E-02 ppm1      2.000 ppm2      0.804 CV     1
 OR { 2565}
   (( segid "    " and resid 55   and name HB  ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI { 2567}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 54   and name HD2%)
      5.300     3.500     0.700 peak  2567 spectrum    1 weight  0.10000E+01 volume  0.60760E-03 ppm1      3.967 ppm2      0.408 CV     1
 ASSI { 2570}
   (( segid "    " and resid 55   and name HB  ))
   (( segid "    " and resid 55   and name H   ))
      3.100     1.200     1.200 peak  2570 spectrum    1 weight  0.10000E+01 volume  0.27091E-02 ppm1      2.002 ppm2      7.490 CV     1
 ASSI { 2574}
   (( segid "    " and resid 11   and name HB3 ))
   (( segid "    " and resid 12   and name H   ))
      4.200     2.200     1.800 peak  2574 spectrum    1 weight  0.10000E+01 volume  0.89937E-03 ppm1      1.999 ppm2      8.968 CV     1
 ASSI { 2576}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 57   and name H   ))
      3.000     1.100     1.100 peak  2576 spectrum    1 weight  0.10000E+01 volume  0.14541E-02 ppm1      2.158 ppm2      7.864 CV     1
 ASSI { 2578}
   (  segid "    " and resid 57   and name HE% )
   (  segid "    " and resid 54   and name HD2%)
      2.600     0.900     0.900 peak  2578 spectrum    1 weight  0.10000E+01 volume  0.33247E-02 ppm1      1.986 ppm2      0.390 CV     1
 ASSI { 2579}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 18   and name HB2 ))
      3.000     1.100     1.100 peak  2579 spectrum    1 weight  0.10000E+01 volume  0.83030E-02 ppm1      1.986 ppm2      1.792 CV     1
 ASSI { 2581}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 59   and name HG  ))
      2.300     0.600     0.600 peak  2581 spectrum    1 weight  0.10000E+01 volume  0.46943E-02 ppm1      1.987 ppm2      1.479 CV     1
 ASSI { 2582}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 59   and name HB2 ))
      3.000     1.100     1.100 peak  2582 spectrum    1 weight  0.10000E+01 volume  0.16952E-02 ppm1      1.986 ppm2      1.257 CV     1
 ASSI { 2583}
   (  segid "    " and resid 57   and name HE% )
   (  segid "    " and resid 17   and name HD1%)
      2.000     2.000     4.000 peak  2583 spectrum    1 weight  0.10000E+01 volume  0.24002E-02 ppm1      1.987 ppm2      1.056 CV     1
 ASSI { 2584}
   (  segid "    " and resid 57   and name HE% )
   (  segid "    " and resid 59   and name HD2%)
      3.200     1.300     1.300 peak  2584 spectrum    1 weight  0.10000E+01 volume  0.77943E-02 ppm1      1.987 ppm2      0.937 CV     1
 ASSI { 2585}
   (  segid "    " and resid 57   and name HE% )
   (  segid "    " and resid 59   and name HD1%)
      1.800     0.400     0.400 peak  2585 spectrum    1 weight  0.10000E+01 volume  0.16196E-01 ppm1      1.987 ppm2      0.828 CV     1
 ASSI { 2587}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 53   and name HB3 ))
      2.900     1.100     1.100 peak  2587 spectrum    1 weight  0.10000E+01 volume  0.17880E-02 ppm1      1.987 ppm2      2.857 CV     1
 ASSI { 2588}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 18   and name HD3 ))
      2.800     1.000     1.000 peak  2588 spectrum    1 weight  0.10000E+01 volume  0.36977E-02 ppm1      1.987 ppm2      3.305 CV     1
 ASSI { 2589}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 59   and name HA  ))
      4.000     2.000     2.000 peak  2589 spectrum    1 weight  0.10000E+01 volume  0.14805E-02 ppm1      1.987 ppm2      4.202 CV     1
 ASSI { 2590}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 57   and name HA  ))
      2.900     1.100     1.100 peak  2590 spectrum    1 weight  0.10000E+01 volume  0.54993E-02 ppm1      1.987 ppm2      3.974 CV     1
 ASSI { 2591}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 18   and name HA  ))
      3.200     1.300     1.300 peak  2591 spectrum    1 weight  0.10000E+01 volume  0.27658E-02 ppm1      1.987 ppm2      3.796 CV     1
 ASSI { 2592}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 54   and name HA  ))
      2.800     1.000     1.000 peak  2592 spectrum    1 weight  0.10000E+01 volume  0.18518E-02 ppm1      1.986 ppm2      3.696 CV     1
 ASSI { 2593}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 53   and name HD2 ))
      2.400     2.400     3.600 peak  2593 spectrum    1 weight  0.10000E+01 volume  0.98367E-03 ppm1      1.988 ppm2      5.763 CV     1
 ASSI { 2595}
   (  segid "    " and resid 57   and name HE% )
   (  segid "    " and resid 21   and name HD% )
      4.800     2.900     1.200 peak  2595 spectrum    1 weight  0.10000E+01 volume  0.76745E-03 ppm1      1.986 ppm2      6.878 CV     1
 OR { 2595}
   (  segid "    " and resid 57   and name HE% )
   (  segid "    " and resid 21   and name HE% )
 ASSI { 2596}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 17   and name H   ))
      2.200     2.200     3.800 peak  2596 spectrum    1 weight  0.10000E+01 volume  0.13250E-02 ppm1      1.987 ppm2      8.732 CV     1
 ASSI { 2597}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 22   and name H   ))
      6.000     6.000     0.000 peak  2597 spectrum    1 weight  0.10000E+01 volume  0.13982E-03 ppm1      1.987 ppm2      8.549 CV     1
 ASSI { 2600}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 57   and name H   ))
      3.500     1.600     1.600 peak  2600 spectrum    1 weight  0.10000E+01 volume  0.22724E-02 ppm1      1.986 ppm2      7.867 CV     1
 ASSI { 2601}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 59   and name H   ))
      4.100     2.100     1.900 peak  2601 spectrum    1 weight  0.10000E+01 volume  0.79007E-03 ppm1      1.986 ppm2      7.663 CV     1
 ASSI { 2602}
   (( segid "    " and resid 56   and name HA  ))
   (  segid "    " and resid 55   and name HG2%)
      2.900     1.100     1.100 peak  2602 spectrum    1 weight  0.10000E+01 volume  0.40825E-02 ppm1      3.820 ppm2      0.818 CV     1
 OR { 2602}
   (( segid "    " and resid 56   and name HA  ))
   (  segid "    " and resid 55   and name HG1%)
 ASSI { 2603}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HB3 ))
      2.400     0.700     0.700 peak  2603 spectrum    1 weight  0.10000E+01 volume  0.61431E-02 ppm1      3.820 ppm2      1.850 CV     1
 ASSI { 2604}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HB2 ))
      2.700     0.900     0.900 peak  2604 spectrum    1 weight  0.10000E+01 volume  0.59924E-02 ppm1      3.820 ppm2      1.714 CV     1
 ASSI { 2605}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HG3 ))
      2.900     1.000     1.000 peak  2605 spectrum    1 weight  0.10000E+01 volume  0.49179E-02 ppm1      3.820 ppm2      2.130 CV     1
 ASSI { 2608}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 53   and name HA  ))
      2.200     0.600     0.600 peak  2608 spectrum    1 weight  0.10000E+01 volume  0.41714E-02 ppm1      1.716 ppm2      4.010 CV     1
 ASSI { 2610}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 56   and name HG2 ))
      2.300     0.700     0.700 peak  2610 spectrum    1 weight  0.10000E+01 volume  0.59966E-02 ppm1      1.847 ppm2      2.218 CV     1
 ASSI { 2611}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 56   and name HG3 ))
      2.700     0.900     0.900 peak  2611 spectrum    1 weight  0.10000E+01 volume  0.62037E-02 ppm1      1.846 ppm2      2.129 CV     1
 ASSI { 2612}
   (( segid "    " and resid 111  and name HG2 ))
   (  segid "    " and resid 102  and name HE% )
      2.400     0.700     0.700 peak  2612 spectrum    1 weight  0.10000E+01 volume  0.68362E-02 ppm1      1.702 ppm2      2.130 CV     1
 OR { 2612}
   (( segid "    " and resid 111  and name HG2 ))
   (( segid "    " and resid 102  and name HB2 ))
 ASSI { 2614}
   (( segid "    " and resid 56   and name HB3 ))
   (  segid "    " and resid 55   and name HG2%)
      4.000     2.000     2.000 peak  2614 spectrum    1 weight  0.10000E+01 volume  0.22955E-02 ppm1      1.846 ppm2      0.810 CV     1
 OR { 2614}
   (( segid "    " and resid 56   and name HB3 ))
   (  segid "    " and resid 55   and name HG1%)
 ASSI { 2615}
   (( segid "    " and resid 30   and name HG3 ))
   (  segid "    " and resid 27   and name HG2%)
      3.400     1.400     1.400 peak  2615 spectrum    1 weight  0.10000E+01 volume  0.40204E-02 ppm1      2.214 ppm2      0.885 CV     1
 ASSI { 2616}
   (( segid "    " and resid 30   and name HG2 ))
   (  segid "    " and resid 27   and name HG2%)
      3.300     1.400     1.400 peak  2616 spectrum    1 weight  0.10000E+01 volume  0.34184E-02 ppm1      2.151 ppm2      0.894 CV     1
 ASSI { 2618}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 56   and name HB2 ))
      2.200     0.600     0.600 peak  2618 spectrum    1 weight  0.10000E+01 volume  0.61214E-02 ppm1      2.123 ppm2      1.714 CV     1
 ASSI { 2619}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 56   and name HB2 ))
      2.700     0.900     0.900 peak  2619 spectrum    1 weight  0.10000E+01 volume  0.68527E-02 ppm1      2.221 ppm2      1.714 CV     1
 ASSI { 2626}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 52   and name HB2 ))
      5.700     4.100     0.300 peak  2626 spectrum    1 weight  0.10000E+01 volume  0.30491E-03 ppm1      2.122 ppm2      3.227 CV     1
 ASSI { 2627}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 35   and name HA  ))
      4.200     2.200     1.800 peak  2627 spectrum    1 weight  0.10000E+01 volume  0.89584E-03 ppm1      2.223 ppm2      4.150 CV     1
 ASSI { 2635}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 30   and name HE21))
      3.500     1.500     1.500 peak  2635 spectrum    1 weight  0.10000E+01 volume  0.20363E-02 ppm1      2.214 ppm2      7.036 CV     1
 ASSI { 2642}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 30   and name HE22))
      3.600     1.600     1.600 peak  2642 spectrum    1 weight  0.10000E+01 volume  0.35163E-02 ppm1      2.213 ppm2      7.754 CV     1
 ASSI { 2643}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 56   and name H   ))
      3.400     1.400     1.400 peak  2643 spectrum    1 weight  0.10000E+01 volume  0.34947E-02 ppm1      2.222 ppm2      8.073 CV     1
 ASSI { 2645}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 56   and name H   ))
      2.500     0.800     0.800 peak  2645 spectrum    1 weight  0.10000E+01 volume  0.29861E-02 ppm1      2.123 ppm2      8.073 CV     1
 ASSI { 2647}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 55   and name H   ))
      5.000     3.200     1.000 peak  2647 spectrum    1 weight  0.10000E+01 volume  0.87935E-03 ppm1      1.841 ppm2      7.485 CV     1
 ASSI { 2648}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 55   and name H   ))
      4.400     2.400     1.600 peak  2648 spectrum    1 weight  0.10000E+01 volume  0.58330E-03 ppm1      1.719 ppm2      7.492 CV     1
 ASSI { 2649}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 57   and name H   ))
      2.900     1.000     1.000 peak  2649 spectrum    1 weight  0.10000E+01 volume  0.20565E-02 ppm1      1.715 ppm2      7.865 CV     1
 ASSI { 2650}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 57   and name H   ))
      3.500     1.600     1.600 peak  2650 spectrum    1 weight  0.10000E+01 volume  0.20404E-02 ppm1      1.845 ppm2      7.865 CV     1
 ASSI { 2652}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name H   ))
      2.300     0.700     0.700 peak  2652 spectrum    1 weight  0.10000E+01 volume  0.36726E-02 ppm1      1.716 ppm2      8.074 CV     1
 ASSI { 2653}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 54   and name H   ))
      5.400     3.600     0.600 peak  2653 spectrum    1 weight  0.10000E+01 volume  0.45497E-03 ppm1      1.844 ppm2      8.289 CV     1
 ASSI { 2655}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 55   and name H   ))
      2.300     0.700     0.700 peak  2655 spectrum    1 weight  0.10000E+01 volume  0.40937E-02 ppm1      0.819 ppm2      7.491 CV     1
 ASSI { 2657}
   (  segid "    " and resid 55   and name HG1%)
   (  segid "    " and resid 60   and name HB% )
      2.500     0.800     0.800 peak  2657 spectrum    1 weight  0.10000E+01 volume  0.43573E-02 ppm1      0.821 ppm2      1.240 CV     1
 ASSI { 2661}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 61   and name HB2 ))
      4.400     2.400     1.600 peak  2661 spectrum    1 weight  0.10000E+01 volume  0.73607E-03 ppm1      0.819 ppm2      2.707 CV     1
 OR { 2661}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 61   and name HB3 ))
 ASSI { 2662}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 51   and name HA  ))
      4.300     2.300     1.700 peak  2662 spectrum    1 weight  0.10000E+01 volume  0.41256E-03 ppm1      0.820 ppm2      2.994 CV     1
 ASSI { 2666}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 56   and name HA  ))
      3.400     3.400     2.600 peak  2666 spectrum    1 weight  0.10000E+01 volume  0.34196E-02 ppm1      0.819 ppm2      3.822 CV     1
 ASSI { 2668}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 62   and name HA  ))
      3.300     1.400     1.400 peak  2668 spectrum    1 weight  0.10000E+01 volume  0.11489E-02 ppm1      0.781 ppm2      4.570 CV     1
 ASSI { 2669}
   (  segid "    " and resid 123  and name HD1%)
   (( segid "    " and resid 118  and name HA  ))
      3.500     1.500     1.500 peak  2669 spectrum    1 weight  0.10000E+01 volume  0.25090E-02 ppm1      0.795 ppm2      3.674 CV     1
 ASSI { 2671}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 54   and name H   ))
      4.200     2.200     1.800 peak  2671 spectrum    1 weight  0.10000E+01 volume  0.10066E-02 ppm1      0.821 ppm2      8.288 CV     1
 ASSI { 2672}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 56   and name H   ))
      3.300     1.400     1.400 peak  2672 spectrum    1 weight  0.10000E+01 volume  0.31079E-02 ppm1      0.819 ppm2      8.072 CV     1
 ASSI { 2675}
   (  segid "    " and resid 55   and name HG1%)
   (  segid "    " and resid 66   and name HD% )
      4.200     2.200     1.800 peak  2675 spectrum    1 weight  0.10000E+01 volume  0.76042E-03 ppm1      0.821 ppm2      7.295 CV     1
 ASSI { 2677}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 66   and name HZ  ))
      3.700     1.700     1.700 peak  2677 spectrum    1 weight  0.10000E+01 volume  0.51881E-03 ppm1      0.821 ppm2      6.945 CV     1
 ASSI { 2678}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 55   and name H   ))
      3.200     1.300     1.300 peak  2678 spectrum    1 weight  0.10000E+01 volume  0.37015E-03 ppm1      0.740 ppm2      7.486 CV     1
 ASSI { 2680}
   (( segid "    " and resid 118  and name HA  ))
   (  segid "    " and resid 118  and name HD1%)
      2.400     0.700     0.700 peak  2680 spectrum    1 weight  0.10000E+01 volume  0.30984E-02 ppm1      3.657 ppm2      0.511 CV     1
 ASSI { 2682}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 54   and name HD2%)
      2.200     0.600     0.600 peak  2682 spectrum    1 weight  0.10000E+01 volume  0.49224E-02 ppm1      3.677 ppm2      0.395 CV     1
 ASSI { 2686}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HA  ))
      3.600     1.600     1.600 peak  2686 spectrum    1 weight  0.10000E+01 volume  0.53013E-03 ppm1      0.743 ppm2      3.681 CV     1
 ASSI { 2687}
   (( segid "    " and resid 54   and name HB2 ))
   (  segid "    " and resid 54   and name HD1%)
      2.800     1.000     1.000 peak  2687 spectrum    1 weight  0.10000E+01 volume  0.21923E-02 ppm1      0.740 ppm2      0.413 CV     1
 OR { 2687}
   (( segid "    " and resid 54   and name HB2 ))
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 2689}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HG  ))
      3.200     1.300     1.300 peak  2689 spectrum    1 weight  0.10000E+01 volume  0.55114E-03 ppm1      0.750 ppm2      1.736 CV     1
 ASSI { 2692}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HB3 ))
      2.300     0.700     0.700 peak  2692 spectrum    1 weight  0.10000E+01 volume  0.10359E-02 ppm1      0.726 ppm2      1.935 CV     1
 ASSI { 2693}
   (( segid "    " and resid 54   and name HG  ))
   (  segid "    " and resid 54   and name HD1%)
      2.300     0.600     0.600 peak  2693 spectrum    1 weight  0.10000E+01 volume  0.44897E-02 ppm1      1.726 ppm2      0.425 CV     1
 OR { 2693}
   (( segid "    " and resid 54   and name HG  ))
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 2694}
   (( segid "    " and resid 54   and name HG  ))
   (( segid "    " and resid 54   and name HA  ))
      3.300     1.400     1.400 peak  2694 spectrum    1 weight  0.10000E+01 volume  0.10238E-02 ppm1      1.717 ppm2      3.671 CV     1
 ASSI { 2695}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 33   and name HB  ))
      3.600     1.600     1.600 peak  2695 spectrum    1 weight  0.10000E+01 volume  0.50940E-03 ppm1      0.440 ppm2      2.304 CV     1
 ASSI { 2697}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 54   and name HB3 ))
      2.500     0.800     0.800 peak  2697 spectrum    1 weight  0.10000E+01 volume  0.33537E-02 ppm1      0.437 ppm2      1.938 CV     1
 ASSI { 2698}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 54   and name HG  ))
      2.200     0.600     0.600 peak  2698 spectrum    1 weight  0.10000E+01 volume  0.53910E-02 ppm1      0.436 ppm2      1.726 CV     1
 ASSI { 2703}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 51   and name HA  ))
      2.700     0.900     0.900 peak  2703 spectrum    1 weight  0.10000E+01 volume  0.24318E-02 ppm1      0.436 ppm2      2.982 CV     1
 ASSI { 2705}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 54   and name HA  ))
      3.800     1.800     1.800 peak  2705 spectrum    1 weight  0.10000E+01 volume  0.17680E-02 ppm1      0.437 ppm2      3.679 CV     1
 ASSI { 2711}
   (  segid "    " and resid 54   and name HD2%)
   (  segid "    " and resid 17   and name HD1%)
      2.400     0.700     0.700 peak  2711 spectrum    1 weight  0.10000E+01 volume  0.71502E-02 ppm1      0.383 ppm2      1.051 CV     1
 ASSI { 2715}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 21   and name HB3 ))
      2.900     1.000     1.000 peak  2715 spectrum    1 weight  0.10000E+01 volume  0.21490E-02 ppm1      0.382 ppm2      3.029 CV     1
 OR { 2715}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 2716}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 59   and name HA  ))
      5.200     3.300     0.800 peak  2716 spectrum    1 weight  0.10000E+01 volume  0.44028E-03 ppm1      0.382 ppm2      4.202 CV     1
 ASSI { 2719}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 57   and name H   ))
      4.600     2.700     1.400 peak  2719 spectrum    1 weight  0.10000E+01 volume  0.56354E-03 ppm1      0.381 ppm2      7.864 CV     1
 ASSI { 2720}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 21   and name H   ))
      4.300     2.300     1.700 peak  2720 spectrum    1 weight  0.10000E+01 volume  0.58393E-03 ppm1      0.381 ppm2      8.935 CV     1
 ASSI { 2721}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 17   and name H   ))
      2.900     2.900     3.100 peak  2721 spectrum    1 weight  0.10000E+01 volume  0.27884E-03 ppm1      0.388 ppm2      8.776 CV     1
 ASSI { 2722}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 22   and name H   ))
      5.300     3.400     0.700 peak  2722 spectrum    1 weight  0.10000E+01 volume  0.36965E-03 ppm1      0.383 ppm2      8.554 CV     1
 ASSI { 2723}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 54   and name H   ))
      3.500     1.600     1.600 peak  2723 spectrum    1 weight  0.10000E+01 volume  0.21093E-02 ppm1      0.382 ppm2      8.296 CV     1
 ASSI { 2725}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 59   and name H   ))
      5.000     3.200     1.000 peak  2725 spectrum    1 weight  0.10000E+01 volume  0.51797E-03 ppm1      0.383 ppm2      7.666 CV     1
 ASSI { 2729}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 54   and name H   ))
      3.600     1.600     1.600 peak  2729 spectrum    1 weight  0.10000E+01 volume  0.23673E-02 ppm1      0.437 ppm2      8.294 CV     1
 ASSI { 2738}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 66   and name HZ  ))
      3.300     1.400     1.400 peak  2738 spectrum    1 weight  0.10000E+01 volume  0.42792E-03 ppm1      0.731 ppm2      6.928 CV     1
 ASSI { 2743}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 59   and name H   ))
      4.400     2.400     1.600 peak  2743 spectrum    1 weight  0.10000E+01 volume  0.28327E-03 ppm1      3.680 ppm2      7.670 CV     1
 ASSI { 2748}
   (( segid "    " and resid 52   and name HA  ))
   (  segid "    " and resid 55   and name HG2%)
      2.500     0.800     0.800 peak  2748 spectrum    1 weight  0.10000E+01 volume  0.53359E-02 ppm1      4.020 ppm2      0.794 CV     1
 OR { 2748}
   (( segid "    " and resid 52   and name HA  ))
   (  segid "    " and resid 55   and name HG1%)
 ASSI { 2749}
   (( segid "    " and resid 52   and name HA  ))
   (  segid "    " and resid 51   and name HG2%)
      2.900     1.100     1.100 peak  2749 spectrum    1 weight  0.10000E+01 volume  0.24812E-02 ppm1      4.019 ppm2      0.674 CV     1
 ASSI { 2751}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HB2 ))
      2.600     0.900     0.900 peak  2751 spectrum    1 weight  0.10000E+01 volume  0.41494E-02 ppm1      4.021 ppm2      3.236 CV     1
 ASSI { 2752}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HB3 ))
      2.400     0.700     0.700 peak  2752 spectrum    1 weight  0.10000E+01 volume  0.38498E-02 ppm1      4.021 ppm2      3.164 CV     1
 ASSI { 2758}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 13   and name HB3 ))
      3.300     1.400     1.400 peak  2758 spectrum    1 weight  0.10000E+01 volume  0.77736E-03 ppm1      2.885 ppm2      2.397 CV     1
 OR { 2758}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 13   and name HB3 ))
 OR { 2758}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 13   and name HB2 ))
 OR { 2758}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 13   and name HG2 ))
 OR { 2758}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 13   and name HG3 ))
 OR { 2758}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 13   and name HB2 ))
 ASSI { 2761}
   (( segid "    " and resid 53   and name HB3 ))
   (( segid "    " and resid 50   and name HA  ))
      5.400     3.600     0.600 peak  2761 spectrum    1 weight  0.10000E+01 volume  0.30022E-03 ppm1      2.885 ppm2      3.781 CV     1
 ASSI { 2765}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HD2 ))
      4.000     2.000     2.000 peak  2765 spectrum    1 weight  0.10000E+01 volume  0.33133E-03 ppm1      2.208 ppm2      5.760 CV     1
 ASSI { 2768}
   (( segid "    " and resid 53   and name HB3 ))
   (( segid "    " and resid 54   and name H   ))
      4.400     2.400     1.600 peak  2768 spectrum    1 weight  0.10000E+01 volume  0.43904E-03 ppm1      2.895 ppm2      8.290 CV     1
 ASSI { 2771}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HD2 ))
      3.100     1.200     1.200 peak  2771 spectrum    1 weight  0.10000E+01 volume  0.13165E-02 ppm1      4.018 ppm2      7.066 CV     1
 ASSI { 2773}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 55   and name H   ))
      3.100     1.200     1.200 peak  2773 spectrum    1 weight  0.10000E+01 volume  0.14072E-02 ppm1      4.019 ppm2      7.490 CV     1
 ASSI { 2777}
   (( segid "    " and resid 9    and name HE3 ))
   (( segid "    " and resid 13   and name H   ))
      5.200     3.400     0.800 peak  2777 spectrum    1 weight  0.10000E+01 volume  0.37751E-03 ppm1      7.070 ppm2      8.033 CV     1
 ASSI { 2778}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 52   and name HB2 ))
      2.900     1.000     1.000 peak  2778 spectrum    1 weight  0.10000E+01 volume  0.15395E-02 ppm1      7.070 ppm2      3.236 CV     1
 ASSI { 2779}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 52   and name HB3 ))
      3.400     1.400     1.400 peak  2779 spectrum    1 weight  0.10000E+01 volume  0.15049E-02 ppm1      7.070 ppm2      3.160 CV     1
 ASSI { 2781}
   (( segid "    " and resid 9    and name HE3 ))
   (( segid "    " and resid 9    and name HB2 ))
      3.000     1.100     1.100 peak  2781 spectrum    1 weight  0.10000E+01 volume  0.15660E-02 ppm1      7.072 ppm2      2.883 CV     1
 OR { 2781}
   (( segid "    " and resid 9    and name HE3 ))
   (( segid "    " and resid 9    and name HB3 ))
 ASSI { 2783}
   (( segid "    " and resid 9    and name HE3 ))
   (( segid "    " and resid 13   and name HG3 ))
      2.500     0.800     0.800 peak  2783 spectrum    1 weight  0.10000E+01 volume  0.21190E-02 ppm1      7.071 ppm2      2.400 CV     1
 OR { 2783}
   (( segid "    " and resid 9    and name HE3 ))
   (( segid "    " and resid 13   and name HB3 ))
 OR { 2783}
   (( segid "    " and resid 9    and name HE3 ))
   (( segid "    " and resid 13   and name HG2 ))
 OR { 2783}
   (( segid "    " and resid 9    and name HE3 ))
   (( segid "    " and resid 13   and name HB2 ))
 ASSI { 2787}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 48   and name HB2 ))
      3.300     1.400     1.400 peak  2787 spectrum    1 weight  0.10000E+01 volume  0.16563E-02 ppm1      7.071 ppm2      1.701 CV     1
 OR { 2787}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 48   and name HD2 ))
 ASSI { 2789}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 48   and name HG2 ))
      3.300     1.400     1.400 peak  2789 spectrum    1 weight  0.10000E+01 volume  0.11895E-02 ppm1      7.070 ppm2      1.339 CV     1
 ASSI { 2790}
   (( segid "    " and resid 52   and name HD2 ))
   (  segid "    " and resid 63   and name HG2%)
      3.500     1.500     1.500 peak  2790 spectrum    1 weight  0.10000E+01 volume  0.37169E-02 ppm1      7.070 ppm2      0.949 CV     1
 OR { 2790}
   (( segid "    " and resid 52   and name HD2 ))
   (  segid "    " and resid 63   and name HG1%)
 ASSI { 2792}
   (( segid "    " and resid 52   and name HD2 ))
   (  segid "    " and resid 51   and name HG2%)
      2.700     0.900     0.900 peak  2792 spectrum    1 weight  0.10000E+01 volume  0.20864E-02 ppm1      7.070 ppm2      0.673 CV     1
 ASSI { 2793}
   (( segid "    " and resid 52   and name HE1 ))
   (  segid "    " and resid 63   and name HG1%)
      4.200     2.200     1.800 peak  2793 spectrum    1 weight  0.10000E+01 volume  0.81103E-03 ppm1      7.824 ppm2      0.949 CV     1
 OR { 2793}
   (( segid "    " and resid 52   and name HE1 ))
   (  segid "    " and resid 63   and name HG2%)
 ASSI { 2796}
   (( segid "    " and resid 52   and name HE1 ))
   (( segid "    " and resid 48   and name HE3 ))
      3.800     1.800     1.800 peak  2796 spectrum    1 weight  0.10000E+01 volume  0.41225E-03 ppm1      7.827 ppm2      2.973 CV     1
 ASSI { 2797}
   (( segid "    " and resid 52   and name HE1 ))
   (  segid "    " and resid 55   and name HG2%)
      4.800     2.800     1.200 peak  2797 spectrum    1 weight  0.10000E+01 volume  0.27371E-03 ppm1      7.824 ppm2      0.804 CV     1
 OR { 2797}
   (( segid "    " and resid 52   and name HE1 ))
   (  segid "    " and resid 55   and name HG1%)
 ASSI { 2798}
   (( segid "    " and resid 52   and name HE1 ))
   (( segid "    " and resid 48   and name HG3 ))
      4.800     2.900     1.200 peak  2798 spectrum    1 weight  0.10000E+01 volume  0.24530E-03 ppm1      7.825 ppm2      1.512 CV     1
 ASSI { 2800}
   (( segid "    " and resid 52   and name HE1 ))
   (( segid "    " and resid 56   and name HG3 ))
      5.400     3.700     0.600 peak  2800 spectrum    1 weight  0.10000E+01 volume  0.28120E-03 ppm1      7.827 ppm2      2.127 CV     1
 ASSI { 2805}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 56   and name HB3 ))
      4.300     2.300     1.700 peak  2805 spectrum    1 weight  0.10000E+01 volume  0.90348E-03 ppm1      3.220 ppm2      1.856 CV     1
 ASSI { 2812}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HG13))
      2.700     0.900     0.900 peak  2812 spectrum    1 weight  0.10000E+01 volume  0.10593E-02 ppm1      2.979 ppm2      0.092 CV     1
 ASSI { 2817}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HB  ))
      3.200     1.300     1.300 peak  2817 spectrum    1 weight  0.10000E+01 volume  0.12070E-02 ppm1      2.980 ppm2      1.634 CV     1
 ASSI { 2818}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HG12))
      3.900     1.900     1.900 peak  2818 spectrum    1 weight  0.10000E+01 volume  0.12081E-02 ppm1      2.979 ppm2      1.507 CV     1
 ASSI { 2819}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 54   and name HB3 ))
      4.500     2.500     1.500 peak  2819 spectrum    1 weight  0.10000E+01 volume  0.59737E-03 ppm1      2.973 ppm2      1.963 CV     1
 ASSI { 2821}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 51   and name HG13))
      3.400     1.500     1.500 peak  2821 spectrum    1 weight  0.10000E+01 volume  0.72807E-03 ppm1      1.626 ppm2      0.090 CV     1
 ASSI { 2822}
   (( segid "    " and resid 51   and name HB  ))
   (  segid "    " and resid 54   and name HD1%)
      5.300     3.500     0.700 peak  2822 spectrum    1 weight  0.10000E+01 volume  0.30443E-03 ppm1      1.622 ppm2      0.435 CV     1
 ASSI { 2827}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 48   and name HA  ))
      3.000     1.100     1.100 peak  2827 spectrum    1 weight  0.10000E+01 volume  0.78763E-03 ppm1      1.623 ppm2      3.887 CV     1
 ASSI { 2828}
   (( segid "    " and resid 51   and name HG12))
   (( segid "    " and resid 51   and name HG13))
      2.400     0.700     0.700 peak  2828 spectrum    1 weight  0.10000E+01 volume  0.82386E-03 ppm1      1.499 ppm2      0.095 CV     1
 ASSI { 2832}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 92   and name HD2 ))
      3.100     1.200     1.200 peak  2832 spectrum    1 weight  0.10000E+01 volume  0.11010E-02 ppm1      1.475 ppm2      2.906 CV     1
 ASSI { 2833}
   (( segid "    " and resid 90   and name HB3 ))
   (( segid "    " and resid 90   and name HA  ))
      2.900     1.100     1.100 peak  2833 spectrum    1 weight  0.10000E+01 volume  0.20029E-02 ppm1      1.474 ppm2      3.745 CV     1
 ASSI { 2834}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 51   and name HG13))
      2.700     0.900     0.900 peak  2834 spectrum    1 weight  0.10000E+01 volume  0.34000E-02 ppm1      0.660 ppm2      0.094 CV     1
 ASSI { 2835}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 51   and name HG13))
      2.200     0.600     0.600 peak  2835 spectrum    1 weight  0.10000E+01 volume  0.51528E-02 ppm1      0.763 ppm2      0.094 CV     1
 ASSI { 2836}
   (  segid "    " and resid 51   and name HD1%)
   (  segid "    " and resid 54   and name HD1%)
      3.700     1.700     1.700 peak  2836 spectrum    1 weight  0.10000E+01 volume  0.20643E-02 ppm1      0.763 ppm2      0.441 CV     1
 ASSI { 2838}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 67   and name HG2 ))
      3.700     1.700     1.700 peak  2838 spectrum    1 weight  0.10000E+01 volume  0.83103E-03 ppm1      0.660 ppm2      2.390 CV     1
 OR { 2838}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 67   and name HG3 ))
 ASSI { 2839}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 63   and name HB  ))
      2.900     1.100     1.100 peak  2839 spectrum    1 weight  0.10000E+01 volume  0.36198E-02 ppm1      0.659 ppm2      2.210 CV     1
 ASSI { 2840}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 55   and name HB  ))
      3.800     1.800     1.800 peak  2840 spectrum    1 weight  0.10000E+01 volume  0.15319E-02 ppm1      0.660 ppm2      1.981 CV     1
 ASSI { 2842}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 51   and name HB  ))
      2.100     0.500     0.500 peak  2842 spectrum    1 weight  0.10000E+01 volume  0.74942E-02 ppm1      0.660 ppm2      1.626 CV     1
 ASSI { 2843}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 51   and name HG12))
      2.200     0.600     0.600 peak  2843 spectrum    1 weight  0.10000E+01 volume  0.56332E-02 ppm1      0.659 ppm2      1.516 CV     1
 ASSI { 2845}
   (  segid "    " and resid 51   and name HG2%)
   (  segid "    " and resid 60   and name HB% )
      3.900     1.900     1.900 peak  2845 spectrum    1 weight  0.10000E+01 volume  0.17929E-02 ppm1      0.660 ppm2      1.253 CV     1
 ASSI { 2848}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 52   and name HB2 ))
      3.900     1.900     1.900 peak  2848 spectrum    1 weight  0.10000E+01 volume  0.12032E-02 ppm1      0.660 ppm2      3.238 CV     1
 ASSI { 2849}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 52   and name HB3 ))
      4.200     2.200     1.800 peak  2849 spectrum    1 weight  0.10000E+01 volume  0.10868E-02 ppm1      0.659 ppm2      3.174 CV     1
 ASSI { 2850}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 51   and name HA  ))
      2.500     0.800     0.800 peak  2850 spectrum    1 weight  0.10000E+01 volume  0.51346E-02 ppm1      0.660 ppm2      2.974 CV     1
 ASSI { 2851}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 63   and name HA  ))
      2.200     0.600     0.600 peak  2851 spectrum    1 weight  0.10000E+01 volume  0.51575E-02 ppm1      0.660 ppm2      3.959 CV     1
 ASSI { 2854}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 66   and name HA  ))
      5.500     3.700     0.500 peak  2854 spectrum    1 weight  0.10000E+01 volume  0.28978E-03 ppm1      0.767 ppm2      4.582 CV     1
 ASSI { 2855}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 48   and name HA  ))
      2.600     0.900     0.900 peak  2855 spectrum    1 weight  0.10000E+01 volume  0.34596E-02 ppm1      0.764 ppm2      3.889 CV     1
 ASSI { 2856}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 47   and name HA  ))
      3.800     1.800     1.800 peak  2856 spectrum    1 weight  0.10000E+01 volume  0.11463E-02 ppm1      0.765 ppm2      3.739 CV     1
 ASSI { 2857}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 33   and name HA  ))
      4.800     2.800     1.200 peak  2857 spectrum    1 weight  0.10000E+01 volume  0.49426E-03 ppm1      0.765 ppm2      3.588 CV     1
 ASSI { 2858}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 66   and name HB3 ))
      3.500     1.500     1.500 peak  2858 spectrum    1 weight  0.10000E+01 volume  0.21202E-02 ppm1      0.764 ppm2      3.360 CV     1
 ASSI { 2860}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 51   and name HA  ))
      2.800     1.000     1.000 peak  2860 spectrum    1 weight  0.10000E+01 volume  0.37497E-02 ppm1      0.764 ppm2      2.967 CV     1
 ASSI { 2861}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 33   and name HB  ))
      3.900     1.900     1.900 peak  2861 spectrum    1 weight  0.10000E+01 volume  0.11398E-02 ppm1      0.762 ppm2      2.362 CV     1
 ASSI { 2864}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 51   and name HB  ))
      2.200     0.600     0.600 peak  2864 spectrum    1 weight  0.10000E+01 volume  0.73428E-02 ppm1      0.764 ppm2      1.631 CV     1
 ASSI { 2865}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 51   and name HG12))
      2.100     0.500     0.500 peak  2865 spectrum    1 weight  0.10000E+01 volume  0.81998E-02 ppm1      0.764 ppm2      1.495 CV     1
 ASSI { 2866}
   (  segid "    " and resid 51   and name HD1%)
   (  segid "    " and resid 32   and name HG1%)
      3.300     3.300     2.700 peak  2866 spectrum    1 weight  0.10000E+01 volume  0.21675E-02 ppm1      0.764 ppm2      1.334 CV     1
 ASSI { 2867}
   (  segid "    " and resid 51   and name HD1%)
   (  segid "    " and resid 33   and name HG2%)
      2.000     0.500     0.500 peak  2867 spectrum    1 weight  0.10000E+01 volume  0.14798E-01 ppm1      0.767 ppm2      0.943 CV     1
 OR { 2867}
   (  segid "    " and resid 51   and name HD1%)
   (  segid "    " and resid 33   and name HG1%)
 ASSI { 2876}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 56   and name HE21))
      4.700     2.700     1.300 peak  2876 spectrum    1 weight  0.10000E+01 volume  0.74447E-03 ppm1      0.660 ppm2      7.397 CV     1
 ASSI { 2881}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 63   and name H   ))
      4.400     2.400     1.600 peak  2881 spectrum    1 weight  0.10000E+01 volume  0.56494E-03 ppm1      0.657 ppm2      8.663 CV     1
 ASSI { 2882}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 51   and name H   ))
      2.300     0.700     0.700 peak  2882 spectrum    1 weight  0.10000E+01 volume  0.49028E-02 ppm1      0.764 ppm2      8.214 CV     1
 ASSI { 2884}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 67   and name H   ))
      5.500     3.700     0.500 peak  2884 spectrum    1 weight  0.10000E+01 volume  0.35805E-03 ppm1      0.761 ppm2      7.781 CV     1
 ASSI { 2886}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 66   and name H   ))
      5.100     3.200     0.900 peak  2886 spectrum    1 weight  0.10000E+01 volume  0.59231E-03 ppm1      0.763 ppm2      7.513 CV     1
 ASSI { 2887}
   (  segid "    " and resid 51   and name HD1%)
   (  segid "    " and resid 66   and name HD% )
      3.700     1.700     1.700 peak  2887 spectrum    1 weight  0.10000E+01 volume  0.20080E-02 ppm1      0.764 ppm2      7.292 CV     1
 ASSI { 2889}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 67   and name HE22))
      4.000     2.000     2.000 peak  2889 spectrum    1 weight  0.10000E+01 volume  0.50922E-03 ppm1      0.764 ppm2      6.933 CV     1
 ASSI { 2890}
   (( segid "    " and resid 51   and name HG13))
   (  segid "    " and resid 54   and name HD1%)
      4.500     2.600     1.500 peak  2890 spectrum    1 weight  0.10000E+01 volume  0.34503E-03 ppm1      0.095 ppm2      0.437 CV     1
 ASSI { 2893}
   (( segid "    " and resid 51   and name HG13))
   (  segid "    " and resid 33   and name HG2%)
      2.800     1.000     1.000 peak  2893 spectrum    1 weight  0.10000E+01 volume  0.12922E-02 ppm1      0.087 ppm2      0.942 CV     1
 OR { 2893}
   (( segid "    " and resid 51   and name HG13))
   (  segid "    " and resid 33   and name HG1%)
 ASSI { 2898}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 54   and name HD1%)
      4.300     2.300     1.700 peak  2898 spectrum    1 weight  0.10000E+01 volume  0.48593E-03 ppm1      3.781 ppm2      0.413 CV     1
 OR { 2898}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 2899}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 9    and name HZ2 ))
      3.500     1.500     1.500 peak  2899 spectrum    1 weight  0.10000E+01 volume  0.99216E-03 ppm1      3.785 ppm2      6.916 CV     1
 ASSI { 2900}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 9    and name HH2 ))
      4.400     2.500     1.600 peak  2900 spectrum    1 weight  0.10000E+01 volume  0.65552E-03 ppm1      3.787 ppm2      6.717 CV     1
 ASSI { 2902}
   (( segid "    " and resid 50   and name HB  ))
   (  segid "    " and resid 54   and name HD1%)
      4.700     2.800     1.300 peak  2902 spectrum    1 weight  0.10000E+01 volume  0.34158E-03 ppm1      2.180 ppm2      0.447 CV     1
 ASSI { 2903}
   (( segid "    " and resid 50   and name HB  ))
   (  segid "    " and resid 50   and name HG2%)
      2.100     0.600     0.600 peak  2903 spectrum    1 weight  0.10000E+01 volume  0.67429E-02 ppm1      2.184 ppm2      0.918 CV     1
 OR { 2903}
   (( segid "    " and resid 50   and name HB  ))
   (  segid "    " and resid 50   and name HD1%)
 ASSI { 2904}
   (( segid "    " and resid 127  and name HG3 ))
   (  segid "    " and resid 124  and name HG1%)
      5.600     4.000     0.400 peak  2904 spectrum    1 weight  0.10000E+01 volume  0.30219E-03 ppm1      1.548 ppm2      0.525 CV     1
 ASSI { 2905}
   (( segid "    " and resid 127  and name HG3 ))
   (  segid "    " and resid 119  and name HD1%)
      3.000     1.100     1.100 peak  2905 spectrum    1 weight  0.10000E+01 volume  0.14926E-02 ppm1      1.555 ppm2      0.668 CV     1
 ASSI { 2908}
   (( segid "    " and resid 103  and name HD3 ))
   (( segid "    " and resid 103  and name HB3 ))
      2.200     0.600     0.600 peak  2908 spectrum    1 weight  0.10000E+01 volume  0.13895E-01 ppm1      1.558 ppm2      1.793 CV     1
 OR { 2908}
   (( segid "    " and resid 103  and name HD3 ))
   (( segid "    " and resid 103  and name HB2 ))
 OR { 2908}
   (( segid "    " and resid 103  and name HD2 ))
   (( segid "    " and resid 103  and name HB3 ))
 OR { 2908}
   (( segid "    " and resid 103  and name HD2 ))
   (( segid "    " and resid 103  and name HB2 ))
 ASSI { 2911}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 51   and name HG13))
      4.100     2.100     1.900 peak  2911 spectrum    1 weight  0.10000E+01 volume  0.87206E-03 ppm1      0.918 ppm2      0.101 CV     1
 ASSI { 2912}
   (  segid "    " and resid 50   and name HG2%)
   (  segid "    " and resid 54   and name HD1%)
      2.100     0.600     0.600 peak  2912 spectrum    1 weight  0.10000E+01 volume  0.79476E-02 ppm1      0.914 ppm2      0.432 CV     1
 ASSI { 2916}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 51   and name HA  ))
      2.900     1.100     1.100 peak  2916 spectrum    1 weight  0.10000E+01 volume  0.17318E-02 ppm1      0.916 ppm2      2.977 CV     1
 ASSI { 2918}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 33   and name HA  ))
      3.000     1.200     1.200 peak  2918 spectrum    1 weight  0.10000E+01 volume  0.21001E-02 ppm1      0.916 ppm2      3.591 CV     1
 ASSI { 2919}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 9    and name HE1 ))
      2.700     2.700     3.300 peak  2919 spectrum    1 weight  0.10000E+01 volume  0.40962E-03 ppm1      0.890 ppm2      0.099 CV     1
 ASSI { 2920}
   (  segid "    " and resid 50   and name HD1%)
   (  segid "    " and resid 54   and name HD1%)
      2.100     2.100     3.900 peak  2920 spectrum    1 weight  0.10000E+01 volume  0.17841E-02 ppm1      0.892 ppm2      0.421 CV     1
 OR { 2920}
   (  segid "    " and resid 50   and name HD1%)
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 2924}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 37   and name HB3 ))
      2.500     0.800     0.800 peak  2924 spectrum    1 weight  0.10000E+01 volume  0.35460E-02 ppm1      0.890 ppm2      1.879 CV     1
 ASSI { 2927}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 45   and name HG3 ))
      2.400     0.700     0.700 peak  2927 spectrum    1 weight  0.10000E+01 volume  0.30833E-02 ppm1      0.890 ppm2      1.394 CV     1
 ASSI { 2931}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 37   and name HA  ))
      3.000     1.200     1.200 peak  2931 spectrum    1 weight  0.10000E+01 volume  0.24939E-02 ppm1      0.890 ppm2      3.938 CV     1
 ASSI { 2932}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 50   and name HA  ))
      2.600     0.800     0.800 peak  2932 spectrum    1 weight  0.10000E+01 volume  0.53569E-02 ppm1      0.890 ppm2      3.772 CV     1
 ASSI { 2934}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 49   and name HA  ))
      3.100     1.200     1.200 peak  2934 spectrum    1 weight  0.10000E+01 volume  0.20339E-03 ppm1      0.887 ppm2      4.207 CV     1
 ASSI { 2935}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 45   and name HE  ))
      3.500     1.500     1.500 peak  2935 spectrum    1 weight  0.10000E+01 volume  0.46748E-03 ppm1      0.892 ppm2      7.094 CV     1
 ASSI { 2936}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 9    and name HZ2 ))
      3.000     1.100     1.100 peak  2936 spectrum    1 weight  0.10000E+01 volume  0.21297E-02 ppm1      0.890 ppm2      6.914 CV     1
 ASSI { 2937}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 9    and name HH2 ))
      3.000     1.100     1.100 peak  2937 spectrum    1 weight  0.10000E+01 volume  0.28741E-02 ppm1      0.891 ppm2      6.717 CV     1
 ASSI { 2940}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 40   and name H   ))
      2.900     2.900     3.100 peak  2940 spectrum    1 weight  0.10000E+01 volume  0.27558E-03 ppm1      0.888 ppm2      7.866 CV     1
 ASSI { 2943}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 37   and name H   ))
      2.400     2.400     3.600 peak  2943 spectrum    1 weight  0.10000E+01 volume  0.92296E-03 ppm1      0.891 ppm2      8.584 CV     1
 ASSI { 2946}
   (( segid "    " and resid 50   and name HB  ))
   (( segid "    " and resid 49   and name H   ))
      4.100     2.100     1.900 peak  2946 spectrum    1 weight  0.10000E+01 volume  0.57310E-03 ppm1      2.180 ppm2      7.713 CV     1
 ASSI { 2955}
   (  segid "    " and resid 50   and name HG2%)
   (  segid "    " and resid 66   and name HD% )
      4.700     2.800     1.300 peak  2955 spectrum    1 weight  0.10000E+01 volume  0.63736E-03 ppm1      0.920 ppm2      7.285 CV     1
 ASSI { 2960}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 21   and name H   ))
      5.400     3.600     0.600 peak  2960 spectrum    1 weight  0.10000E+01 volume  0.25956E-03 ppm1      0.913 ppm2      8.934 CV     1
 ASSI { 2961}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 9    and name HH2 ))
      5.400     3.600     0.600 peak  2961 spectrum    1 weight  0.10000E+01 volume  0.83661E-03 ppm1      0.914 ppm2      6.723 CV     1
 ASSI { 2962}
   (( segid "    " and resid 82   and name HA  ))
   (  segid "    " and resid 82   and name HD2%)
      2.300     0.700     0.700 peak  2962 spectrum    1 weight  0.10000E+01 volume  0.75078E-02 ppm1      4.219 ppm2      0.955 CV     1
 ASSI { 2963}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 48   and name HG2 ))
      3.300     1.400     1.400 peak  2963 spectrum    1 weight  0.10000E+01 volume  0.80088E-03 ppm1      4.213 ppm2      1.335 CV     1
 ASSI { 2964}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HB3 ))
      3.000     1.100     1.100 peak  2964 spectrum    1 weight  0.10000E+01 volume  0.32256E-02 ppm1      4.216 ppm2      1.703 CV     1
 ASSI { 2965}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HG2 ))
      2.900     1.100     1.100 peak  2965 spectrum    1 weight  0.10000E+01 volume  0.29409E-02 ppm1      4.216 ppm2      2.563 CV     1
 ASSI { 2966}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 52   and name HB2 ))
      2.900     1.000     1.000 peak  2966 spectrum    1 weight  0.10000E+01 volume  0.11426E-02 ppm1      4.214 ppm2      3.232 CV     1
 ASSI { 2967}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 52   and name HB3 ))
      4.000     2.000     2.000 peak  2967 spectrum    1 weight  0.10000E+01 volume  0.12320E-02 ppm1      4.213 ppm2      3.161 CV     1
 ASSI { 2971}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 49   and name HA  ))
      3.000     1.100     1.100 peak  2971 spectrum    1 weight  0.10000E+01 volume  0.19306E-02 ppm1      2.206 ppm2      4.186 CV     1
 OR { 2971}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI { 2972}
   (( segid "    " and resid 49   and name HG2 ))
   (  segid "    " and resid 46   and name HG2%)
      4.100     2.100     1.900 peak  2972 spectrum    1 weight  0.10000E+01 volume  0.37690E-03 ppm1      2.557 ppm2      1.209 CV     1
 ASSI { 2973}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 45   and name HG3 ))
      4.400     2.400     1.600 peak  2973 spectrum    1 weight  0.10000E+01 volume  0.44520E-03 ppm1      2.567 ppm2      1.338 CV     1
 ASSI { 2974}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 45   and name HB3 ))
      3.600     1.600     1.600 peak  2974 spectrum    1 weight  0.10000E+01 volume  0.53411E-03 ppm1      2.550 ppm2      1.702 CV     1
 OR { 2974}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 2980}
   (( segid "    " and resid 19   and name HB3 ))
   (( segid "    " and resid 16   and name HD2 ))
      3.100     1.200     1.200 peak  2980 spectrum    1 weight  0.10000E+01 volume  0.66393E-03 ppm1      2.225 ppm2      7.296 CV     1
 ASSI { 2983}
   (( segid "    " and resid 19   and name HB3 ))
   (( segid "    " and resid 20   and name H   ))
      2.500     0.800     0.800 peak  2983 spectrum    1 weight  0.10000E+01 volume  0.18922E-02 ppm1      2.233 ppm2      8.666 CV     1
 ASSI { 2984}
   (( segid "    " and resid 19   and name HB3 ))
   (( segid "    " and resid 21   and name H   ))
      4.500     2.500     1.500 peak  2984 spectrum    1 weight  0.10000E+01 volume  0.45255E-03 ppm1      2.231 ppm2      8.930 CV     1
 ASSI { 2991}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HB2 ))
      2.300     0.700     0.700 peak  2991 spectrum    1 weight  0.10000E+01 volume  0.56142E-02 ppm1      3.885 ppm2      1.710 CV     1
 OR { 2991}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HD3 ))
 ASSI { 2994}
   (( segid "    " and resid 69   and name HB2 ))
   (  segid "    " and resid 63   and name HG1%)
      2.800     1.000     1.000 peak  2994 spectrum    1 weight  0.10000E+01 volume  0.21324E-02 ppm1      1.876 ppm2      0.945 CV     1
 OR { 2994}
   (( segid "    " and resid 69   and name HB2 ))
   (  segid "    " and resid 63   and name HG2%)
 OR { 2994}
   (( segid "    " and resid 69   and name HB3 ))
   (  segid "    " and resid 63   and name HG1%)
 ASSI { 2996}
   (( segid "    " and resid 69   and name HB3 ))
   (  segid "    " and resid 71   and name HG2%)
      3.700     1.700     1.700 peak  2996 spectrum    1 weight  0.10000E+01 volume  0.92532E-03 ppm1      1.874 ppm2      1.180 CV     1
 OR { 2996}
   (( segid "    " and resid 69   and name HB2 ))
   (  segid "    " and resid 71   and name HG2%)
 ASSI { 2997}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 48   and name HG2 ))
      2.400     0.700     0.700 peak  2997 spectrum    1 weight  0.10000E+01 volume  0.38525E-02 ppm1      1.873 ppm2      1.338 CV     1
 ASSI { 3000}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 48   and name HA  ))
      2.900     1.000     1.000 peak  3000 spectrum    1 weight  0.10000E+01 volume  0.35815E-02 ppm1      1.873 ppm2      3.887 CV     1
 ASSI { 3002}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 48   and name HA  ))
      3.100     1.200     1.200 peak  3002 spectrum    1 weight  0.10000E+01 volume  0.23651E-02 ppm1      1.336 ppm2      3.887 CV     1
 ASSI { 3003}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 48   and name HE3 ))
      2.300     0.700     0.700 peak  3003 spectrum    1 weight  0.10000E+01 volume  0.60511E-02 ppm1      1.338 ppm2      2.971 CV     1
 OR { 3003}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 48   and name HE2 ))
 ASSI { 3005}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 48   and name HD2 ))
      2.100     0.500     0.500 peak  3005 spectrum    1 weight  0.10000E+01 volume  0.21933E-01 ppm1      1.338 ppm2      1.701 CV     1
 OR { 3005}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 48   and name HD3 ))
 OR { 3005}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 48   and name HB2 ))
 ASSI { 3008}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 49   and name HG2 ))
      4.200     2.200     1.800 peak  3008 spectrum    1 weight  0.10000E+01 volume  0.37098E-03 ppm1      1.331 ppm2      2.560 CV     1
 ASSI { 3009}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HG2 ))
      2.900     1.000     1.000 peak  3009 spectrum    1 weight  0.10000E+01 volume  0.41202E-02 ppm1      1.726 ppm2      1.340 CV     1
 ASSI { 3010}
   (( segid "    " and resid 48   and name HG2 ))
   (  segid "    " and resid 51   and name HG2%)
      4.300     2.400     1.700 peak  3010 spectrum    1 weight  0.10000E+01 volume  0.74611E-03 ppm1      1.342 ppm2      0.675 CV     1
 ASSI { 3012}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 52   and name HB2 ))
      3.500     1.500     1.500 peak  3012 spectrum    1 weight  0.10000E+01 volume  0.46655E-03 ppm1      1.337 ppm2      3.235 CV     1
 ASSI { 3015}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 52   and name HE1 ))
      4.600     2.600     1.400 peak  3015 spectrum    1 weight  0.10000E+01 volume  0.42940E-03 ppm1      1.334 ppm2      7.826 CV     1
 ASSI { 3017}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 48   and name H   ))
      3.900     1.900     1.900 peak  3017 spectrum    1 weight  0.10000E+01 volume  0.11303E-02 ppm1      1.338 ppm2      8.328 CV     1
 ASSI { 3029}
   (( segid "    " and resid 127  and name HG2 ))
   (  segid "    " and resid 119  and name HD1%)
      2.600     0.900     0.900 peak  3029 spectrum    1 weight  0.10000E+01 volume  0.15228E-02 ppm1      1.749 ppm2      0.664 CV     1
 ASSI { 3037}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 47   and name H   ))
      3.300     1.400     1.400 peak  3037 spectrum    1 weight  0.10000E+01 volume  0.15431E-02 ppm1      1.218 ppm2      9.006 CV     1
 ASSI { 3039}
   (( segid "    " and resid 46   and name HA  ))
   (  segid "    " and resid 46   and name HG2%)
      3.100     1.200     1.200 peak  3039 spectrum    1 weight  0.10000E+01 volume  0.36217E-02 ppm1      4.598 ppm2      1.214 CV     1
 ASSI { 3042}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 47   and name HA  ))
      5.600     3.900     0.400 peak  3042 spectrum    1 weight  0.10000E+01 volume  0.84903E-04 ppm1      4.596 ppm2      3.732 CV     1
 ASSI { 3043}
   (( segid "    " and resid 46   and name HB  ))
   (  segid "    " and resid 46   and name HG2%)
      2.600     0.900     0.900 peak  3043 spectrum    1 weight  0.10000E+01 volume  0.39382E-02 ppm1      4.712 ppm2      1.221 CV     1
 ASSI { 3047}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 49   and name HB2 ))
      3.300     1.400     1.400 peak  3047 spectrum    1 weight  0.10000E+01 volume  0.17873E-02 ppm1      1.222 ppm2      2.213 CV     1
 OR { 3047}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 49   and name HB3 ))
 ASSI { 3058}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 80   and name HE22))
      5.100     3.300     0.900 peak  3058 spectrum    1 weight  0.10000E+01 volume  0.47542E-03 ppm1      1.225 ppm2      6.602 CV     1
 ASSI { 3059}
   (( segid "    " and resid 45   and name HD2 ))
   (  segid "    " and resid 43   and name HG2%)
      3.100     1.200     1.200 peak  3059 spectrum    1 weight  0.10000E+01 volume  0.10157E-02 ppm1      2.311 ppm2      0.733 CV     1
 OR { 3059}
   (( segid "    " and resid 45   and name HD2 ))
   (  segid "    " and resid 43   and name HG1%)
 ASSI { 3060}
   (( segid "    " and resid 45   and name HD2 ))
   (  segid "    " and resid 50   and name HD1%)
      3.500     1.600     1.600 peak  3060 spectrum    1 weight  0.10000E+01 volume  0.19910E-02 ppm1      2.313 ppm2      0.906 CV     1
 ASSI { 3061}
   (( segid "    " and resid 45   and name HD2 ))
   (  segid "    " and resid 46   and name HG2%)
      3.800     1.800     1.800 peak  3061 spectrum    1 weight  0.10000E+01 volume  0.34163E-03 ppm1      2.312 ppm2      1.245 CV     1
 ASSI { 3062}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HG3 ))
      3.100     1.200     1.200 peak  3062 spectrum    1 weight  0.10000E+01 volume  0.13534E-02 ppm1      2.312 ppm2      1.369 CV     1
 ASSI { 3063}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HG2 ))
      2.900     1.000     1.000 peak  3063 spectrum    1 weight  0.10000E+01 volume  0.14694E-02 ppm1      2.312 ppm2      1.533 CV     1
 ASSI { 3064}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HB3 ))
      3.000     1.100     1.100 peak  3064 spectrum    1 weight  0.10000E+01 volume  0.14807E-02 ppm1      2.311 ppm2      1.668 CV     1
 OR { 3064}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 3065}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 43   and name HB  ))
      3.900     1.900     1.900 peak  3065 spectrum    1 weight  0.10000E+01 volume  0.27142E-03 ppm1      2.312 ppm2      1.908 CV     1
 ASSI { 3067}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HD3 ))
      2.100     0.500     0.500 peak  3067 spectrum    1 weight  0.10000E+01 volume  0.25243E-02 ppm1      2.311 ppm2      2.850 CV     1
 ASSI { 3069}
   (( segid "    " and resid 45   and name HD3 ))
   (( segid "    " and resid 45   and name HB3 ))
      3.300     1.400     1.400 peak  3069 spectrum    1 weight  0.10000E+01 volume  0.15839E-02 ppm1      2.853 ppm2      1.671 CV     1
 OR { 3069}
   (( segid "    " and resid 45   and name HD3 ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 3070}
   (( segid "    " and resid 45   and name HD3 ))
   (( segid "    " and resid 43   and name HB  ))
      4.000     2.000     2.000 peak  3070 spectrum    1 weight  0.10000E+01 volume  0.62303E-03 ppm1      2.837 ppm2      1.905 CV     1
 ASSI { 3071}
   (( segid "    " and resid 45   and name HD3 ))
   (( segid "    " and resid 45   and name HG3 ))
      2.900     1.000     1.000 peak  3071 spectrum    1 weight  0.10000E+01 volume  0.13480E-02 ppm1      2.847 ppm2      1.368 CV     1
 ASSI { 3072}
   (( segid "    " and resid 45   and name HD3 ))
   (  segid "    " and resid 50   and name HD1%)
      2.800     1.000     1.000 peak  3072 spectrum    1 weight  0.10000E+01 volume  0.15714E-02 ppm1      2.848 ppm2      0.904 CV     1
 ASSI { 3073}
   (( segid "    " and resid 45   and name HD3 ))
   (  segid "    " and resid 43   and name HG2%)
      3.400     1.400     1.400 peak  3073 spectrum    1 weight  0.10000E+01 volume  0.12734E-02 ppm1      2.850 ppm2      0.737 CV     1
 OR { 3073}
   (( segid "    " and resid 45   and name HD3 ))
   (  segid "    " and resid 43   and name HG1%)
 ASSI { 3075}
   (( segid "    " and resid 45   and name HG2 ))
   (( segid "    " and resid 45   and name HD3 ))
      3.300     1.300     1.300 peak  3075 spectrum    1 weight  0.10000E+01 volume  0.78941E-03 ppm1      1.526 ppm2      2.851 CV     1
 ASSI { 3077}
   (( segid "    " and resid 123  and name HG  ))
   (( segid "    " and resid 121  and name HB2 ))
      2.000     0.500     0.500 peak  3077 spectrum    1 weight  0.10000E+01 volume  0.59479E-02 ppm1      1.392 ppm2      1.631 CV     1
 ASSI { 3078}
   (( segid "    " and resid 45   and name HB2 ))
   (  segid "    " and resid 50   and name HD1%)
      2.800     1.000     1.000 peak  3078 spectrum    1 weight  0.10000E+01 volume  0.40041E-02 ppm1      1.686 ppm2      0.878 CV     1
 OR { 3078}
   (( segid "    " and resid 45   and name HB3 ))
   (  segid "    " and resid 50   and name HD1%)
 ASSI { 3079}
   (( segid "    " and resid 45   and name HG2 ))
   (( segid "    " and resid 45   and name HE  ))
      4.000     2.000     2.000 peak  3079 spectrum    1 weight  0.10000E+01 volume  0.70767E-03 ppm1      1.516 ppm2      7.104 CV     1
 ASSI { 3080}
   (( segid "    " and resid 45   and name HD3 ))
   (( segid "    " and resid 9    and name HZ2 ))
      3.500     1.500     1.500 peak  3080 spectrum    1 weight  0.10000E+01 volume  0.61604E-03 ppm1      2.849 ppm2      6.916 CV     1
 ASSI { 3081}
   (( segid "    " and resid 45   and name HD3 ))
   (( segid "    " and resid 53   and name HD2 ))
      4.700     2.800     1.300 peak  3081 spectrum    1 weight  0.10000E+01 volume  0.44141E-03 ppm1      2.857 ppm2      5.774 CV     1
 ASSI { 3082}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 53   and name HD2 ))
      4.500     2.600     1.500 peak  3082 spectrum    1 weight  0.10000E+01 volume  0.43062E-03 ppm1      2.309 ppm2      5.795 CV     1
 ASSI { 3083}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 9    and name HH2 ))
      4.100     2.100     1.900 peak  3083 spectrum    1 weight  0.10000E+01 volume  0.40231E-03 ppm1      2.317 ppm2      6.723 CV     1
 ASSI { 3084}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 9    and name HZ2 ))
      3.600     1.600     1.600 peak  3084 spectrum    1 weight  0.10000E+01 volume  0.66110E-03 ppm1      2.310 ppm2      6.913 CV     1
 ASSI { 3085}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HE  ))
      3.300     1.400     1.400 peak  3085 spectrum    1 weight  0.10000E+01 volume  0.78671E-03 ppm1      2.311 ppm2      7.102 CV     1
 ASSI { 3087}
   (( segid "    " and resid 45   and name HD3 ))
   (( segid "    " and resid 45   and name H   ))
      5.000     3.200     1.000 peak  3087 spectrum    1 weight  0.10000E+01 volume  0.29179E-03 ppm1      2.853 ppm2      8.104 CV     1
 ASSI { 3089}
   (( segid "    " and resid 45   and name HD3 ))
   (( segid "    " and resid 45   and name HE  ))
      3.000     1.100     1.100 peak  3089 spectrum    1 weight  0.10000E+01 volume  0.10530E-02 ppm1      2.851 ppm2      7.103 CV     1
 ASSI { 3090}
   (( segid "    " and resid 45   and name HD3 ))
   (( segid "    " and resid 9    and name HH2 ))
      3.700     1.700     1.700 peak  3090 spectrum    1 weight  0.10000E+01 volume  0.30484E-03 ppm1      2.841 ppm2      6.733 CV     1
 ASSI { 3093}
   (( segid "    " and resid 43   and name HB  ))
   (( segid "    " and resid 44   and name HD3 ))
      3.900     1.900     1.900 peak  3093 spectrum    1 weight  0.10000E+01 volume  0.19362E-02 ppm1      1.906 ppm2      3.733 CV     1
 ASSI { 3094}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 43   and name HG2%)
      3.900     1.900     1.900 peak  3094 spectrum    1 weight  0.10000E+01 volume  0.88488E-03 ppm1      4.376 ppm2      0.729 CV     1
 OR { 3094}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 43   and name HG1%)
 ASSI { 3095}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 50   and name HD1%)
      4.400     2.400     1.600 peak  3095 spectrum    1 weight  0.10000E+01 volume  0.82393E-03 ppm1      4.378 ppm2      0.852 CV     1
 ASSI { 3096}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 45   and name HG3 ))
      4.600     2.600     1.400 peak  3096 spectrum    1 weight  0.10000E+01 volume  0.64946E-03 ppm1      4.369 ppm2      1.324 CV     1
 ASSI { 3097}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HB2 ))
      2.700     0.900     0.900 peak  3097 spectrum    1 weight  0.10000E+01 volume  0.54326E-02 ppm1      4.375 ppm2      1.888 CV     1
 OR { 3097}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HG3 ))
 ASSI { 3098}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HG2 ))
      3.900     1.900     1.900 peak  3098 spectrum    1 weight  0.10000E+01 volume  0.14607E-02 ppm1      4.375 ppm2      2.058 CV     1
 ASSI { 3099}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HB3 ))
      2.400     0.700     0.700 peak  3099 spectrum    1 weight  0.10000E+01 volume  0.40981E-02 ppm1      4.375 ppm2      2.190 CV     1
 ASSI { 3100}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HD2 ))
      4.000     2.000     2.000 peak  3100 spectrum    1 weight  0.10000E+01 volume  0.78376E-03 ppm1      4.380 ppm2      3.547 CV     1
 ASSI { 3101}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HD3 ))
      3.600     1.600     1.600 peak  3101 spectrum    1 weight  0.10000E+01 volume  0.79162E-03 ppm1      4.382 ppm2      3.727 CV     1
 ASSI { 3102}
   (( segid "    " and resid 44   and name HB2 ))
   (  segid "    " and resid 43   and name HG2%)
      3.800     1.800     1.800 peak  3102 spectrum    1 weight  0.10000E+01 volume  0.18279E-02 ppm1      1.867 ppm2      0.763 CV     1
 OR { 3102}
   (( segid "    " and resid 44   and name HB2 ))
   (  segid "    " and resid 43   and name HG1%)
 ASSI { 3104}
   (( segid "    " and resid 44   and name HG2 ))
   (  segid "    " and resid 43   and name HG1%)
      3.800     1.800     1.800 peak  3104 spectrum    1 weight  0.10000E+01 volume  0.17179E-02 ppm1      2.055 ppm2      0.742 CV     1
 OR { 3104}
   (( segid "    " and resid 44   and name HG2 ))
   (  segid "    " and resid 43   and name HG2%)
 ASSI { 3105}
   (( segid "    " and resid 44   and name HG2 ))
   (( segid "    " and resid 44   and name HG3 ))
      1.600     0.300     0.600 peak  3105 spectrum    1 weight  0.10000E+01 volume  0.19671E-01 ppm1      2.056 ppm2      1.901 CV     1
 OR { 3105}
   (( segid "    " and resid 44   and name HG2 ))
   (( segid "    " and resid 44   and name HB2 ))
 ASSI { 3107}
   (( segid "    " and resid 44   and name HG2 ))
   (( segid "    " and resid 44   and name HD3 ))
      3.100     1.200     1.200 peak  3107 spectrum    1 weight  0.10000E+01 volume  0.34796E-02 ppm1      2.057 ppm2      3.732 CV     1
 ASSI { 3110}
   (( segid "    " and resid 44   and name HG3 ))
   (( segid "    " and resid 44   and name HD3 ))
      2.500     0.800     0.800 peak  3110 spectrum    1 weight  0.10000E+01 volume  0.30986E-02 ppm1      1.909 ppm2      3.735 CV     1
 ASSI { 3111}
   (( segid "    " and resid 44   and name HG3 ))
   (( segid "    " and resid 44   and name HG2 ))
      1.600     0.300     0.600 peak  3111 spectrum    1 weight  0.10000E+01 volume  0.16258E-01 ppm1      1.910 ppm2      2.053 CV     1
 ASSI { 3112}
   (( segid "    " and resid 44   and name HD3 ))
   (  segid "    " and resid 43   and name HG1%)
      3.500     1.500     1.500 peak  3112 spectrum    1 weight  0.10000E+01 volume  0.27879E-02 ppm1      3.731 ppm2      0.740 CV     1
 ASSI { 3113}
   (( segid "    " and resid 44   and name HD2 ))
   (  segid "    " and resid 43   and name HG1%)
      2.900     1.000     1.000 peak  3113 spectrum    1 weight  0.10000E+01 volume  0.41222E-02 ppm1      3.543 ppm2      0.739 CV     1
 OR { 3113}
   (( segid "    " and resid 44   and name HD2 ))
   (  segid "    " and resid 43   and name HG2%)
 ASSI { 3114}
   (( segid "    " and resid 44   and name HD3 ))
   (( segid "    " and resid 44   and name HB3 ))
      3.500     1.600     1.600 peak  3114 spectrum    1 weight  0.10000E+01 volume  0.89618E-03 ppm1      3.731 ppm2      2.185 CV     1
 ASSI { 3116}
   (( segid "    " and resid 44   and name HD3 ))
   (( segid "    " and resid 44   and name HG3 ))
      2.500     0.800     0.800 peak  3116 spectrum    1 weight  0.10000E+01 volume  0.43552E-02 ppm1      3.732 ppm2      1.903 CV     1
 OR { 3116}
   (( segid "    " and resid 44   and name HD3 ))
   (( segid "    " and resid 44   and name HB2 ))
 ASSI { 3118}
   (( segid "    " and resid 44   and name HD2 ))
   (( segid "    " and resid 44   and name HG2 ))
      2.400     0.700     0.700 peak  3118 spectrum    1 weight  0.10000E+01 volume  0.34092E-02 ppm1      3.542 ppm2      2.049 CV     1
 ASSI { 3120}
   (( segid "    " and resid 44   and name HD3 ))
   (( segid "    " and resid 44   and name HD2 ))
      2.000     0.500     0.500 peak  3120 spectrum    1 weight  0.10000E+01 volume  0.47320E-02 ppm1      3.732 ppm2      3.543 CV     1
 ASSI { 3121}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 7    and name HD2 ))
      1.700     0.400     0.500 peak  3121 spectrum    1 weight  0.10000E+01 volume  0.13187E-01 ppm1      3.552 ppm2      3.813 CV     1
 ASSI { 3126}
   (( segid "    " and resid 44   and name HD3 ))
   (( segid "    " and resid 45   and name H   ))
      3.000     3.000     3.000 peak  3126 spectrum    1 weight  0.10000E+01 volume  0.21096E-03 ppm1      3.728 ppm2      8.095 CV     1
 ASSI { 3128}
   (( segid "    " and resid 44   and name HG2 ))
   (( segid "    " and resid 45   and name H   ))
      2.600     2.600     3.400 peak  3128 spectrum    1 weight  0.10000E+01 volume  0.60419E-03 ppm1      2.054 ppm2      8.099 CV     1
 ASSI { 3129}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 114  and name H   ))
      3.500     1.500     1.500 peak  3129 spectrum    1 weight  0.10000E+01 volume  0.13098E-02 ppm1      1.907 ppm2      8.101 CV     1
 OR { 3129}
   (( segid "    " and resid 113  and name HG3 ))
   (( segid "    " and resid 114  and name H   ))
 ASSI { 3131}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 43   and name H   ))
      3.700     1.700     1.700 peak  3131 spectrum    1 weight  0.10000E+01 volume  0.49969E-03 ppm1      4.376 ppm2      7.992 CV     1
 ASSI { 3132}
   (( segid "    " and resid 43   and name HB  ))
   (( segid "    " and resid 43   and name H   ))
      3.000     1.100     1.100 peak  3132 spectrum    1 weight  0.10000E+01 volume  0.22542E-02 ppm1      1.905 ppm2      7.976 CV     1
 ASSI { 3134}
   (  segid "    " and resid 43   and name HG2%)
   (  segid "    " and resid 42   and name HG2%)
      2.400     0.700     0.700 peak  3134 spectrum    1 weight  0.10000E+01 volume  0.64745E-02 ppm1      0.713 ppm2      1.243 CV     1
 ASSI { 3135}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 13   and name HG2 ))
      3.400     1.400     1.400 peak  3135 spectrum    1 weight  0.10000E+01 volume  0.12808E-02 ppm1      0.714 ppm2      2.422 CV     1
 OR { 3135}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 13   and name HG3 ))
 ASSI { 3136}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 49   and name HB3 ))
      3.400     1.500     1.500 peak  3136 spectrum    1 weight  0.10000E+01 volume  0.25209E-02 ppm1      0.713 ppm2      2.236 CV     1
 OR { 3136}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 49   and name HG3 ))
 OR { 3136}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 49   and name HB2 ))
 ASSI { 3137}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 43   and name HB  ))
      2.000     0.500     0.500 peak  3137 spectrum    1 weight  0.10000E+01 volume  0.17965E-01 ppm1      0.713 ppm2      1.908 CV     1
 ASSI { 3138}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 45   and name HB3 ))
      3.300     1.300     1.300 peak  3138 spectrum    1 weight  0.10000E+01 volume  0.30743E-02 ppm1      0.713 ppm2      1.718 CV     1
 OR { 3138}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 3139}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 45   and name HG2 ))
      3.400     1.400     1.400 peak  3139 spectrum    1 weight  0.10000E+01 volume  0.21529E-02 ppm1      0.713 ppm2      1.520 CV     1
 ASSI { 3140}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 45   and name HG3 ))
      3.500     1.500     1.500 peak  3140 spectrum    1 weight  0.10000E+01 volume  0.20402E-02 ppm1      0.713 ppm2      1.364 CV     1
 ASSI { 3141}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 45   and name HD3 ))
      3.400     1.400     1.400 peak  3141 spectrum    1 weight  0.10000E+01 volume  0.10122E-02 ppm1      0.714 ppm2      2.850 CV     1
 ASSI { 3142}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 49   and name HB3 ))
      2.800     2.800     3.200 peak  3142 spectrum    1 weight  0.10000E+01 volume  0.32997E-02 ppm1      0.744 ppm2      2.233 CV     1
 OR { 3142}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 49   and name HG3 ))
 OR { 3142}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 49   and name HB2 ))
 ASSI { 3143}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 43   and name HB  ))
      2.000     0.500     0.500 peak  3143 spectrum    1 weight  0.10000E+01 volume  0.19007E-01 ppm1      0.744 ppm2      1.910 CV     1
 ASSI { 3145}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 45   and name HG2 ))
      3.500     1.500     1.500 peak  3145 spectrum    1 weight  0.10000E+01 volume  0.20859E-02 ppm1      0.744 ppm2      1.537 CV     1
 ASSI { 3147}
   (  segid "    " and resid 43   and name HG1%)
   (  segid "    " and resid 42   and name HG2%)
      2.700     0.900     0.900 peak  3147 spectrum    1 weight  0.10000E+01 volume  0.46273E-02 ppm1      0.744 ppm2      1.246 CV     1
 ASSI { 3149}
   (( segid "    " and resid 43   and name HB  ))
   (  segid "    " and resid 43   and name HG1%)
      2.000     0.500     0.500 peak  3149 spectrum    1 weight  0.10000E+01 volume  0.19255E-01 ppm1      1.905 ppm2      0.730 CV     1
 OR { 3149}
   (( segid "    " and resid 43   and name HB  ))
   (  segid "    " and resid 43   and name HG2%)
 ASSI { 3150}
   (( segid "    " and resid 43   and name HB  ))
   (  segid "    " and resid 42   and name HG2%)
      3.900     1.900     1.900 peak  3150 spectrum    1 weight  0.10000E+01 volume  0.90691E-03 ppm1      1.901 ppm2      1.244 CV     1
 ASSI { 3151}
   (( segid "    " and resid 43   and name HA  ))
   (  segid "    " and resid 43   and name HG1%)
      2.400     0.700     0.700 peak  3151 spectrum    1 weight  0.10000E+01 volume  0.85321E-02 ppm1      4.383 ppm2      0.736 CV     1
 OR { 3151}
   (( segid "    " and resid 43   and name HA  ))
   (  segid "    " and resid 43   and name HG2%)
 ASSI { 3153}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 44   and name HG2 ))
      4.300     2.300     1.700 peak  3153 spectrum    1 weight  0.10000E+01 volume  0.18167E-02 ppm1      4.382 ppm2      2.051 CV     1
 ASSI { 3154}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 44   and name HB3 ))
      4.300     2.300     1.700 peak  3154 spectrum    1 weight  0.10000E+01 volume  0.12813E-02 ppm1      4.379 ppm2      2.191 CV     1
 ASSI { 3155}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 44   and name HD3 ))
      2.600     0.800     0.800 peak  3155 spectrum    1 weight  0.10000E+01 volume  0.40676E-02 ppm1      4.384 ppm2      3.734 CV     1
 ASSI { 3156}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 44   and name HD2 ))
      2.400     0.700     0.700 peak  3156 spectrum    1 weight  0.10000E+01 volume  0.36684E-02 ppm1      4.382 ppm2      3.543 CV     1
 ASSI { 3157}
   (( segid "    " and resid 43   and name HB  ))
   (( segid "    " and resid 44   and name HD2 ))
      3.000     1.100     1.100 peak  3157 spectrum    1 weight  0.10000E+01 volume  0.23248E-02 ppm1      1.905 ppm2      3.543 CV     1
 ASSI { 3159}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 44   and name HD2 ))
      2.800     1.000     1.000 peak  3159 spectrum    1 weight  0.10000E+01 volume  0.48038E-02 ppm1      0.744 ppm2      3.544 CV     1
 ASSI { 3160}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 44   and name HD3 ))
      3.900     1.900     1.900 peak  3160 spectrum    1 weight  0.10000E+01 volume  0.19515E-02 ppm1      0.714 ppm2      3.736 CV     1
 ASSI { 3161}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 44   and name HD2 ))
      3.300     1.300     1.300 peak  3161 spectrum    1 weight  0.10000E+01 volume  0.25862E-02 ppm1      0.714 ppm2      3.545 CV     1
 ASSI { 3162}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 43   and name HA  ))
      2.500     0.800     0.800 peak  3162 spectrum    1 weight  0.10000E+01 volume  0.56857E-02 ppm1      0.744 ppm2      4.384 CV     1
 ASSI { 3164}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 43   and name HA  ))
      2.800     1.000     1.000 peak  3164 spectrum    1 weight  0.10000E+01 volume  0.44004E-02 ppm1      0.713 ppm2      4.384 CV     1
 ASSI { 3166}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 53   and name HD2 ))
      4.400     2.400     1.600 peak  3166 spectrum    1 weight  0.10000E+01 volume  0.57829E-03 ppm1      0.745 ppm2      5.776 CV     1
 ASSI { 3167}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 53   and name HD2 ))
      4.300     2.400     1.700 peak  3167 spectrum    1 weight  0.10000E+01 volume  0.59674E-03 ppm1      0.715 ppm2      5.798 CV     1
 ASSI { 3168}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 9    and name HH2 ))
      4.300     2.300     1.700 peak  3168 spectrum    1 weight  0.10000E+01 volume  0.23274E-03 ppm1      0.717 ppm2      6.721 CV     1
 ASSI { 3170}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 43   and name H   ))
      2.400     0.700     0.700 peak  3170 spectrum    1 weight  0.10000E+01 volume  0.60869E-02 ppm1      0.713 ppm2      7.976 CV     1
 ASSI { 3171}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 45   and name H   ))
      4.300     2.300     1.700 peak  3171 spectrum    1 weight  0.10000E+01 volume  0.74157E-03 ppm1      0.743 ppm2      8.099 CV     1
 ASSI { 3173}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 45   and name H   ))
      4.200     2.200     1.800 peak  3173 spectrum    1 weight  0.10000E+01 volume  0.69830E-03 ppm1      0.714 ppm2      8.095 CV     1
 ASSI { 3175}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 9    and name HZ2 ))
      4.800     2.900     1.200 peak  3175 spectrum    1 weight  0.10000E+01 volume  0.22789E-03 ppm1      0.753 ppm2      6.918 CV     1
 ASSI { 3176}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 9    and name HZ3 ))
      5.000     3.200     1.000 peak  3176 spectrum    1 weight  0.10000E+01 volume  0.16604E-03 ppm1      0.750 ppm2      6.832 CV     1
 ASSI { 3177}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 9    and name HH2 ))
      4.700     2.800     1.300 peak  3177 spectrum    1 weight  0.10000E+01 volume  0.21594E-03 ppm1      0.745 ppm2      6.726 CV     1
 ASSI { 3178}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 43   and name H   ))
      2.900     1.100     1.100 peak  3178 spectrum    1 weight  0.10000E+01 volume  0.29679E-02 ppm1      0.744 ppm2      7.976 CV     1
 ASSI { 3180}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 43   and name HG1%)
      3.700     1.700     1.700 peak  3180 spectrum    1 weight  0.10000E+01 volume  0.17585E-02 ppm1      4.202 ppm2      0.726 CV     1
 OR { 3180}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 43   and name HG2%)
 ASSI { 3181}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 40   and name HD2%)
      5.500     3.800     0.500 peak  3181 spectrum    1 weight  0.10000E+01 volume  0.28539E-03 ppm1      4.204 ppm2      0.982 CV     1
 OR { 3181}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 40   and name HD1%)
 ASSI { 3182}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 42   and name HG2%)
      2.700     0.900     0.900 peak  3182 spectrum    1 weight  0.10000E+01 volume  0.10549E-01 ppm1      4.203 ppm2      1.245 CV     1
 ASSI { 3185}
   (( segid "    " and resid 42   and name HB  ))
   (  segid "    " and resid 43   and name HG2%)
      3.500     1.500     1.500 peak  3185 spectrum    1 weight  0.10000E+01 volume  0.39392E-02 ppm1      4.199 ppm2      0.722 CV     1
 OR { 3185}
   (( segid "    " and resid 42   and name HB  ))
   (  segid "    " and resid 43   and name HG1%)
 ASSI { 3186}
   (( segid "    " and resid 42   and name HB  ))
   (  segid "    " and resid 40   and name HD2%)
      4.300     2.300     1.700 peak  3186 spectrum    1 weight  0.10000E+01 volume  0.74868E-03 ppm1      4.200 ppm2      0.967 CV     1
 OR { 3186}
   (( segid "    " and resid 42   and name HB  ))
   (  segid "    " and resid 40   and name HD1%)
 ASSI { 3187}
   (( segid "    " and resid 42   and name HB  ))
   (  segid "    " and resid 42   and name HG2%)
      1.900     0.500     0.500 peak  3187 spectrum    1 weight  0.10000E+01 volume  0.17575E-01 ppm1      4.200 ppm2      1.245 CV     1
 ASSI { 3189}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 13   and name HG3 ))
      3.800     1.800     1.800 peak  3189 spectrum    1 weight  0.10000E+01 volume  0.10052E-02 ppm1      4.201 ppm2      2.412 CV     1
 OR { 3189}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 13   and name HG2 ))
 ASSI { 3190}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name H   ))
      3.400     1.500     1.500 peak  3190 spectrum    1 weight  0.10000E+01 volume  0.80973E-03 ppm1      4.202 ppm2      8.172 CV     1
 ASSI { 3191}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 43   and name H   ))
      3.200     1.300     1.300 peak  3191 spectrum    1 weight  0.10000E+01 volume  0.21726E-02 ppm1      4.203 ppm2      7.977 CV     1
 ASSI { 3192}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 42   and name H   ))
      3.600     1.600     1.600 peak  3192 spectrum    1 weight  0.10000E+01 volume  0.75180E-03 ppm1      4.199 ppm2      8.171 CV     1
 ASSI { 3193}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 43   and name H   ))
      3.500     1.500     1.500 peak  3193 spectrum    1 weight  0.10000E+01 volume  0.33294E-02 ppm1      4.199 ppm2      7.976 CV     1
 ASSI { 3194}
   (  segid "    " and resid 60   and name HB% )
   (( segid "    " and resid 65   and name H   ))
      3.400     1.400     1.400 peak  3194 spectrum    1 weight  0.10000E+01 volume  0.20180E-02 ppm1      1.235 ppm2      7.671 CV     1
 ASSI { 3199}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 132  and name H   ))
      4.700     2.700     1.300 peak  3199 spectrum    1 weight  0.10000E+01 volume  0.72245E-03 ppm1      2.829 ppm2      7.868 CV     1
 ASSI { 3200}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 41   and name HB3 ))
      2.400     0.700     0.700 peak  3200 spectrum    1 weight  0.10000E+01 volume  0.97310E-02 ppm1      4.776 ppm2      2.804 CV     1
 OR { 3200}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 41   and name HB2 ))
 ASSI { 3201}
   (( segid "    " and resid 41   and name HB2 ))
   (  segid "    " and resid 42   and name HG2%)
      4.900     3.000     1.100 peak  3201 spectrum    1 weight  0.10000E+01 volume  0.50988E-03 ppm1      2.799 ppm2      1.257 CV     1
 OR { 3201}
   (( segid "    " and resid 41   and name HB3 ))
   (  segid "    " and resid 42   and name HG2%)
 ASSI { 3204}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 128  and name HG3 ))
      3.400     1.500     1.500 peak  3204 spectrum    1 weight  0.10000E+01 volume  0.11536E-02 ppm1      2.830 ppm2      1.628 CV     1
 OR { 3204}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 128  and name HG2 ))
 ASSI { 3206}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 42   and name HA  ))
      4.300     2.300     1.700 peak  3206 spectrum    1 weight  0.10000E+01 volume  0.49768E-03 ppm1      2.823 ppm2      4.192 CV     1
 OR { 3206}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 42   and name HA  ))
 OR { 3206}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 42   and name HB  ))
 OR { 3206}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 42   and name HB  ))
 ASSI { 3209}
   (( segid "    " and resid 40   and name HG  ))
   (( segid "    " and resid 40   and name H   ))
      3.400     1.500     1.500 peak  3209 spectrum    1 weight  0.10000E+01 volume  0.12573E-02 ppm1      1.889 ppm2      7.871 CV     1
 ASSI { 3210}
   (( segid "    " and resid 40   and name HA  ))
   (  segid "    " and resid 42   and name HG2%)
      4.000     2.000     2.000 peak  3210 spectrum    1 weight  0.10000E+01 volume  0.89925E-03 ppm1      4.437 ppm2      1.215 CV     1
 ASSI { 3211}
   (( segid "    " and resid 40   and name HB2 ))
   (  segid "    " and resid 20   and name HD2%)
      2.800     2.800     3.200 peak  3211 spectrum    1 weight  0.10000E+01 volume  0.16573E-02 ppm1      1.924 ppm2      0.604 CV     1
 ASSI { 3212}
   (( segid "    " and resid 40   and name HB3 ))
   (  segid "    " and resid 20   and name HD2%)
      2.000     2.000     4.000 peak  3212 spectrum    1 weight  0.10000E+01 volume  0.26005E-02 ppm1      1.525 ppm2      0.608 CV     1
 ASSI { 3214}
   (( segid "    " and resid 40   and name HB3 ))
   (  segid "    " and resid 40   and name HD1%)
      2.200     0.600     0.600 peak  3214 spectrum    1 weight  0.10000E+01 volume  0.10766E-01 ppm1      1.524 ppm2      0.970 CV     1
 OR { 3214}
   (( segid "    " and resid 40   and name HB3 ))
   (  segid "    " and resid 40   and name HD2%)
 ASSI { 3215}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name HB3 ))
      1.800     0.400     0.400 peak  3215 spectrum    1 weight  0.10000E+01 volume  0.97636E-02 ppm1      1.923 ppm2      1.519 CV     1
 ASSI { 3216}
   (( segid "    " and resid 40   and name HB3 ))
   (( segid "    " and resid 40   and name HB2 ))
      1.800     0.400     0.400 peak  3216 spectrum    1 weight  0.10000E+01 volume  0.10287E-01 ppm1      1.525 ppm2      1.915 CV     1
 OR { 3216}
   (( segid "    " and resid 40   and name HB3 ))
   (( segid "    " and resid 40   and name HG  ))
 ASSI { 3220}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HA  ))
      3.200     1.300     1.300 peak  3220 spectrum    1 weight  0.10000E+01 volume  0.14834E-02 ppm1      1.924 ppm2      3.721 CV     1
 ASSI { 3224}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name HA  ))
      3.000     1.100     1.100 peak  3224 spectrum    1 weight  0.10000E+01 volume  0.11672E-02 ppm1      1.923 ppm2      4.451 CV     1
 ASSI { 3225}
   (( segid "    " and resid 40   and name HB3 ))
   (( segid "    " and resid 40   and name HA  ))
      3.300     1.400     1.400 peak  3225 spectrum    1 weight  0.10000E+01 volume  0.10986E-02 ppm1      1.524 ppm2      4.450 CV     1
 ASSI { 3227}
   (( segid "    " and resid 40   and name HG  ))
   (  segid "    " and resid 40   and name HD1%)
      2.100     0.500     0.500 peak  3227 spectrum    1 weight  0.10000E+01 volume  0.12216E-01 ppm1      1.891 ppm2      0.970 CV     1
 OR { 3227}
   (( segid "    " and resid 40   and name HG  ))
   (  segid "    " and resid 40   and name HD2%)
 ASSI { 3232}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 13   and name HG3 ))
      3.200     1.300     1.300 peak  3232 spectrum    1 weight  0.10000E+01 volume  0.37066E-02 ppm1      0.988 ppm2      2.406 CV     1
 OR { 3232}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 13   and name HG2 ))
 OR { 3232}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 13   and name HB3 ))
 ASSI { 3237}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 40   and name HA  ))
      3.600     1.600     1.600 peak  3237 spectrum    1 weight  0.10000E+01 volume  0.19774E-02 ppm1      0.989 ppm2      4.450 CV     1
 ASSI { 3238}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 22   and name HG  ))
      2.000     0.500     0.500 peak  3238 spectrum    1 weight  0.10000E+01 volume  0.13568E-01 ppm1      0.947 ppm2      2.062 CV     1
 ASSI { 3240}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 9    and name HZ3 ))
      2.900     1.100     1.100 peak  3240 spectrum    1 weight  0.10000E+01 volume  0.18316E-02 ppm1      0.988 ppm2      6.797 CV     1
 ASSI { 3241}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 9    and name HH2 ))
      3.000     1.100     1.100 peak  3241 spectrum    1 weight  0.10000E+01 volume  0.15912E-02 ppm1      0.989 ppm2      6.732 CV     1
 ASSI { 3242}
   (  segid "    " and resid 22   and name HD1%)
   (  segid "    " and resid 21   and name HD% )
      4.700     2.800     1.300 peak  3242 spectrum    1 weight  0.10000E+01 volume  0.12568E-02 ppm1      0.987 ppm2      6.900 CV     1
 ASSI { 3248}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 17   and name H   ))
      3.400     1.500     1.500 peak  3248 spectrum    1 weight  0.10000E+01 volume  0.14072E-02 ppm1      0.989 ppm2      8.764 CV     1
 ASSI { 3249}
   (( segid "    " and resid 118  and name HG  ))
   (( segid "    " and resid 118  and name H   ))
      4.400     2.400     1.600 peak  3249 spectrum    1 weight  0.10000E+01 volume  0.70918E-03 ppm1      1.883 ppm2      8.394 CV     1
 ASSI { 3253}
   (( segid "    " and resid 40   and name HB3 ))
   (( segid "    " and resid 39   and name H   ))
      4.400     2.400     1.600 peak  3253 spectrum    1 weight  0.10000E+01 volume  0.87400E-03 ppm1      1.532 ppm2      7.537 CV     1
 ASSI { 3257}
   (( segid "    " and resid 39   and name HB2 ))
   (  segid "    " and resid 20   and name HD1%)
      2.700     0.900     0.900 peak  3257 spectrum    1 weight  0.10000E+01 volume  0.25197E-02 ppm1      3.463 ppm2      0.657 CV     1
 ASSI { 3260}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 39   and name HB3 ))
      2.200     0.600     0.600 peak  3260 spectrum    1 weight  0.10000E+01 volume  0.27453E-02 ppm1      3.461 ppm2      2.867 CV     1
 ASSI { 3266}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 39   and name HD2 ))
      3.400     1.400     1.400 peak  3266 spectrum    1 weight  0.10000E+01 volume  0.64813E-03 ppm1      3.460 ppm2      7.413 CV     1
 ASSI { 3269}
   (( segid "    " and resid 39   and name HB3 ))
   (( segid "    " and resid 39   and name HD2 ))
      4.200     2.200     1.800 peak  3269 spectrum    1 weight  0.10000E+01 volume  0.59907E-03 ppm1      2.866 ppm2      7.411 CV     1
 ASSI { 3272}
   (( segid "    " and resid 16   and name HE1 ))
   (( segid "    " and resid 16   and name HD2 ))
      5.600     3.900     0.400 peak  3272 spectrum    1 weight  0.10000E+01 volume  0.13377E-03 ppm1      8.319 ppm2      7.305 CV     1
 ASSI { 3273}
   (( segid "    " and resid 16   and name HE1 ))
   (( segid "    " and resid 40   and name HA  ))
      4.200     2.200     1.800 peak  3273 spectrum    1 weight  0.10000E+01 volume  0.20234E-03 ppm1      8.314 ppm2      4.461 CV     1
 ASSI { 3275}
   (( segid "    " and resid 39   and name HD2 ))
   (( segid "    " and resid 38   and name HA  ))
      5.900     4.400     0.100 peak  3275 spectrum    1 weight  0.10000E+01 volume  0.19316E-03 ppm1      7.406 ppm2      4.079 CV     1
 ASSI { 3276}
   (( segid "    " and resid 39   and name HD2 ))
   (( segid "    " and resid 36   and name HA  ))
      4.000     2.000     2.000 peak  3276 spectrum    1 weight  0.10000E+01 volume  0.37534E-03 ppm1      7.407 ppm2      3.665 CV     1
 ASSI { 3278}
   (( segid "    " and resid 16   and name HE1 ))
   (( segid "    " and resid 39   and name HB2 ))
      4.900     3.000     1.100 peak  3278 spectrum    1 weight  0.10000E+01 volume  0.25210E-03 ppm1      8.319 ppm2      3.443 CV     1
 ASSI { 3281}
   (( segid "    " and resid 16   and name HE1 ))
   (( segid "    " and resid 40   and name HG  ))
      4.900     3.000     1.100 peak  3281 spectrum    1 weight  0.10000E+01 volume  0.16104E-03 ppm1      8.316 ppm2      1.902 CV     1
 OR { 3281}
   (( segid "    " and resid 16   and name HE1 ))
   (( segid "    " and resid 40   and name HB2 ))
 ASSI { 3283}
   (( segid "    " and resid 39   and name HD2 ))
   (( segid "    " and resid 36   and name HB  ))
      4.700     2.800     1.300 peak  3283 spectrum    1 weight  0.10000E+01 volume  0.14892E-03 ppm1      7.410 ppm2      2.109 CV     1
 ASSI { 3284}
   (( segid "    " and resid 39   and name HD2 ))
   (( segid "    " and resid 20   and name HG  ))
      5.100     3.200     0.900 peak  3284 spectrum    1 weight  0.10000E+01 volume  0.14225E-03 ppm1      7.412 ppm2      1.736 CV     1
 ASSI { 3285}
   (( segid "    " and resid 39   and name HD2 ))
   (  segid "    " and resid 35   and name HB% )
      4.500     2.500     1.500 peak  3285 spectrum    1 weight  0.10000E+01 volume  0.72790E-03 ppm1      7.410 ppm2      1.415 CV     1
 ASSI { 3287}
   (( segid "    " and resid 39   and name HD2 ))
   (  segid "    " and resid 20   and name HD1%)
      2.100     2.100     3.900 peak  3287 spectrum    1 weight  0.10000E+01 volume  0.18479E-02 ppm1      7.411 ppm2      0.666 CV     1
 ASSI { 3289}
   (( segid "    " and resid 16   and name HE1 ))
   (  segid "    " and resid 20   and name HD2%)
      3.800     1.800     1.800 peak  3289 spectrum    1 weight  0.10000E+01 volume  0.88739E-03 ppm1      8.319 ppm2      0.630 CV     1
 ASSI { 3290}
   (( segid "    " and resid 16   and name HE1 ))
   (  segid "    " and resid 40   and name HD1%)
      4.200     2.200     1.800 peak  3290 spectrum    1 weight  0.10000E+01 volume  0.58929E-03 ppm1      8.317 ppm2      0.966 CV     1
 OR { 3290}
   (( segid "    " and resid 16   and name HE1 ))
   (  segid "    " and resid 40   and name HD2%)
 ASSI { 3292}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 37   and name HD1%)
      3.700     1.700     1.700 peak  3292 spectrum    1 weight  0.10000E+01 volume  0.11032E-02 ppm1      4.076 ppm2      0.861 CV     1
 ASSI { 3296}
   (  segid "    " and resid 38   and name HB% )
   (  segid "    " and resid 20   and name HD1%)
      4.200     2.200     1.800 peak  3296 spectrum    1 weight  0.10000E+01 volume  0.93237E-03 ppm1      1.278 ppm2      0.644 CV     1
 OR { 3296}
   (  segid "    " and resid 38   and name HB% )
   (  segid "    " and resid 20   and name HD2%)
 ASSI { 3298}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 34   and name HG2 ))
      2.600     2.600     3.400 peak  3298 spectrum    1 weight  0.10000E+01 volume  0.60604E-03 ppm1      1.285 ppm2      2.402 CV     1
 ASSI { 3299}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 50   and name HB  ))
      4.300     2.400     1.700 peak  3299 spectrum    1 weight  0.10000E+01 volume  0.12244E-02 ppm1      1.279 ppm2      2.154 CV     1
 ASSI { 3301}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 37   and name HG  ))
      3.800     1.800     1.800 peak  3301 spectrum    1 weight  0.10000E+01 volume  0.19523E-02 ppm1      1.280 ppm2      1.695 CV     1
 ASSI { 3303}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 39   and name HB3 ))
      4.600     2.700     1.400 peak  3303 spectrum    1 weight  0.10000E+01 volume  0.81977E-03 ppm1      1.278 ppm2      2.866 CV     1
 ASSI { 3304}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 38   and name HA  ))
      2.100     0.500     0.500 peak  3304 spectrum    1 weight  0.10000E+01 volume  0.16246E-01 ppm1      1.278 ppm2      4.078 CV     1
 ASSI { 3305}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 36   and name HA  ))
      4.300     2.300     1.700 peak  3305 spectrum    1 weight  0.10000E+01 volume  0.64045E-03 ppm1      1.278 ppm2      3.659 CV     1
 ASSI { 3306}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 39   and name HB2 ))
      4.700     2.800     1.300 peak  3306 spectrum    1 weight  0.10000E+01 volume  0.54440E-03 ppm1      1.275 ppm2      3.466 CV     1
 ASSI { 3307}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 47   and name HD3 ))
      2.800     2.800     3.200 peak  3307 spectrum    1 weight  0.10000E+01 volume  0.32520E-03 ppm1      1.280 ppm2      3.227 CV     1
 OR { 3307}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 47   and name HD2 ))
 ASSI { 3310}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 37   and name H   ))
      4.900     3.000     1.100 peak  3310 spectrum    1 weight  0.10000E+01 volume  0.36636E-03 ppm1      4.079 ppm2      8.570 CV     1
 ASSI { 3312}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 39   and name HD2 ))
      2.700     0.900     0.900 peak  3312 spectrum    1 weight  0.10000E+01 volume  0.27132E-02 ppm1      1.278 ppm2      7.413 CV     1
 ASSI { 3314}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 36   and name H   ))
      4.000     2.000     2.000 peak  3314 spectrum    1 weight  0.10000E+01 volume  0.87439E-03 ppm1      1.280 ppm2      8.104 CV     1
 ASSI { 3321}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HB3 ))
      2.200     0.600     0.600 peak  3321 spectrum    1 weight  0.10000E+01 volume  0.34336E-02 ppm1      3.930 ppm2      1.869 CV     1
 ASSI { 3323}
   (( segid "    " and resid 37   and name HB2 ))
   (  segid "    " and resid 38   and name HB% )
      4.100     2.100     1.900 peak  3323 spectrum    1 weight  0.10000E+01 volume  0.11401E-02 ppm1      1.554 ppm2      1.278 CV     1
 ASSI { 3324}
   (( segid "    " and resid 37   and name HB3 ))
   (  segid "    " and resid 38   and name HB% )
      4.300     2.300     1.700 peak  3324 spectrum    1 weight  0.10000E+01 volume  0.13109E-02 ppm1      1.854 ppm2      1.269 CV     1
 ASSI { 3327}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 36   and name HB  ))
      3.800     1.800     1.800 peak  3327 spectrum    1 weight  0.10000E+01 volume  0.10672E-02 ppm1      1.855 ppm2      2.123 CV     1
 ASSI { 3328}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 36   and name HB  ))
      4.600     2.600     1.400 peak  3328 spectrum    1 weight  0.10000E+01 volume  0.93340E-03 ppm1      1.557 ppm2      2.121 CV     1
 ASSI { 3334}
   (  segid "    " and resid 119  and name HD2%)
   (( segid "    " and resid 119  and name H   ))
      3.400     1.400     1.400 peak  3334 spectrum    1 weight  0.10000E+01 volume  0.42473E-02 ppm1      0.804 ppm2      7.873 CV     1
 ASSI { 3336}
   (( segid "    " and resid 119  and name HG  ))
   (( segid "    " and resid 124  and name H   ))
      4.700     2.700     1.300 peak  3336 spectrum    1 weight  0.10000E+01 volume  0.32018E-03 ppm1      1.568 ppm2      6.771 CV     1
 ASSI { 3343}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 36   and name H   ))
      4.800     2.900     1.200 peak  3343 spectrum    1 weight  0.10000E+01 volume  0.33142E-03 ppm1      3.899 ppm2      8.124 CV     1
 ASSI { 3344}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name H   ))
      2.500     0.800     0.800 peak  3344 spectrum    1 weight  0.10000E+01 volume  0.23413E-02 ppm1      3.931 ppm2      8.591 CV     1
 ASSI { 3345}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 37   and name H   ))
      2.500     0.800     0.800 peak  3345 spectrum    1 weight  0.10000E+01 volume  0.27970E-02 ppm1      1.855 ppm2      8.587 CV     1
 ASSI { 3348}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 39   and name H   ))
      3.600     1.700     1.700 peak  3348 spectrum    1 weight  0.10000E+01 volume  0.48542E-03 ppm1      3.656 ppm2      7.527 CV     1
 ASSI { 3350}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 35   and name HB% )
      3.400     1.400     1.400 peak  3350 spectrum    1 weight  0.10000E+01 volume  0.12959E-02 ppm1      3.661 ppm2      1.430 CV     1
 ASSI { 3351}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 20   and name HG  ))
      2.800     0.900     0.900 peak  3351 spectrum    1 weight  0.10000E+01 volume  0.69136E-03 ppm1      3.661 ppm2      1.682 CV     1
 ASSI { 3352}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 20   and name HD2%)
      3.900     1.900     1.900 peak  3352 spectrum    1 weight  0.10000E+01 volume  0.28330E-02 ppm1      3.660 ppm2      0.612 CV     1
 ASSI { 3353}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HG13))
      2.600     0.800     0.800 peak  3353 spectrum    1 weight  0.10000E+01 volume  0.27495E-02 ppm1      3.660 ppm2      2.105 CV     1
 OR { 3353}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HB  ))
 ASSI { 3355}
   (( segid "    " and resid 36   and name HB  ))
   (( segid "    " and resid 33   and name HA  ))
      2.500     0.800     0.800 peak  3355 spectrum    1 weight  0.10000E+01 volume  0.95574E-03 ppm1      2.109 ppm2      3.594 CV     1
 ASSI { 3361}
   (( segid "    " and resid 36   and name HG13))
   (( segid "    " and resid 36   and name HA  ))
      3.100     1.200     1.200 peak  3361 spectrum    1 weight  0.10000E+01 volume  0.95543E-03 ppm1      2.107 ppm2      3.682 CV     1
 ASSI { 3362}
   (  segid "    " and resid 36   and name HG2%)
   (  segid "    " and resid 54   and name HD1%)
      2.800     1.000     1.000 peak  3362 spectrum    1 weight  0.10000E+01 volume  0.29710E-02 ppm1      0.966 ppm2      0.425 CV     1
 OR { 3362}
   (  segid "    " and resid 36   and name HG2%)
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 3367}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 36   and name H   ))
      3.300     1.300     1.300 peak  3367 spectrum    1 weight  0.10000E+01 volume  0.36419E-02 ppm1      0.972 ppm2      8.103 CV     1
 ASSI { 3370}
   (( segid "    " and resid 36   and name HG13))
   (( segid "    " and resid 35   and name H   ))
      3.300     1.300     1.300 peak  3370 spectrum    1 weight  0.10000E+01 volume  0.20353E-02 ppm1      2.118 ppm2      7.870 CV     1
 ASSI { 3371}
   (( segid "    " and resid 36   and name HB  ))
   (( segid "    " and resid 36   and name H   ))
      2.600     0.800     0.800 peak  3371 spectrum    1 weight  0.10000E+01 volume  0.14148E-02 ppm1      2.105 ppm2      8.102 CV     1
 ASSI { 3373}
   (( segid "    " and resid 14   and name HG3 ))
   (( segid "    " and resid 14   and name H   ))
      3.200     1.300     1.300 peak  3373 spectrum    1 weight  0.10000E+01 volume  0.86857E-03 ppm1      2.148 ppm2      8.714 CV     1
 ASSI { 3374}
   (( segid "    " and resid 36   and name HB  ))
   (( segid "    " and resid 35   and name H   ))
      5.000     3.200     1.000 peak  3374 spectrum    1 weight  0.10000E+01 volume  0.31040E-03 ppm1      2.110 ppm2      7.866 CV     1
 ASSI { 3377}
   (  segid "    " and resid 35   and name HB% )
   (  segid "    " and resid 54   and name HD1%)
      5.100     3.300     0.900 peak  3377 spectrum    1 weight  0.10000E+01 volume  0.36860E-03 ppm1      1.423 ppm2      0.441 CV     1
 ASSI { 3378}
   (  segid "    " and resid 35   and name HB% )
   (  segid "    " and resid 20   and name HD1%)
      3.100     1.200     1.200 peak  3378 spectrum    1 weight  0.10000E+01 volume  0.14658E-02 ppm1      1.416 ppm2      0.664 CV     1
 ASSI { 3381}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 33   and name HB  ))
      2.800     2.800     3.200 peak  3381 spectrum    1 weight  0.10000E+01 volume  0.23880E-02 ppm1      1.414 ppm2      2.355 CV     1
 ASSI { 3382}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 24   and name HB2 ))
      2.800     1.000     1.000 peak  3382 spectrum    1 weight  0.10000E+01 volume  0.24413E-02 ppm1      1.416 ppm2      2.500 CV     1
 ASSI { 3383}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 39   and name HB3 ))
      4.000     2.000     2.000 peak  3383 spectrum    1 weight  0.10000E+01 volume  0.66697E-03 ppm1      1.418 ppm2      2.866 CV     1
 ASSI { 3388}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 18   and name HD3 ))
      3.500     1.600     1.600 peak  3388 spectrum    1 weight  0.10000E+01 volume  0.11079E-02 ppm1      4.204 ppm2      3.309 CV     1
 OR { 3388}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 18   and name HD2 ))
 ASSI { 3390}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 24   and name HD22))
      3.300     1.300     1.300 peak  3390 spectrum    1 weight  0.10000E+01 volume  0.18430E-02 ppm1      1.415 ppm2      7.484 CV     1
 ASSI { 3395}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 37   and name H   ))
      3.900     1.900     1.900 peak  3395 spectrum    1 weight  0.10000E+01 volume  0.12323E-02 ppm1      1.415 ppm2      8.586 CV     1
 ASSI { 3396}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 32   and name H   ))
      2.900     2.900     3.100 peak  3396 spectrum    1 weight  0.10000E+01 volume  0.28883E-03 ppm1      1.415 ppm2      9.088 CV     1
 ASSI { 3398}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 39   and name HD2 ))
      3.700     1.700     1.700 peak  3398 spectrum    1 weight  0.10000E+01 volume  0.37330E-03 ppm1      4.190 ppm2      7.412 CV     1
 ASSI { 3400}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 35   and name HA  ))
      2.100     0.600     0.600 peak  3400 spectrum    1 weight  0.10000E+01 volume  0.10997E-01 ppm1      1.415 ppm2      4.189 CV     1
 ASSI { 3401}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 31   and name HB3 ))
      4.300     2.300     1.700 peak  3401 spectrum    1 weight  0.10000E+01 volume  0.16243E-02 ppm1      2.421 ppm2      2.862 CV     1
 ASSI { 3402}
   (( segid "    " and resid 34   and name HG3 ))
   (( segid "    " and resid 31   and name HB3 ))
      2.900     1.100     1.100 peak  3402 spectrum    1 weight  0.10000E+01 volume  0.13260E-02 ppm1      2.249 ppm2      2.863 CV     1
 ASSI { 3405}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 37   and name HD1%)
      2.100     0.500     0.500 peak  3405 spectrum    1 weight  0.10000E+01 volume  0.61697E-02 ppm1      3.980 ppm2      0.830 CV     1
 ASSI { 3406}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 17   and name HD1%)
      2.100     0.600     0.600 peak  3406 spectrum    1 weight  0.10000E+01 volume  0.63308E-02 ppm1      3.964 ppm2      1.058 CV     1
 ASSI { 3407}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 38   and name HB% )
      3.700     1.700     1.700 peak  3407 spectrum    1 weight  0.10000E+01 volume  0.13121E-02 ppm1      3.973 ppm2      1.289 CV     1
 ASSI { 3413}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 89   and name HB2 ))
      2.500     0.800     0.800 peak  3413 spectrum    1 weight  0.10000E+01 volume  0.83004E-02 ppm1      2.398 ppm2      2.045 CV     1
 ASSI { 3414}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 28   and name HB2 ))
      2.100     0.600     0.600 peak  3414 spectrum    1 weight  0.10000E+01 volume  0.16696E-01 ppm1      2.255 ppm2      1.988 CV     1
 OR { 3414}
   (( segid "    " and resid 28   and name HG3 ))
   (( segid "    " and resid 28   and name HB3 ))
 OR { 3414}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 28   and name HB3 ))
 OR { 3414}
   (( segid "    " and resid 28   and name HG3 ))
   (( segid "    " and resid 28   and name HB2 ))
 ASSI { 3420}
   (( segid "    " and resid 34   and name HG3 ))
   (( segid "    " and resid 34   and name H   ))
      2.500     0.800     0.800 peak  3420 spectrum    1 weight  0.10000E+01 volume  0.33513E-02 ppm1      2.249 ppm2      7.999 CV     1
 ASSI { 3421}
   (( segid "    " and resid 34   and name HG3 ))
   (( segid "    " and resid 35   and name H   ))
      4.000     2.000     2.000 peak  3421 spectrum    1 weight  0.10000E+01 volume  0.14085E-02 ppm1      2.249 ppm2      7.873 CV     1
 ASSI { 3425}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 20   and name H   ))
      3.600     1.600     1.600 peak  3425 spectrum    1 weight  0.10000E+01 volume  0.17201E-02 ppm1      2.292 ppm2      8.668 CV     1
 ASSI { 3426}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 15   and name H   ))
      3.300     1.300     1.300 peak  3426 spectrum    1 weight  0.10000E+01 volume  0.10925E-02 ppm1      2.393 ppm2      8.277 CV     1
 ASSI { 3427}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 14   and name H   ))
      2.700     0.900     0.900 peak  3427 spectrum    1 weight  0.10000E+01 volume  0.14275E-02 ppm1      2.397 ppm2      8.714 CV     1
 ASSI { 3430}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name H   ))
      2.900     1.100     1.100 peak  3430 spectrum    1 weight  0.10000E+01 volume  0.13638E-02 ppm1      3.967 ppm2      8.762 CV     1
 ASSI { 3437}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 36   and name HB  ))
      2.300     0.600     0.600 peak  3437 spectrum    1 weight  0.10000E+01 volume  0.22303E-02 ppm1      3.580 ppm2      2.108 CV     1
 OR { 3437}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 36   and name HG13))
 ASSI { 3438}
   (( segid "    " and resid 33   and name HB  ))
   (  segid "    " and resid 33   and name HG2%)
      2.000     0.500     0.500 peak  3438 spectrum    1 weight  0.10000E+01 volume  0.10023E-01 ppm1      2.339 ppm2      0.948 CV     1
 OR { 3438}
   (( segid "    " and resid 33   and name HB  ))
   (  segid "    " and resid 33   and name HG1%)
 ASSI { 3439}
   (( segid "    " and resid 33   and name HB  ))
   (  segid "    " and resid 32   and name HG1%)
      3.300     1.400     1.400 peak  3439 spectrum    1 weight  0.10000E+01 volume  0.12549E-02 ppm1      2.341 ppm2      1.291 CV     1
 ASSI { 3440}
   (( segid "    " and resid 33   and name HB  ))
   (( segid "    " and resid 33   and name HA  ))
      2.700     0.900     0.900 peak  3440 spectrum    1 weight  0.10000E+01 volume  0.86758E-03 ppm1      2.337 ppm2      3.579 CV     1
 ASSI { 3445}
   (( segid "    " and resid 32   and name HB  ))
   (  segid "    " and resid 32   and name HG2%)
      2.300     0.600     0.600 peak  3445 spectrum    1 weight  0.10000E+01 volume  0.69370E-02 ppm1      2.361 ppm2      1.031 CV     1
 ASSI { 3446}
   (( segid "    " and resid 32   and name HB  ))
   (  segid "    " and resid 35   and name HB% )
      3.900     1.900     1.900 peak  3446 spectrum    1 weight  0.10000E+01 volume  0.16747E-02 ppm1      2.359 ppm2      1.406 CV     1
 ASSI { 3449}
   (( segid "    " and resid 32   and name HB  ))
   (( segid "    " and resid 25   and name HA  ))
      3.000     1.100     1.100 peak  3449 spectrum    1 weight  0.10000E+01 volume  0.18924E-02 ppm1      2.360 ppm2      3.858 CV     1
 ASSI { 3450}
   (  segid "    " and resid 32   and name HG1%)
   (  segid "    " and resid 54   and name HD1%)
      3.000     1.100     1.100 peak  3450 spectrum    1 weight  0.10000E+01 volume  0.23888E-02 ppm1      1.295 ppm2      0.430 CV     1
 ASSI { 3451}
   (  segid "    " and resid 32   and name HG2%)
   (  segid "    " and resid 54   and name HD1%)
      3.900     1.900     1.900 peak  3451 spectrum    1 weight  0.10000E+01 volume  0.21378E-02 ppm1      1.035 ppm2      0.419 CV     1
 OR { 3451}
   (  segid "    " and resid 32   and name HG2%)
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 3456}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 32   and name HB  ))
      2.200     0.600     0.600 peak  3456 spectrum    1 weight  0.10000E+01 volume  0.98698E-02 ppm1      1.295 ppm2      2.360 CV     1
 ASSI { 3457}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 36   and name HG13))
      3.400     1.400     1.400 peak  3457 spectrum    1 weight  0.10000E+01 volume  0.23837E-02 ppm1      1.295 ppm2      2.113 CV     1
 OR { 3457}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 36   and name HB  ))
 ASSI { 3458}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 21   and name HB3 ))
      4.100     2.100     1.900 peak  3458 spectrum    1 weight  0.10000E+01 volume  0.12241E-02 ppm1      1.295 ppm2      3.009 CV     1
 OR { 3458}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 3460}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 25   and name HA  ))
      3.500     1.500     1.500 peak  3460 spectrum    1 weight  0.10000E+01 volume  0.26478E-02 ppm1      1.295 ppm2      3.858 CV     1
 ASSI { 3461}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 33   and name HA  ))
      3.100     1.200     1.200 peak  3461 spectrum    1 weight  0.10000E+01 volume  0.16553E-02 ppm1      1.295 ppm2      3.582 CV     1
 ASSI { 3462}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 66   and name HB3 ))
      4.500     2.500     1.500 peak  3462 spectrum    1 weight  0.10000E+01 volume  0.46572E-03 ppm1      1.296 ppm2      3.368 CV     1
 ASSI { 3463}
   (  segid "    " and resid 32   and name HG2%)
   (  segid "    " and resid 35   and name HB% )
      2.600     0.900     0.900 peak  3463 spectrum    1 weight  0.10000E+01 volume  0.82729E-02 ppm1      1.035 ppm2      1.415 CV     1
 ASSI { 3464}
   (  segid "    " and resid 32   and name HG2%)
   (  segid "    " and resid 32   and name HG1%)
      2.000     0.500     0.500 peak  3464 spectrum    1 weight  0.10000E+01 volume  0.18250E-01 ppm1      1.035 ppm2      1.295 CV     1
 ASSI { 3465}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 24   and name HB2 ))
      2.400     0.700     0.700 peak  3465 spectrum    1 weight  0.10000E+01 volume  0.44141E-02 ppm1      1.036 ppm2      2.503 CV     1
 ASSI { 3467}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 36   and name HG13))
      2.700     0.900     0.900 peak  3467 spectrum    1 weight  0.10000E+01 volume  0.43374E-02 ppm1      1.034 ppm2      2.111 CV     1
 OR { 3467}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 36   and name HB  ))
 ASSI { 3468}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 21   and name HB3 ))
      3.500     1.500     1.500 peak  3468 spectrum    1 weight  0.10000E+01 volume  0.20903E-02 ppm1      1.035 ppm2      3.024 CV     1
 OR { 3468}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 3471}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 25   and name HA  ))
      2.400     0.700     0.700 peak  3471 spectrum    1 weight  0.10000E+01 volume  0.56526E-02 ppm1      1.036 ppm2      3.855 CV     1
 ASSI { 3472}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 24   and name HD22))
      4.600     2.600     1.400 peak  3472 spectrum    1 weight  0.10000E+01 volume  0.99532E-03 ppm1      1.034 ppm2      7.486 CV     1
 ASSI { 3474}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 30   and name HE21))
      3.500     1.500     1.500 peak  3474 spectrum    1 weight  0.10000E+01 volume  0.21770E-02 ppm1      1.035 ppm2      7.034 CV     1
 ASSI { 3475}
   (  segid "    " and resid 32   and name HG2%)
   (  segid "    " and resid 21   and name HD% )
      2.500     0.800     0.800 peak  3475 spectrum    1 weight  0.10000E+01 volume  0.63980E-02 ppm1      1.035 ppm2      6.888 CV     1
 OR { 3475}
   (  segid "    " and resid 32   and name HG2%)
   (  segid "    " and resid 21   and name HE% )
 ASSI { 3477}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 35   and name H   ))
      3.400     1.400     1.400 peak  3477 spectrum    1 weight  0.10000E+01 volume  0.15816E-02 ppm1      1.034 ppm2      7.863 CV     1
 ASSI { 3478}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 30   and name HE22))
      4.500     2.500     1.500 peak  3478 spectrum    1 weight  0.10000E+01 volume  0.10687E-02 ppm1      1.034 ppm2      7.760 CV     1
 ASSI { 3483}
   (  segid "    " and resid 32   and name HG1%)
   (  segid "    " and resid 66   and name HE% )
      2.700     0.900     0.900 peak  3483 spectrum    1 weight  0.10000E+01 volume  0.39837E-02 ppm1      1.295 ppm2      7.089 CV     1
 ASSI { 3484}
   (  segid "    " and resid 32   and name HG1%)
   (  segid "    " and resid 21   and name HE% )
      2.300     0.700     0.700 peak  3484 spectrum    1 weight  0.10000E+01 volume  0.74369E-02 ppm1      1.295 ppm2      6.860 CV     1
 OR { 3484}
   (  segid "    " and resid 32   and name HG1%)
   (  segid "    " and resid 21   and name HD% )
 ASSI { 3485}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 33   and name H   ))
      2.300     0.600     0.600 peak  3485 spectrum    1 weight  0.10000E+01 volume  0.55769E-02 ppm1      1.295 ppm2      7.982 CV     1
 ASSI { 3488}
   (( segid "    " and resid 32   and name HB  ))
   (( segid "    " and resid 33   and name H   ))
      3.700     1.800     1.800 peak  3488 spectrum    1 weight  0.10000E+01 volume  0.14884E-02 ppm1      2.360 ppm2      7.986 CV     1
 ASSI { 3489}
   (( segid "    " and resid 32   and name HB  ))
   (  segid "    " and resid 21   and name HD% )
      4.700     2.800     1.300 peak  3489 spectrum    1 weight  0.10000E+01 volume  0.50765E-03 ppm1      2.358 ppm2      6.899 CV     1
 ASSI { 3492}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 32   and name H   ))
      2.700     0.900     0.900 peak  3492 spectrum    1 weight  0.10000E+01 volume  0.37115E-02 ppm1      1.294 ppm2      9.097 CV     1
 ASSI { 3494}
   (( segid "    " and resid 31   and name HB3 ))
   (( segid "    " and resid 32   and name H   ))
      4.800     2.900     1.200 peak  3494 spectrum    1 weight  0.10000E+01 volume  0.23905E-03 ppm1      2.847 ppm2      9.095 CV     1
 ASSI { 3496}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 32   and name H   ))
      5.000     3.100     1.000 peak  3496 spectrum    1 weight  0.10000E+01 volume  0.33905E-03 ppm1      2.681 ppm2      9.083 CV     1
 ASSI { 3497}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 64   and name H   ))
      5.700     4.000     0.300 peak  3497 spectrum    1 weight  0.10000E+01 volume  0.16013E-03 ppm1      2.701 ppm2      8.285 CV     1
 OR { 3497}
   (( segid "    " and resid 61   and name HB3 ))
   (( segid "    " and resid 64   and name H   ))
 ASSI { 3499}
   (( segid "    " and resid 31   and name HB3 ))
   (( segid "    " and resid 35   and name H   ))
      4.800     2.900     1.200 peak  3499 spectrum    1 weight  0.10000E+01 volume  0.37812E-03 ppm1      2.860 ppm2      7.867 CV     1
 ASSI { 3503}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 31   and name H   ))
      5.400     3.600     0.600 peak  3503 spectrum    1 weight  0.10000E+01 volume  0.26694E-03 ppm1      2.052 ppm2      8.868 CV     1
 ASSI { 3506}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 31   and name H   ))
      4.600     2.700     1.400 peak  3506 spectrum    1 weight  0.10000E+01 volume  0.33892E-03 ppm1      2.214 ppm2      8.863 CV     1
 ASSI { 3508}
   (( segid "    " and resid 30   and name HA  ))
   (  segid "    " and resid 27   and name HG2%)
      3.800     1.800     1.800 peak  3508 spectrum    1 weight  0.10000E+01 volume  0.22205E-02 ppm1      4.578 ppm2      0.902 CV     1
 ASSI { 3509}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB2 ))
      2.600     0.800     0.800 peak  3509 spectrum    1 weight  0.10000E+01 volume  0.36509E-02 ppm1      4.573 ppm2      2.058 CV     1
 ASSI { 3510}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB3 ))
      2.700     0.900     0.900 peak  3510 spectrum    1 weight  0.10000E+01 volume  0.49055E-02 ppm1      4.573 ppm2      1.856 CV     1
 ASSI { 3511}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HB3 ))
      1.700     0.400     0.500 peak  3511 spectrum    1 weight  0.10000E+01 volume  0.11821E-01 ppm1      2.054 ppm2      1.853 CV     1
 ASSI { 3514}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 30   and name HA  ))
      3.800     1.800     1.800 peak  3514 spectrum    1 weight  0.10000E+01 volume  0.61502E-03 ppm1      2.145 ppm2      4.579 CV     1
 ASSI { 3518}
   (( segid "    " and resid 29   and name HA3 ))
   (  segid "    " and resid 27   and name HG2%)
      3.800     1.800     1.800 peak  3518 spectrum    1 weight  0.10000E+01 volume  0.77327E-03 ppm1      3.752 ppm2      0.911 CV     1
 ASSI { 3520}
   (( segid "    " and resid 29   and name HA3 ))
   (( segid "    " and resid 30   and name HG3 ))
      3.800     1.800     1.800 peak  3520 spectrum    1 weight  0.10000E+01 volume  0.69908E-03 ppm1      3.747 ppm2      2.254 CV     1
 ASSI { 3522}
   (( segid "    " and resid 29   and name HA3 ))
   (( segid "    " and resid 30   and name HB3 ))
      4.800     2.900     1.200 peak  3522 spectrum    1 weight  0.10000E+01 volume  0.37013E-03 ppm1      3.756 ppm2      1.854 CV     1
 ASSI { 3525}
   (( segid "    " and resid 29   and name HA3 ))
   (( segid "    " and resid 28   and name H   ))
      3.000     3.000     3.000 peak  3525 spectrum    1 weight  0.10000E+01 volume  0.25283E-03 ppm1      3.753 ppm2      8.598 CV     1
 ASSI { 3526}
   (( segid "    " and resid 29   and name HA2 ))
   (( segid "    " and resid 30   and name HB3 ))
      4.900     3.000     1.100 peak  3526 spectrum    1 weight  0.10000E+01 volume  0.42646E-03 ppm1      4.087 ppm2      1.828 CV     1
 ASSI { 3527}
   (( segid "    " and resid 34   and name HG3 ))
   (( segid "    " and resid 31   and name HB2 ))
      2.800     1.000     1.000 peak  3527 spectrum    1 weight  0.10000E+01 volume  0.14138E-02 ppm1      2.249 ppm2      2.664 CV     1
 ASSI { 3531}
   (( segid "    " and resid 28   and name HB3 ))
   (( segid "    " and resid 27   and name HA  ))
      3.700     1.700     1.700 peak  3531 spectrum    1 weight  0.10000E+01 volume  0.33486E-02 ppm1      1.991 ppm2      3.892 CV     1
 OR { 3531}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 27   and name HA  ))
 ASSI { 3533}
   (( segid "    " and resid 86   and name HB3 ))
   (  segid "    " and resid 91   and name HE% )
      4.100     2.100     1.900 peak  3533 spectrum    1 weight  0.10000E+01 volume  0.37346E-03 ppm1      1.990 ppm2      7.300 CV     1
 OR { 3533}
   (( segid "    " and resid 86   and name HB2 ))
   (  segid "    " and resid 91   and name HE% )
 ASSI { 3534}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 27   and name H   ))
      3.000     3.000     3.000 peak  3534 spectrum    1 weight  0.10000E+01 volume  0.23781E-03 ppm1      2.307 ppm2      7.296 CV     1
 ASSI { 3535}
   (( segid "    " and resid 34   and name HG3 ))
   (  segid "    " and resid 66   and name HD% )
      4.700     2.800     1.300 peak  3535 spectrum    1 weight  0.10000E+01 volume  0.27746E-03 ppm1      2.249 ppm2      7.301 CV     1
 ASSI { 3538}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 28   and name HG3 ))
      3.900     1.900     1.900 peak  3538 spectrum    1 weight  0.10000E+01 volume  0.10004E-02 ppm1      3.881 ppm2      2.265 CV     1
 OR { 3538}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 28   and name HG2 ))
 ASSI { 3542}
   (( segid "    " and resid 27   and name HB  ))
   (( segid "    " and resid 30   and name HE21))
      4.100     2.100     1.900 peak  3542 spectrum    1 weight  0.10000E+01 volume  0.87441E-03 ppm1      2.104 ppm2      7.030 CV     1
 ASSI { 3543}
   (( segid "    " and resid 27   and name HB  ))
   (( segid "    " and resid 30   and name HE22))
      3.700     1.700     1.700 peak  3543 spectrum    1 weight  0.10000E+01 volume  0.12713E-02 ppm1      2.105 ppm2      7.753 CV     1
 ASSI { 3548}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 25   and name HG3 ))
      3.300     1.400     1.400 peak  3548 spectrum    1 weight  0.10000E+01 volume  0.72729E-03 ppm1      2.897 ppm2      1.153 CV     1
 ASSI { 3553}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HB3 ))
      2.500     0.800     0.800 peak  3553 spectrum    1 weight  0.10000E+01 volume  0.44727E-02 ppm1      3.854 ppm2      1.141 CV     1
 OR { 3553}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HG3 ))
 ASSI { 3555}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HB2 ))
      2.400     0.700     0.700 peak  3555 spectrum    1 weight  0.10000E+01 volume  0.49521E-02 ppm1      3.860 ppm2      1.493 CV     1
 ASSI { 3556}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 25   and name HB3 ))
      1.900     0.400     0.400 peak  3556 spectrum    1 weight  0.10000E+01 volume  0.58566E-02 ppm1      1.484 ppm2      1.147 CV     1
 OR { 3556}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 25   and name HG3 ))
 ASSI { 3557}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 25   and name HE2 ))
      4.300     2.300     1.700 peak  3557 spectrum    1 weight  0.10000E+01 volume  0.14735E-02 ppm1      1.478 ppm2      3.001 CV     1
 OR { 3557}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 25   and name HE3 ))
 ASSI { 3559}
   (( segid "    " and resid 25   and name HB3 ))
   (( segid "    " and resid 25   and name HA  ))
      2.900     1.000     1.000 peak  3559 spectrum    1 weight  0.10000E+01 volume  0.15435E-02 ppm1      1.141 ppm2      3.853 CV     1
 ASSI { 3560}
   (( segid "    " and resid 25   and name HB3 ))
   (( segid "    " and resid 22   and name HA  ))
      3.100     1.200     1.200 peak  3560 spectrum    1 weight  0.10000E+01 volume  0.49333E-03 ppm1      1.140 ppm2      3.731 CV     1
 ASSI { 3561}
   (( segid "    " and resid 25   and name HB3 ))
   (( segid "    " and resid 25   and name HE2 ))
      4.600     2.600     1.400 peak  3561 spectrum    1 weight  0.10000E+01 volume  0.82086E-03 ppm1      1.139 ppm2      2.985 CV     1
 OR { 3561}
   (( segid "    " and resid 25   and name HB3 ))
   (( segid "    " and resid 25   and name HE3 ))
 ASSI { 3563}
   (( segid "    " and resid 25   and name HB3 ))
   (( segid "    " and resid 25   and name HB2 ))
      2.000     0.500     0.500 peak  3563 spectrum    1 weight  0.10000E+01 volume  0.32098E-02 ppm1      1.141 ppm2      1.481 CV     1
 ASSI { 3564}
   (( segid "    " and resid 25   and name HB3 ))
   (( segid "    " and resid 25   and name HD3 ))
      2.600     0.900     0.900 peak  3564 spectrum    1 weight  0.10000E+01 volume  0.29470E-02 ppm1      1.141 ppm2      1.346 CV     1
 OR { 3564}
   (( segid "    " and resid 25   and name HB3 ))
   (( segid "    " and resid 25   and name HD2 ))
 ASSI { 3565}
   (( segid "    " and resid 25   and name HG3 ))
   (( segid "    " and resid 25   and name HB2 ))
      2.500     0.800     0.800 peak  3565 spectrum    1 weight  0.10000E+01 volume  0.30058E-02 ppm1      1.148 ppm2      1.478 CV     1
 ASSI { 3566}
   (( segid "    " and resid 25   and name HG3 ))
   (( segid "    " and resid 25   and name HD2 ))
      2.400     0.700     0.700 peak  3566 spectrum    1 weight  0.10000E+01 volume  0.52161E-02 ppm1      1.150 ppm2      1.346 CV     1
 OR { 3566}
   (( segid "    " and resid 25   and name HG3 ))
   (( segid "    " and resid 25   and name HD3 ))
 ASSI { 3567}
   (( segid "    " and resid 25   and name HG3 ))
   (( segid "    " and resid 25   and name HE2 ))
      3.400     1.500     1.500 peak  3567 spectrum    1 weight  0.10000E+01 volume  0.15774E-02 ppm1      1.149 ppm2      2.988 CV     1
 OR { 3567}
   (( segid "    " and resid 25   and name HG3 ))
   (( segid "    " and resid 25   and name HE3 ))
 ASSI { 3568}
   (( segid "    " and resid 25   and name HG3 ))
   (( segid "    " and resid 22   and name HA  ))
      4.600     2.600     1.400 peak  3568 spectrum    1 weight  0.10000E+01 volume  0.72486E-03 ppm1      1.140 ppm2      3.732 CV     1
 ASSI { 3569}
   (( segid "    " and resid 25   and name HD3 ))
   (  segid "    " and resid 22   and name HD2%)
      2.400     0.700     0.700 peak  3569 spectrum    1 weight  0.10000E+01 volume  0.66151E-02 ppm1      1.344 ppm2      0.947 CV     1
 OR { 3569}
   (( segid "    " and resid 25   and name HD2 ))
   (  segid "    " and resid 22   and name HD2%)
 ASSI { 3570}
   (( segid "    " and resid 25   and name HD2 ))
   (( segid "    " and resid 25   and name HG3 ))
      2.100     0.500     0.500 peak  3570 spectrum    1 weight  0.10000E+01 volume  0.11088E-01 ppm1      1.346 ppm2      1.173 CV     1
 OR { 3570}
   (( segid "    " and resid 25   and name HD3 ))
   (( segid "    " and resid 25   and name HG2 ))
 OR { 3570}
   (( segid "    " and resid 25   and name HD2 ))
   (( segid "    " and resid 25   and name HG2 ))
 OR { 3570}
   (( segid "    " and resid 25   and name HD3 ))
   (( segid "    " and resid 25   and name HG3 ))
 OR { 3570}
   (( segid "    " and resid 25   and name HD2 ))
   (( segid "    " and resid 25   and name HB3 ))
 ASSI { 3572}
   (( segid "    " and resid 25   and name HD3 ))
   (( segid "    " and resid 22   and name HG  ))
      4.700     2.700     1.300 peak  3572 spectrum    1 weight  0.10000E+01 volume  0.72840E-03 ppm1      1.345 ppm2      2.049 CV     1
 OR { 3572}
   (( segid "    " and resid 25   and name HD2 ))
   (( segid "    " and resid 22   and name HG  ))
 ASSI { 3573}
   (( segid "    " and resid 25   and name HD3 ))
   (( segid "    " and resid 22   and name HB2 ))
      5.000     3.100     1.000 peak  3573 spectrum    1 weight  0.10000E+01 volume  0.65917E-03 ppm1      1.345 ppm2      1.912 CV     1
 OR { 3573}
   (( segid "    " and resid 25   and name HD2 ))
   (( segid "    " and resid 22   and name HB2 ))
 ASSI { 3574}
   (( segid "    " and resid 25   and name HD3 ))
   (( segid "    " and resid 25   and name HE3 ))
      2.200     0.600     0.600 peak  3574 spectrum    1 weight  0.10000E+01 volume  0.84019E-02 ppm1      1.346 ppm2      2.992 CV     1
 OR { 3574}
   (( segid "    " and resid 25   and name HD3 ))
   (( segid "    " and resid 25   and name HE2 ))
 OR { 3574}
   (( segid "    " and resid 25   and name HD2 ))
   (( segid "    " and resid 25   and name HE3 ))
 OR { 3574}
   (( segid "    " and resid 25   and name HD2 ))
   (( segid "    " and resid 25   and name HE2 ))
 ASSI { 3575}
   (( segid "    " and resid 25   and name HD2 ))
   (( segid "    " and resid 25   and name HA  ))
      4.400     2.400     1.600 peak  3575 spectrum    1 weight  0.10000E+01 volume  0.13457E-02 ppm1      1.347 ppm2      3.851 CV     1
 OR { 3575}
   (( segid "    " and resid 25   and name HD3 ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI { 3579}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 26   and name H   ))
      3.400     1.400     1.400 peak  3579 spectrum    1 weight  0.10000E+01 volume  0.11829E-02 ppm1      3.854 ppm2      8.542 CV     1
 ASSI { 3581}
   (( segid "    " and resid 25   and name HB2 ))
   (  segid "    " and resid 21   and name HE% )
      3.600     1.600     1.600 peak  3581 spectrum    1 weight  0.10000E+01 volume  0.59993E-03 ppm1      1.481 ppm2      6.861 CV     1
 OR { 3581}
   (( segid "    " and resid 25   and name HB2 ))
   (  segid "    " and resid 21   and name HD% )
 ASSI { 3582}
   (( segid "    " and resid 25   and name HB3 ))
   (  segid "    " and resid 21   and name HE% )
      3.900     1.900     1.900 peak  3582 spectrum    1 weight  0.10000E+01 volume  0.42088E-03 ppm1      1.140 ppm2      6.853 CV     1
 ASSI { 3584}
   (( segid "    " and resid 25   and name HB3 ))
   (( segid "    " and resid 25   and name H   ))
      3.000     1.100     1.100 peak  3584 spectrum    1 weight  0.10000E+01 volume  0.10618E-02 ppm1      1.139 ppm2      8.037 CV     1
 ASSI { 3588}
   (( segid "    " and resid 25   and name HG3 ))
   (( segid "    " and resid 25   and name H   ))
      3.800     1.800     1.800 peak  3588 spectrum    1 weight  0.10000E+01 volume  0.10573E-02 ppm1      1.143 ppm2      8.037 CV     1
 ASSI { 3589}
   (( segid "    " and resid 25   and name HG3 ))
   (  segid "    " and resid 21   and name HE% )
      4.800     2.900     1.200 peak  3589 spectrum    1 weight  0.10000E+01 volume  0.63209E-03 ppm1      1.151 ppm2      6.873 CV     1
 OR { 3589}
   (( segid "    " and resid 25   and name HG3 ))
   (  segid "    " and resid 21   and name HD% )
 ASSI { 3591}
   (( segid "    " and resid 24   and name HB3 ))
   (  segid "    " and resid 32   and name HG2%)
      3.500     1.500     1.500 peak  3591 spectrum    1 weight  0.10000E+01 volume  0.17366E-02 ppm1      2.574 ppm2      1.023 CV     1
 ASSI { 3594}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 27   and name HB  ))
      3.300     1.400     1.400 peak  3594 spectrum    1 weight  0.10000E+01 volume  0.12824E-02 ppm1      4.929 ppm2      2.113 CV     1
 ASSI { 3596}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 93   and name HB2 ))
      3.000     1.100     1.100 peak  3596 spectrum    1 weight  0.10000E+01 volume  0.30463E-02 ppm1      4.934 ppm2      2.839 CV     1
 ASSI { 3601}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 25   and name H   ))
      3.300     1.400     1.400 peak  3601 spectrum    1 weight  0.10000E+01 volume  0.84323E-03 ppm1      4.942 ppm2      8.046 CV     1
 ASSI { 3602}
   (( segid "    " and resid 24   and name HB3 ))
   (( segid "    " and resid 30   and name HE21))
      3.600     1.600     1.600 peak  3602 spectrum    1 weight  0.10000E+01 volume  0.31292E-03 ppm1      2.577 ppm2      7.029 CV     1
 ASSI { 3606}
   (( segid "    " and resid 24   and name HB3 ))
   (( segid "    " and resid 24   and name HD22))
      4.800     2.900     1.200 peak  3606 spectrum    1 weight  0.10000E+01 volume  0.57369E-03 ppm1      2.576 ppm2      7.482 CV     1
 ASSI { 3607}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 24   and name HD22))
      4.600     2.700     1.400 peak  3607 spectrum    1 weight  0.10000E+01 volume  0.52541E-03 ppm1      2.490 ppm2      7.484 CV     1
 ASSI { 3608}
   (( segid "    " and resid 24   and name HB3 ))
   (( segid "    " and resid 24   and name HD21))
      4.300     2.300     1.700 peak  3608 spectrum    1 weight  0.10000E+01 volume  0.59929E-03 ppm1      2.552 ppm2      8.102 CV     1
 ASSI { 3611}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 22   and name HA  ))
      4.200     2.200     1.800 peak  3611 spectrum    1 weight  0.10000E+01 volume  0.37072E-03 ppm1      4.235 ppm2      3.730 CV     1
 ASSI { 3612}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 22   and name HB2 ))
      3.600     1.600     1.600 peak  3612 spectrum    1 weight  0.10000E+01 volume  0.75146E-03 ppm1      4.250 ppm2      1.901 CV     1
 ASSI { 3615}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 25   and name H   ))
      3.800     1.800     1.800 peak  3615 spectrum    1 weight  0.10000E+01 volume  0.54616E-03 ppm1      4.238 ppm2      8.060 CV     1
 ASSI { 3617}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 22   and name HD2%)
      2.200     0.600     0.600 peak  3617 spectrum    1 weight  0.10000E+01 volume  0.99550E-02 ppm1      3.720 ppm2      0.946 CV     1
 OR { 3617}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 22   and name HD1%)
 ASSI { 3619}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 25   and name HD3 ))
      2.300     0.600     0.600 peak  3619 spectrum    1 weight  0.10000E+01 volume  0.28848E-02 ppm1      3.717 ppm2      1.372 CV     1
 OR { 3619}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 25   and name HD2 ))
 ASSI { 3625}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HG  ))
      2.500     0.800     0.800 peak  3625 spectrum    1 weight  0.10000E+01 volume  0.28050E-02 ppm1      1.924 ppm2      2.048 CV     1
 ASSI { 3626}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 22   and name HB2 ))
      2.000     0.500     0.500 peak  3626 spectrum    1 weight  0.10000E+01 volume  0.46502E-02 ppm1      1.457 ppm2      1.919 CV     1
 ASSI { 3628}
   (( segid "    " and resid 22   and name HG  ))
   (  segid "    " and resid 22   and name HD1%)
      2.000     0.500     0.500 peak  3628 spectrum    1 weight  0.10000E+01 volume  0.11551E-01 ppm1      2.063 ppm2      0.946 CV     1
 OR { 3628}
   (( segid "    " and resid 22   and name HG  ))
   (  segid "    " and resid 22   and name HD2%)
 ASSI { 3630}
   (( segid "    " and resid 22   and name HG  ))
   (( segid "    " and resid 18   and name HG2 ))
      3.700     1.700     1.700 peak  3630 spectrum    1 weight  0.10000E+01 volume  0.13793E-02 ppm1      2.066 ppm2      1.638 CV     1
 ASSI { 3631}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 22   and name HB3 ))
      2.200     0.600     0.600 peak  3631 spectrum    1 weight  0.10000E+01 volume  0.13024E-01 ppm1      0.946 ppm2      1.450 CV     1
 ASSI { 3634}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 21   and name H   ))
      5.100     3.300     0.900 peak  3634 spectrum    1 weight  0.10000E+01 volume  0.33389E-03 ppm1      0.946 ppm2      8.937 CV     1
 ASSI { 3635}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 18   and name H   ))
      4.100     2.100     1.900 peak  3635 spectrum    1 weight  0.10000E+01 volume  0.12629E-02 ppm1      0.947 ppm2      8.307 CV     1
 ASSI { 3636}
   (( segid "    " and resid 22   and name HG  ))
   (  segid "    " and resid 21   and name HD% )
      4.500     2.500     1.500 peak  3636 spectrum    1 weight  0.10000E+01 volume  0.83018E-03 ppm1      2.066 ppm2      6.892 CV     1
 ASSI { 3639}
   (( segid "    " and resid 22   and name HG  ))
   (( segid "    " and resid 21   and name H   ))
      4.900     3.000     1.100 peak  3639 spectrum    1 weight  0.10000E+01 volume  0.27772E-03 ppm1      2.065 ppm2      8.931 CV     1
 ASSI { 3640}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 57   and name H   ))
      2.900     1.000     1.000 peak  3640 spectrum    1 weight  0.10000E+01 volume  0.14621E-02 ppm1      3.715 ppm2      7.859 CV     1
 ASSI { 3645}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 21   and name H   ))
      5.100     3.300     0.900 peak  3645 spectrum    1 weight  0.10000E+01 volume  0.21855E-03 ppm1      1.919 ppm2      8.927 CV     1
 ASSI { 3646}
   (( segid "    " and resid 22   and name HB3 ))
   (  segid "    " and resid 21   and name HD% )
      5.400     3.700     0.600 peak  3646 spectrum    1 weight  0.10000E+01 volume  0.27972E-03 ppm1      1.458 ppm2      6.894 CV     1
 ASSI { 3648}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 21   and name HD% )
      3.000     1.100     1.100 peak  3648 spectrum    1 weight  0.10000E+01 volume  0.22108E-02 ppm1      4.011 ppm2      6.897 CV     1
 ASSI { 3650}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 22   and name HA  ))
      3.100     1.200     1.200 peak  3650 spectrum    1 weight  0.10000E+01 volume  0.70355E-03 ppm1      6.904 ppm2      3.727 CV     1
 ASSI { 3651}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 21   and name HB3 ))
      2.500     0.800     0.800 peak  3651 spectrum    1 weight  0.10000E+01 volume  0.20886E-02 ppm1      6.904 ppm2      3.040 CV     1
 OR { 3651}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 3657}
   (  segid "    " and resid 21   and name HD% )
   (  segid "    " and resid 59   and name HD1%)
      3.000     1.100     1.100 peak  3657 spectrum    1 weight  0.10000E+01 volume  0.17018E-02 ppm1      6.903 ppm2      0.830 CV     1
 ASSI { 3658}
   (  segid "    " and resid 21   and name HD% )
   (  segid "    " and resid 54   and name HD1%)
      2.600     0.900     0.900 peak  3658 spectrum    1 weight  0.10000E+01 volume  0.21663E-02 ppm1      6.904 ppm2      0.409 CV     1
 OR { 3658}
   (  segid "    " and resid 21   and name HD% )
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 3659}
   (( segid "    " and resid 21   and name HB3 ))
   (  segid "    " and resid 54   and name HD2%)
      3.500     1.600     1.600 peak  3659 spectrum    1 weight  0.10000E+01 volume  0.90845E-03 ppm1      3.042 ppm2      0.397 CV     1
 OR { 3659}
   (( segid "    " and resid 21   and name HB2 ))
   (  segid "    " and resid 54   and name HD2%)
 OR { 3659}
   (( segid "    " and resid 21   and name HB2 ))
   (  segid "    " and resid 54   and name HD1%)
 ASSI { 3660}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 54   and name HD1%)
      4.600     2.700     1.400 peak  3660 spectrum    1 weight  0.10000E+01 volume  0.99342E-03 ppm1      4.014 ppm2      0.400 CV     1
 OR { 3660}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 3662}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 32   and name HG1%)
      4.400     2.400     1.600 peak  3662 spectrum    1 weight  0.10000E+01 volume  0.85918E-03 ppm1      4.017 ppm2      1.299 CV     1
 ASSI { 3665}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HB3 ))
      2.600     0.800     0.800 peak  3665 spectrum    1 weight  0.10000E+01 volume  0.21135E-02 ppm1      4.013 ppm2      3.045 CV     1
 OR { 3665}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 3673}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 24   and name H   ))
      3.600     1.700     1.700 peak  3673 spectrum    1 weight  0.10000E+01 volume  0.43237E-03 ppm1      4.008 ppm2      7.277 CV     1
 ASSI { 3674}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 22   and name H   ))
      3.600     1.700     1.700 peak  3674 spectrum    1 weight  0.10000E+01 volume  0.72527E-03 ppm1      4.009 ppm2      8.551 CV     1
 ASSI { 3675}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name H   ))
      2.900     1.100     1.100 peak  3675 spectrum    1 weight  0.10000E+01 volume  0.12514E-02 ppm1      4.011 ppm2      8.933 CV     1
 ASSI { 3677}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 25   and name HA  ))
      4.600     2.700     1.400 peak  3677 spectrum    1 weight  0.10000E+01 volume  0.42468E-03 ppm1      6.839 ppm2      3.838 CV     1
 ASSI { 3678}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 22   and name HA  ))
      4.600     2.600     1.400 peak  3678 spectrum    1 weight  0.10000E+01 volume  0.49168E-03 ppm1      6.837 ppm2      3.709 CV     1
 ASSI { 3686}
   (  segid "    " and resid 21   and name HE% )
   (  segid "    " and resid 54   and name HD1%)
      2.900     1.100     1.100 peak  3686 spectrum    1 weight  0.10000E+01 volume  0.24683E-02 ppm1      6.845 ppm2      0.417 CV     1
 OR { 3686}
   (  segid "    " and resid 21   and name HE% )
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 3688}
   (  segid "    " and resid 21   and name HE% )
   (  segid "    " and resid 66   and name HE% )
      2.900     1.100     1.100 peak  3688 spectrum    1 weight  0.10000E+01 volume  0.24616E-02 ppm1      6.841 ppm2      7.093 CV     1
 ASSI { 3698}
   (( segid "    " and resid 18   and name HD3 ))
   (( segid "    " and resid 19   and name H   ))
      4.600     2.700     1.400 peak  3698 spectrum    1 weight  0.10000E+01 volume  0.73405E-03 ppm1      3.332 ppm2      7.987 CV     1
 ASSI { 3699}
   (( segid "    " and resid 18   and name HD2 ))
   (( segid "    " and resid 19   and name H   ))
      4.600     2.600     1.400 peak  3699 spectrum    1 weight  0.10000E+01 volume  0.63501E-03 ppm1      3.276 ppm2      7.988 CV     1
 ASSI { 3700}
   (( segid "    " and resid 18   and name HD3 ))
   (( segid "    " and resid 18   and name H   ))
      4.100     2.100     1.900 peak  3700 spectrum    1 weight  0.10000E+01 volume  0.97279E-03 ppm1      3.333 ppm2      8.312 CV     1
 ASSI { 3702}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 111  and name HE  ))
      3.900     1.900     1.900 peak  3702 spectrum    1 weight  0.10000E+01 volume  0.35474E-03 ppm1      3.334 ppm2      7.415 CV     1
 ASSI { 3710}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 21   and name HB2 ))
      2.800     1.000     1.000 peak  3710 spectrum    1 weight  0.10000E+01 volume  0.10491E-02 ppm1      3.794 ppm2      3.043 CV     1
 OR { 3710}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 21   and name HB3 ))
 ASSI { 3711}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 18   and name HA  ))
      3.200     1.200     1.200 peak  3711 spectrum    1 weight  0.10000E+01 volume  0.23062E-02 ppm1      1.657 ppm2      3.797 CV     1
 OR { 3711}
   (( segid "    " and resid 18   and name HG3 ))
   (( segid "    " and resid 18   and name HA  ))
 ASSI { 3722}
   (( segid "    " and resid 18   and name HD3 ))
   (( segid "    " and resid 15   and name HA  ))
      3.600     1.600     1.600 peak  3722 spectrum    1 weight  0.10000E+01 volume  0.87751E-03 ppm1      3.337 ppm2      4.200 CV     1
 ASSI { 3723}
   (( segid "    " and resid 17   and name HB3 ))
   (( segid "    " and resid 18   and name H   ))
      2.900     1.100     1.100 peak  3723 spectrum    1 weight  0.10000E+01 volume  0.70255E-03 ppm1      2.222 ppm2      8.301 CV     1
 ASSI { 3726}
   (( segid "    " and resid 17   and name HB3 ))
   (  segid "    " and resid 17   and name HD2%)
      2.700     0.900     0.900 peak  3726 spectrum    1 weight  0.10000E+01 volume  0.16578E-02 ppm1      2.221 ppm2      0.738 CV     1
 ASSI { 3727}
   (( segid "    " and resid 17   and name HB3 ))
   (  segid "    " and resid 17   and name HD1%)
      3.800     1.800     1.800 peak  3727 spectrum    1 weight  0.10000E+01 volume  0.10599E-02 ppm1      2.232 ppm2      1.066 CV     1
 ASSI { 3728}
   (( segid "    " and resid 17   and name HB3 ))
   (( segid "    " and resid 17   and name HG  ))
      3.100     1.200     1.200 peak  3728 spectrum    1 weight  0.10000E+01 volume  0.67298E-03 ppm1      2.227 ppm2      1.486 CV     1
 ASSI { 3729}
   (( segid "    " and resid 17   and name HB3 ))
   (( segid "    " and resid 17   and name HB2 ))
      2.300     0.600     0.600 peak  3729 spectrum    1 weight  0.10000E+01 volume  0.11656E-02 ppm1      2.221 ppm2      1.785 CV     1
 ASSI { 3731}
   (  segid "    " and resid 17   and name HD1%)
   (  segid "    " and resid 54   and name HD2%)
      2.500     0.800     0.800 peak  3731 spectrum    1 weight  0.10000E+01 volume  0.79859E-02 ppm1      1.073 ppm2      0.400 CV     1
 OR { 3731}
   (  segid "    " and resid 17   and name HD1%)
   (  segid "    " and resid 54   and name HD1%)
 ASSI { 3732}
   (  segid "    " and resid 17   and name HD1%)
   (  segid "    " and resid 17   and name HD2%)
      2.000     0.500     0.500 peak  3732 spectrum    1 weight  0.10000E+01 volume  0.15153E-01 ppm1      1.073 ppm2      0.741 CV     1
 ASSI { 3733}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 17   and name HG  ))
      2.000     0.500     0.500 peak  3733 spectrum    1 weight  0.10000E+01 volume  0.93330E-02 ppm1      1.073 ppm2      1.486 CV     1
 ASSI { 3737}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 40   and name HB2 ))
      3.200     1.300     1.300 peak  3737 spectrum    1 weight  0.10000E+01 volume  0.35967E-02 ppm1      1.070 ppm2      1.904 CV     1
 OR { 3737}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 40   and name HG  ))
 ASSI { 3739}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 21   and name HB3 ))
      4.000     2.000     2.000 peak  3739 spectrum    1 weight  0.10000E+01 volume  0.10829E-02 ppm1      1.072 ppm2      3.034 CV     1
 OR { 3739}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 3740}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 53   and name HB3 ))
      4.300     2.300     1.700 peak  3740 spectrum    1 weight  0.10000E+01 volume  0.91000E-03 ppm1      1.071 ppm2      2.900 CV     1
 ASSI { 3742}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 50   and name HA  ))
      3.100     1.200     1.200 peak  3742 spectrum    1 weight  0.10000E+01 volume  0.17658E-02 ppm1      1.074 ppm2      3.779 CV     1
 ASSI { 3746}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 54   and name HA  ))
      3.100     1.200     1.200 peak  3746 spectrum    1 weight  0.10000E+01 volume  0.20126E-02 ppm1      0.736 ppm2      3.676 CV     1
 ASSI { 3747}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 53   and name HB3 ))
      2.900     1.100     1.100 peak  3747 spectrum    1 weight  0.10000E+01 volume  0.18960E-02 ppm1      0.735 ppm2      2.885 CV     1
 ASSI { 3748}
   (  segid "    " and resid 17   and name HD2%)
   (  segid "    " and resid 54   and name HD2%)
      2.400     0.700     0.700 peak  3748 spectrum    1 weight  0.10000E+01 volume  0.83681E-02 ppm1      0.735 ppm2      0.397 CV     1
 ASSI { 3752}
   (  segid "    " and resid 17   and name HD2%)
   (  segid "    " and resid 57   and name HE% )
      2.300     0.600     0.600 peak  3752 spectrum    1 weight  0.10000E+01 volume  0.55923E-02 ppm1      0.736 ppm2      1.985 CV     1
 ASSI { 3754}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 17   and name HG  ))
      2.100     0.600     0.600 peak  3754 spectrum    1 weight  0.10000E+01 volume  0.83118E-02 ppm1      0.735 ppm2      1.484 CV     1
 ASSI { 3755}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 9    and name HZ3 ))
      3.800     1.800     1.800 peak  3755 spectrum    1 weight  0.10000E+01 volume  0.17337E-02 ppm1      1.073 ppm2      6.807 CV     1
 ASSI { 3756}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 9    and name HH2 ))
      2.500     0.800     0.800 peak  3756 spectrum    1 weight  0.10000E+01 volume  0.14150E-02 ppm1      1.073 ppm2      6.729 CV     1
 ASSI { 3759}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 21   and name H   ))
      4.100     2.100     1.900 peak  3759 spectrum    1 weight  0.10000E+01 volume  0.77497E-03 ppm1      1.074 ppm2      8.932 CV     1
 ASSI { 3761}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 20   and name H   ))
      3.900     1.900     1.900 peak  3761 spectrum    1 weight  0.10000E+01 volume  0.10096E-02 ppm1      1.073 ppm2      8.678 CV     1
 ASSI { 3764}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 53   and name H   ))
      3.900     1.900     1.900 peak  3764 spectrum    1 weight  0.10000E+01 volume  0.15386E-02 ppm1      0.736 ppm2      8.131 CV     1
 ASSI { 3766}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 53   and name HD2 ))
      2.900     1.000     1.000 peak  3766 spectrum    1 weight  0.10000E+01 volume  0.31774E-02 ppm1      0.734 ppm2      5.764 CV     1
 ASSI { 3767}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 53   and name HD2 ))
      5.000     3.100     1.000 peak  3767 spectrum    1 weight  0.10000E+01 volume  0.37575E-03 ppm1      1.070 ppm2      5.764 CV     1
 ASSI { 3769}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 9    and name HZ2 ))
      3.000     1.100     1.100 peak  3769 spectrum    1 weight  0.10000E+01 volume  0.17305E-02 ppm1      0.735 ppm2      6.906 CV     1
 ASSI { 3770}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 9    and name HZ3 ))
      3.500     1.600     1.600 peak  3770 spectrum    1 weight  0.10000E+01 volume  0.25171E-02 ppm1      0.735 ppm2      6.802 CV     1
 ASSI { 3772}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 16   and name HB3 ))
      3.700     1.700     1.700 peak  3772 spectrum    1 weight  0.10000E+01 volume  0.79771E-03 ppm1      7.302 ppm2      3.380 CV     1
 OR { 3772}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 16   and name HB2 ))
 ASSI { 3773}
   (( segid "    " and resid 39   and name HE1 ))
   (  segid "    " and resid 20   and name HD1%)
      3.100     3.100     2.900 peak  3773 spectrum    1 weight  0.10000E+01 volume  0.19302E-03 ppm1      8.231 ppm2      0.665 CV     1
 ASSI { 3774}
   (( segid "    " and resid 39   and name HE1 ))
   (  segid "    " and resid 38   and name HB% )
      5.100     3.300     0.900 peak  3774 spectrum    1 weight  0.10000E+01 volume  0.39501E-03 ppm1      8.226 ppm2      1.282 CV     1
 ASSI { 3775}
   (( segid "    " and resid 39   and name HE1 ))
   (  segid "    " and resid 35   and name HB% )
      4.900     3.000     1.100 peak  3775 spectrum    1 weight  0.10000E+01 volume  0.22111E-03 ppm1      8.229 ppm2      1.429 CV     1
 ASSI { 3776}
   (( segid "    " and resid 39   and name HE1 ))
   (( segid "    " and resid 39   and name HD2 ))
      5.400     3.700     0.600 peak  3776 spectrum    1 weight  0.10000E+01 volume  0.17451E-03 ppm1      8.230 ppm2      7.414 CV     1
 ASSI { 3777}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 20   and name H   ))
      4.500     2.500     1.500 peak  3777 spectrum    1 weight  0.10000E+01 volume  0.41709E-03 ppm1      7.302 ppm2      8.668 CV     1
 ASSI { 3787}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 16   and name HA  ))
      3.900     1.900     1.900 peak  3787 spectrum    1 weight  0.10000E+01 volume  0.20793E-03 ppm1      3.402 ppm2      4.726 CV     1
 OR { 3787}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 16   and name HA  ))
 ASSI { 3795}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 19   and name HB3 ))
      5.100     3.300     0.900 peak  3795 spectrum    1 weight  0.10000E+01 volume  0.42687E-03 ppm1      3.393 ppm2      2.241 CV     1
 OR { 3795}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 19   and name HB2 ))
 OR { 3795}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 19   and name HB3 ))
 OR { 3795}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI { 3802}
   (( segid "    " and resid 16   and name HB3 ))
   (  segid "    " and resid 15   and name HB% )
      4.400     2.400     1.600 peak  3802 spectrum    1 weight  0.10000E+01 volume  0.69372E-03 ppm1      3.391 ppm2      1.566 CV     1
 OR { 3802}
   (( segid "    " and resid 16   and name HB2 ))
   (  segid "    " and resid 15   and name HB% )
 ASSI { 3804}
   (( segid "    " and resid 16   and name HB2 ))
   (  segid "    " and resid 40   and name HD1%)
      3.400     1.400     1.400 peak  3804 spectrum    1 weight  0.10000E+01 volume  0.16460E-02 ppm1      3.391 ppm2      0.976 CV     1
 OR { 3804}
   (( segid "    " and resid 16   and name HB2 ))
   (  segid "    " and resid 40   and name HD2%)
 OR { 3804}
   (( segid "    " and resid 16   and name HB3 ))
   (  segid "    " and resid 40   and name HD1%)
 OR { 3804}
   (( segid "    " and resid 16   and name HB3 ))
   (  segid "    " and resid 40   and name HD2%)
 ASSI { 3807}
   (( segid "    " and resid 16   and name HB2 ))
   (  segid "    " and resid 20   and name HD2%)
      4.700     2.700     1.300 peak  3807 spectrum    1 weight  0.10000E+01 volume  0.35387E-03 ppm1      3.344 ppm2      0.603 CV     1
 OR { 3807}
   (( segid "    " and resid 16   and name HB3 ))
   (  segid "    " and resid 20   and name HD2%)
 ASSI { 3810}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 19   and name HG2 ))
      3.600     1.700     1.700 peak  3810 spectrum    1 weight  0.10000E+01 volume  0.50679E-03 ppm1      7.297 ppm2      2.458 CV     1
 ASSI { 3811}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 19   and name HB3 ))
      3.000     1.100     1.100 peak  3811 spectrum    1 weight  0.10000E+01 volume  0.13537E-02 ppm1      7.301 ppm2      2.261 CV     1
 OR { 3811}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI { 3814}
   (( segid "    " and resid 16   and name HD2 ))
   (  segid "    " and resid 15   and name HB% )
      4.600     2.700     1.400 peak  3814 spectrum    1 weight  0.10000E+01 volume  0.56908E-03 ppm1      7.300 ppm2      1.570 CV     1
 ASSI { 3816}
   (( segid "    " and resid 16   and name HD2 ))
   (  segid "    " and resid 42   and name HG2%)
      4.600     2.700     1.400 peak  3816 spectrum    1 weight  0.10000E+01 volume  0.40640E-03 ppm1      7.302 ppm2      1.238 CV     1
 ASSI { 3818}
   (( segid "    " and resid 16   and name HD2 ))
   (  segid "    " and resid 20   and name HD2%)
      3.300     1.300     1.300 peak  3818 spectrum    1 weight  0.10000E+01 volume  0.17493E-02 ppm1      7.300 ppm2      0.633 CV     1
 ASSI { 3819}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 19   and name HB3 ))
      2.300     0.700     0.700 peak  3819 spectrum    1 weight  0.10000E+01 volume  0.21792E-02 ppm1      4.725 ppm2      2.261 CV     1
 OR { 3819}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI { 3821}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 19   and name HA  ))
      4.700     2.700     1.300 peak  3821 spectrum    1 weight  0.10000E+01 volume  0.73079E-03 ppm1      4.724 ppm2      4.011 CV     1
 ASSI { 3822}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 18   and name HG3 ))
      3.900     1.900     1.900 peak  3822 spectrum    1 weight  0.10000E+01 volume  0.13964E-02 ppm1      4.724 ppm2      1.690 CV     1
 ASSI { 3823}
   (( segid "    " and resid 16   and name HA  ))
   (  segid "    " and resid 15   and name HB% )
      4.200     2.200     1.800 peak  3823 spectrum    1 weight  0.10000E+01 volume  0.34238E-03 ppm1      4.738 ppm2      1.580 CV     1
 ASSI { 3824}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HD2 ))
      2.900     1.100     1.100 peak  3824 spectrum    1 weight  0.10000E+01 volume  0.14782E-02 ppm1      4.731 ppm2      7.294 CV     1
 ASSI { 3827}
   (  segid "    " and resid 15   and name HB% )
   (  segid "    " and resid 59   and name HD1%)
      5.600     4.000     0.400 peak  3827 spectrum    1 weight  0.10000E+01 volume  0.53814E-03 ppm1      1.569 ppm2      0.837 CV     1
 ASSI { 3829}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 19   and name HB2 ))
      2.800     1.000     1.000 peak  3829 spectrum    1 weight  0.10000E+01 volume  0.25387E-02 ppm1      1.572 ppm2      2.296 CV     1
 ASSI { 3831}
   (  segid "    " and resid 15   and name HB% )
   (  segid "    " and resid 57   and name HE% )
      2.800     2.800     3.200 peak  3831 spectrum    1 weight  0.10000E+01 volume  0.27527E-02 ppm1      1.572 ppm2      1.987 CV     1
 OR { 3831}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 57   and name HG2 ))
 ASSI { 3836}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 16   and name H   ))
      2.600     0.900     0.900 peak  3836 spectrum    1 weight  0.10000E+01 volume  0.54897E-02 ppm1      1.572 ppm2      7.982 CV     1
 ASSI { 3843}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HB2 ))
      2.800     1.000     1.000 peak  3843 spectrum    1 weight  0.10000E+01 volume  0.35231E-02 ppm1      3.988 ppm2      1.975 CV     1
 ASSI { 3847}
   (( segid "    " and resid 13   and name HB3 ))
   (  segid "    " and resid 43   and name HG1%)
      4.400     2.500     1.600 peak  3847 spectrum    1 weight  0.10000E+01 volume  0.77422E-03 ppm1      2.390 ppm2      0.743 CV     1
 OR { 3847}
   (( segid "    " and resid 13   and name HB3 ))
   (  segid "    " and resid 43   and name HG2%)
 OR { 3847}
   (( segid "    " and resid 13   and name HB2 ))
   (  segid "    " and resid 43   and name HG1%)
 OR { 3847}
   (( segid "    " and resid 13   and name HB2 ))
   (  segid "    " and resid 43   and name HG2%)
 ASSI { 3848}
   (( segid "    " and resid 13   and name HB3 ))
   (( segid "    " and resid 9    and name HB2 ))
      3.200     1.300     1.300 peak  3848 spectrum    1 weight  0.10000E+01 volume  0.72337E-03 ppm1      2.400 ppm2      2.862 CV     1
 OR { 3848}
   (( segid "    " and resid 13   and name HB3 ))
   (( segid "    " and resid 9    and name HB3 ))
 OR { 3848}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 9    and name HB2 ))
 OR { 3848}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 9    and name HB3 ))
 ASSI { 3850}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 110  and name HA  ))
      4.700     2.800     1.300 peak  3850 spectrum    1 weight  0.10000E+01 volume  0.34253E-03 ppm1      3.993 ppm2      4.453 CV     1
 ASSI { 3851}
   (( segid "    " and resid 18   and name HB3 ))
   (  segid "    " and resid 59   and name HD1%)
      2.600     0.800     0.800 peak  3851 spectrum    1 weight  0.10000E+01 volume  0.18837E-02 ppm1      2.083 ppm2      0.843 CV     1
 ASSI { 3852}
   (( segid "    " and resid 18   and name HB3 ))
   (( segid "    " and resid 18   and name HB2 ))
      1.700     0.400     0.500 peak  3852 spectrum    1 weight  0.10000E+01 volume  0.67768E-02 ppm1      2.081 ppm2      1.820 CV     1
 ASSI { 3854}
   (( segid "    " and resid 18   and name HB3 ))
   (( segid "    " and resid 18   and name HD3 ))
      2.800     1.000     1.000 peak  3854 spectrum    1 weight  0.10000E+01 volume  0.21405E-02 ppm1      2.084 ppm2      3.312 CV     1
 OR { 3854}
   (( segid "    " and resid 18   and name HB3 ))
   (( segid "    " and resid 18   and name HD2 ))
 ASSI { 3855}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 53   and name HD2 ))
      4.800     2.900     1.200 peak  3855 spectrum    1 weight  0.10000E+01 volume  0.22970E-03 ppm1      3.994 ppm2      5.765 CV     1
 ASSI { 3858}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 41   and name H   ))
      4.900     3.000     1.100 peak  3858 spectrum    1 weight  0.10000E+01 volume  0.20467E-03 ppm1      2.853 ppm2      8.421 CV     1
 ASSI { 3859}
   (( segid "    " and resid 14   and name HG3 ))
   (( segid "    " and resid 15   and name H   ))
      5.000     3.200     1.000 peak  3859 spectrum    1 weight  0.10000E+01 volume  0.34783E-03 ppm1      2.135 ppm2      8.279 CV     1
 ASSI { 3860}
   (( segid "    " and resid 14   and name HG3 ))
   (( segid "    " and resid 9    and name HE3 ))
      3.800     1.800     1.800 peak  3860 spectrum    1 weight  0.10000E+01 volume  0.37446E-03 ppm1      2.156 ppm2      7.062 CV     1
 ASSI { 3861}
   (( segid "    " and resid 14   and name HG3 ))
   (( segid "    " and resid 53   and name HD2 ))
      4.300     2.300     1.700 peak  3861 spectrum    1 weight  0.10000E+01 volume  0.36236E-03 ppm1      2.150 ppm2      5.763 CV     1
 ASSI { 3862}
   (( segid "    " and resid 14   and name HG3 ))
   (( segid "    " and resid 14   and name HA  ))
      3.500     1.500     1.500 peak  3862 spectrum    1 weight  0.10000E+01 volume  0.10099E-02 ppm1      2.146 ppm2      3.977 CV     1
 ASSI { 3864}
   (( segid "    " and resid 14   and name HG3 ))
   (( segid "    " and resid 14   and name HB2 ))
      3.700     1.700     1.700 peak  3864 spectrum    1 weight  0.10000E+01 volume  0.29939E-03 ppm1      2.146 ppm2      2.396 CV     1
 ASSI { 3865}
   (( segid "    " and resid 14   and name HG3 ))
   (  segid "    " and resid 17   and name HD2%)
      4.600     2.700     1.400 peak  3865 spectrum    1 weight  0.10000E+01 volume  0.50818E-03 ppm1      2.143 ppm2      0.731 CV     1
 ASSI { 3868}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 14   and name H   ))
      4.300     2.300     1.700 peak  3868 spectrum    1 weight  0.10000E+01 volume  0.74591E-03 ppm1      2.444 ppm2      8.720 CV     1
 OR { 3868}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 14   and name H   ))
 ASSI { 3871}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 12   and name HB3 ))
      2.300     0.600     0.600 peak  3871 spectrum    1 weight  0.10000E+01 volume  0.91872E-02 ppm1      2.451 ppm2      1.979 CV     1
 ASSI { 3872}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 12   and name HB2 ))
      2.300     0.700     0.700 peak  3872 spectrum    1 weight  0.10000E+01 volume  0.14643E-01 ppm1      2.444 ppm2      2.139 CV     1
 ASSI { 3873}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 9    and name HB3 ))
      4.200     2.200     1.800 peak  3873 spectrum    1 weight  0.10000E+01 volume  0.69338E-03 ppm1      2.416 ppm2      2.853 CV     1
 OR { 3873}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 9    and name HB2 ))
 OR { 3873}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 9    and name HB2 ))
 OR { 3873}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 9    and name HB3 ))
 ASSI { 3877}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HB2 ))
      2.500     0.800     0.800 peak  3877 spectrum    1 weight  0.10000E+01 volume  0.51954E-02 ppm1      4.252 ppm2      2.407 CV     1
 OR { 3877}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HG3 ))
 OR { 3877}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HB3 ))
 OR { 3877}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HG2 ))
 ASSI { 3878}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 16   and name HB2 ))
      3.200     1.300     1.300 peak  3878 spectrum    1 weight  0.10000E+01 volume  0.13943E-02 ppm1      4.252 ppm2      3.380 CV     1
 OR { 3878}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 16   and name HB3 ))
 ASSI { 3879}
   (( segid "    " and resid 124  and name HA  ))
   (  segid "    " and resid 130  and name HD1%)
      4.300     2.300     1.700 peak  3879 spectrum    1 weight  0.10000E+01 volume  0.15047E-02 ppm1      4.254 ppm2      0.979 CV     1
 ASSI { 3885}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 12   and name H   ))
      3.300     1.400     1.400 peak  3885 spectrum    1 weight  0.10000E+01 volume  0.75934E-03 ppm1      2.490 ppm2      8.968 CV     1
 ASSI { 3886}
   (( segid "    " and resid 11   and name HD3 ))
   (( segid "    " and resid 12   and name H   ))
      3.900     1.900     1.900 peak  3886 spectrum    1 weight  0.10000E+01 volume  0.47856E-03 ppm1      3.996 ppm2      8.966 CV     1
 OR { 3886}
   (( segid "    " and resid 11   and name HD2 ))
   (( segid "    " and resid 12   and name H   ))
 ASSI { 3887}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HB2 ))
      3.100     1.200     1.200 peak  3887 spectrum    1 weight  0.10000E+01 volume  0.25776E-02 ppm1      4.524 ppm2      2.484 CV     1
 ASSI { 3888}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 14   and name HB2 ))
      2.300     0.700     0.700 peak  3888 spectrum    1 weight  0.10000E+01 volume  0.17710E-02 ppm1      4.526 ppm2      2.415 CV     1
 ASSI { 3889}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HG3 ))
      2.900     1.100     1.100 peak  3889 spectrum    1 weight  0.10000E+01 volume  0.13828E-02 ppm1      4.521 ppm2      2.308 CV     1
 ASSI { 3892}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HB3 ))
      2.800     1.000     1.000 peak  3892 spectrum    1 weight  0.10000E+01 volume  0.13672E-02 ppm1      4.530 ppm2      1.988 CV     1
 ASSI { 3896}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 12   and name H   ))
      3.800     1.800     1.800 peak  3896 spectrum    1 weight  0.10000E+01 volume  0.41804E-03 ppm1      4.524 ppm2      8.982 CV     1
 ASSI { 3898}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 12   and name HA  ))
      3.900     1.900     1.900 peak  3898 spectrum    1 weight  0.10000E+01 volume  0.42060E-03 ppm1      2.484 ppm2      4.118 CV     1
 ASSI { 3899}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HD3 ))
      3.700     1.700     1.700 peak  3899 spectrum    1 weight  0.10000E+01 volume  0.88931E-03 ppm1      2.491 ppm2      3.998 CV     1
 OR { 3899}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HD2 ))
 ASSI { 3900}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HG3 ))
      3.300     1.400     1.400 peak  3900 spectrum    1 weight  0.10000E+01 volume  0.26326E-02 ppm1      2.490 ppm2      2.293 CV     1
 ASSI { 3901}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HB3 ))
      2.100     0.600     0.600 peak  3901 spectrum    1 weight  0.10000E+01 volume  0.40295E-02 ppm1      2.493 ppm2      2.007 CV     1
 ASSI { 3902}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HG2 ))
      2.700     0.900     0.900 peak  3902 spectrum    1 weight  0.10000E+01 volume  0.25507E-02 ppm1      2.493 ppm2      2.149 CV     1
 ASSI { 3903}
   (( segid "    " and resid 11   and name HB2 ))
   (  segid "    " and resid 15   and name HB% )
      4.500     2.600     1.500 peak  3903 spectrum    1 weight  0.10000E+01 volume  0.29880E-03 ppm1      2.488 ppm2      1.573 CV     1
 ASSI { 3907}
   (( segid "    " and resid 11   and name HD3 ))
   (( segid "    " and resid 11   and name HB3 ))
      4.700     2.800     1.300 peak  3907 spectrum    1 weight  0.10000E+01 volume  0.64442E-03 ppm1      3.995 ppm2      2.004 CV     1
 OR { 3907}
   (( segid "    " and resid 11   and name HD2 ))
   (( segid "    " and resid 11   and name HB3 ))
 ASSI { 3908}
   (( segid "    " and resid 11   and name HD3 ))
   (( segid "    " and resid 11   and name HG2 ))
      3.200     1.300     1.300 peak  3908 spectrum    1 weight  0.10000E+01 volume  0.97395E-03 ppm1      3.997 ppm2      2.154 CV     1
 OR { 3908}
   (( segid "    " and resid 11   and name HD2 ))
   (( segid "    " and resid 11   and name HG2 ))
 ASSI { 3909}
   (( segid "    " and resid 11   and name HD2 ))
   (( segid "    " and resid 11   and name HG3 ))
      3.300     1.300     1.300 peak  3909 spectrum    1 weight  0.10000E+01 volume  0.96835E-03 ppm1      3.996 ppm2      2.293 CV     1
 OR { 3909}
   (( segid "    " and resid 11   and name HD3 ))
   (( segid "    " and resid 11   and name HG3 ))
 ASSI { 3913}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 9    and name HB3 ))
      2.900     1.100     1.100 peak  3913 spectrum    1 weight  0.10000E+01 volume  0.16503E-02 ppm1      4.481 ppm2      2.874 CV     1
 OR { 3913}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 9    and name HB2 ))
 ASSI { 3914}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 9    and name HE3 ))
      4.800     2.900     1.200 peak  3914 spectrum    1 weight  0.10000E+01 volume  0.91692E-03 ppm1      4.482 ppm2      7.058 CV     1
 ASSI { 3916}
   (( segid "    " and resid 10   and name HB3 ))
   (( segid "    " and resid 12   and name H   ))
      4.900     3.100     1.100 peak  3916 spectrum    1 weight  0.10000E+01 volume  0.23958E-03 ppm1      4.070 ppm2      8.959 CV     1
 ASSI { 3917}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 12   and name H   ))
      4.100     2.100     1.900 peak  3917 spectrum    1 weight  0.10000E+01 volume  0.21879E-03 ppm1      4.484 ppm2      8.965 CV     1
 ASSI { 3918}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 10   and name H   ))
      4.300     2.300     1.700 peak  3918 spectrum    1 weight  0.10000E+01 volume  0.25083E-03 ppm1      4.493 ppm2      8.778 CV     1
 ASSI { 3919}
   (( segid "    " and resid 10   and name HB3 ))
   (( segid "    " and resid 10   and name HB2 ))
      3.000     3.000     3.000 peak  3919 spectrum    1 weight  0.10000E+01 volume  0.57585E-03 ppm1      4.061 ppm2      4.490 CV     1
 ASSI { 3923}
   (( segid "    " and resid 10   and name HB3 ))
   (( segid "    " and resid 11   and name HG3 ))
      5.500     3.700     0.500 peak  3923 spectrum    1 weight  0.10000E+01 volume  0.53790E-03 ppm1      4.083 ppm2      2.325 CV     1
 ASSI { 3925}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 53   and name HB3 ))
      3.200     1.300     1.300 peak  3925 spectrum    1 weight  0.10000E+01 volume  0.67403E-03 ppm1      5.765 ppm2      2.869 CV     1
 ASSI { 3926}
   (( segid "    " and resid 9    and name HD1 ))
   (( segid "    " and resid 9    and name HB3 ))
      3.500     1.500     1.500 peak  3926 spectrum    1 weight  0.10000E+01 volume  0.11338E-02 ppm1      6.974 ppm2      2.886 CV     1
 OR { 3926}
   (( segid "    " and resid 9    and name HD1 ))
   (( segid "    " and resid 9    and name HB2 ))
 ASSI { 3927}
   (( segid "    " and resid 9    and name HD1 ))
   (( segid "    " and resid 9    and name HE1 ))
      2.300     0.700     0.700 peak  3927 spectrum    1 weight  0.10000E+01 volume  0.36511E-02 ppm1      6.975 ppm2      9.895 CV     1
 ASSI { 3931}
   (( segid "    " and resid 9    and name HD1 ))
   (  segid "    " and resid 43   and name HG1%)
      4.800     2.900     1.200 peak  3931 spectrum    1 weight  0.10000E+01 volume  0.15274E-03 ppm1      6.968 ppm2      0.727 CV     1
 OR { 3931}
   (( segid "    " and resid 9    and name HD1 ))
   (  segid "    " and resid 43   and name HG2%)
 ASSI { 3934}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 43   and name HG1%)
      5.100     3.300     0.900 peak  3934 spectrum    1 weight  0.10000E+01 volume  0.30939E-03 ppm1      4.501 ppm2      0.731 CV     1
 OR { 3934}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 43   and name HG2%)
 ASSI { 3937}
   (( segid "    " and resid 9    and name HZ3 ))
   (  segid "    " and resid 40   and name HD1%)
      3.200     1.200     1.200 peak  3937 spectrum    1 weight  0.10000E+01 volume  0.12590E-02 ppm1      6.808 ppm2      0.957 CV     1
 OR { 3937}
   (( segid "    " and resid 9    and name HZ3 ))
   (  segid "    " and resid 40   and name HD2%)
 ASSI { 3940}
   (( segid "    " and resid 9    and name HZ3 ))
   (( segid "    " and resid 17   and name HB3 ))
      5.200     3.400     0.800 peak  3940 spectrum    1 weight  0.10000E+01 volume  0.27497E-03 ppm1      6.811 ppm2      2.238 CV     1
 ASSI { 3941}
   (( segid "    " and resid 9    and name HZ3 ))
   (( segid "    " and resid 13   and name HG3 ))
      3.700     1.700     1.700 peak  3941 spectrum    1 weight  0.10000E+01 volume  0.72522E-03 ppm1      6.801 ppm2      2.402 CV     1
 OR { 3941}
   (( segid "    " and resid 9    and name HZ3 ))
   (( segid "    " and resid 13   and name HG2 ))
 OR { 3941}
   (( segid "    " and resid 9    and name HZ3 ))
   (( segid "    " and resid 13   and name HB3 ))
 ASSI { 3944}
   (( segid "    " and resid 9    and name HH2 ))
   (  segid "    " and resid 17   and name HD2%)
      3.600     1.700     1.700 peak  3944 spectrum    1 weight  0.10000E+01 volume  0.62573E-03 ppm1      6.713 ppm2      0.741 CV     1
 ASSI { 3947}
   (( segid "    " and resid 9    and name HH2 ))
   (( segid "    " and resid 50   and name HG13))
      3.900     1.900     1.900 peak  3947 spectrum    1 weight  0.10000E+01 volume  0.55217E-03 ppm1      6.712 ppm2      1.581 CV     1
 OR { 3947}
   (( segid "    " and resid 9    and name HH2 ))
   (( segid "    " and resid 50   and name HG12))
 ASSI { 3952}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 9    and name HE1 ))
      3.200     1.300     1.300 peak  3952 spectrum    1 weight  0.10000E+01 volume  0.15111E-02 ppm1      6.921 ppm2      9.896 CV     1
 ASSI { 3959}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 45   and name HG3 ))
      5.100     3.200     0.900 peak  3959 spectrum    1 weight  0.10000E+01 volume  0.19097E-03 ppm1      6.926 ppm2      1.373 CV     1
 ASSI { 3960}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 49   and name HG2 ))
      4.800     2.900     1.200 peak  3960 spectrum    1 weight  0.10000E+01 volume  0.28944E-03 ppm1      6.921 ppm2      2.531 CV     1
 ASSI { 3961}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 13   and name HG3 ))
      4.900     3.000     1.100 peak  3961 spectrum    1 weight  0.10000E+01 volume  0.35811E-03 ppm1      6.916 ppm2      2.472 CV     1
 OR { 3961}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 13   and name HG2 ))
 ASSI { 3966}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 9    and name HH2 ))
      2.400     0.700     0.700 peak  3966 spectrum    1 weight  0.10000E+01 volume  0.27439E-02 ppm1      6.920 ppm2      6.717 CV     1
 ASSI { 3971}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 56   and name HE22))
      4.400     2.400     1.600 peak  3971 spectrum    1 weight  0.10000E+01 volume  0.15219E-02 ppm1      7.070 ppm2      6.872 CV     1
 ASSI { 3972}
   (( segid "    " and resid 9    and name HE3 ))
   (( segid "    " and resid 9    and name HZ3 ))
      2.600     0.800     0.800 peak  3972 spectrum    1 weight  0.10000E+01 volume  0.19065E-02 ppm1      7.072 ppm2      6.801 CV     1
 ASSI { 3977}
   (( segid "    " and resid 8    and name HB  ))
   (( segid "    " and resid 9    and name H   ))
      3.100     1.200     1.200 peak  3977 spectrum    1 weight  0.10000E+01 volume  0.31198E-02 ppm1      4.208 ppm2      8.680 CV     1
 ASSI { 3978}
   (( segid "    " and resid 8    and name HB  ))
   (( segid "    " and resid 8    and name H   ))
      3.900     1.900     1.900 peak  3978 spectrum    1 weight  0.10000E+01 volume  0.13504E-02 ppm1      4.207 ppm2      8.338 CV     1
 ASSI { 3979}
   (( segid "    " and resid 8    and name HB  ))
   (( segid "    " and resid 9    and name HD1 ))
      4.600     2.700     1.400 peak  3979 spectrum    1 weight  0.10000E+01 volume  0.78736E-03 ppm1      4.206 ppm2      6.973 CV     1
 ASSI { 3984}
   (( segid "    " and resid 8    and name HB  ))
   (( segid "    " and resid 9    and name HB3 ))
      4.700     2.800     1.300 peak  3984 spectrum    1 weight  0.10000E+01 volume  0.49691E-03 ppm1      4.211 ppm2      2.896 CV     1
 OR { 3984}
   (( segid "    " and resid 8    and name HB  ))
   (( segid "    " and resid 9    and name HB2 ))
 ASSI { 3985}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 64   and name HE3 ))
      2.600     2.600     3.400 peak  3985 spectrum    1 weight  0.10000E+01 volume  0.60146E-03 ppm1      4.200 ppm2      3.004 CV     1
 OR { 3985}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 64   and name HE2 ))
 ASSI { 3986}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 16   and name HB3 ))
      3.500     1.500     1.500 peak  3986 spectrum    1 weight  0.10000E+01 volume  0.58955E-03 ppm1      1.243 ppm2      3.355 CV     1
 ASSI { 3987}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 44   and name HD2 ))
      4.500     2.600     1.500 peak  3987 spectrum    1 weight  0.10000E+01 volume  0.63507E-03 ppm1      1.245 ppm2      3.572 CV     1
 ASSI { 3993}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 7    and name HB2 ))
      3.600     1.700     1.700 peak  3993 spectrum    1 weight  0.10000E+01 volume  0.20701E-02 ppm1      3.551 ppm2      1.720 CV     1
 ASSI { 3994}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 7    and name HB2 ))
      3.500     1.500     1.500 peak  3994 spectrum    1 weight  0.10000E+01 volume  0.12340E-02 ppm1      3.815 ppm2      1.718 CV     1
 ASSI { 3995}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 7    and name HG3 ))
      2.300     0.700     0.700 peak  3995 spectrum    1 weight  0.10000E+01 volume  0.70272E-02 ppm1      3.815 ppm2      1.954 CV     1
 OR { 3995}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 7    and name HG2 ))
 ASSI { 4000}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 7    and name HG2 ))
      2.100     0.600     0.600 peak  4000 spectrum    1 weight  0.10000E+01 volume  0.15252E-01 ppm1      1.719 ppm2      1.946 CV     1
 OR { 4000}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 7    and name HG3 ))
 ASSI { 4002}
   (( segid "    " and resid 7    and name HA  ))
   (  segid "    " and resid 43   and name HG1%)
      3.900     1.900     1.900 peak  4002 spectrum    1 weight  0.10000E+01 volume  0.79437E-03 ppm1      4.458 ppm2      0.734 CV     1
 OR { 4002}
   (( segid "    " and resid 7    and name HA  ))
   (  segid "    " and resid 43   and name HG2%)
 ASSI { 4003}
   (( segid "    " and resid 7    and name HA  ))
   (  segid "    " and resid 8    and name HG2%)
      3.900     1.900     1.900 peak  4003 spectrum    1 weight  0.10000E+01 volume  0.14745E-02 ppm1      4.458 ppm2      1.252 CV     1
 ASSI { 4004}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HB3 ))
      2.100     0.600     0.600 peak  4004 spectrum    1 weight  0.10000E+01 volume  0.92946E-02 ppm1      4.458 ppm2      2.239 CV     1
 ASSI { 4005}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HG2 ))
      3.100     1.200     1.200 peak  4005 spectrum    1 weight  0.10000E+01 volume  0.39153E-02 ppm1      4.458 ppm2      1.958 CV     1
 OR { 4005}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HG3 ))
 ASSI { 4006}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HB2 ))
      2.800     1.000     1.000 peak  4006 spectrum    1 weight  0.10000E+01 volume  0.55494E-02 ppm1      4.457 ppm2      1.720 CV     1
 ASSI { 4007}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HD3 ))
      3.600     1.600     1.600 peak  4007 spectrum    1 weight  0.10000E+01 volume  0.80027E-03 ppm1      4.455 ppm2      3.551 CV     1
 ASSI { 4008}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HD2 ))
      3.900     1.900     1.900 peak  4008 spectrum    1 weight  0.10000E+01 volume  0.88686E-03 ppm1      4.460 ppm2      3.812 CV     1
 ASSI { 4009}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 8    and name HA  ))
      3.900     1.900     1.900 peak  4009 spectrum    1 weight  0.10000E+01 volume  0.15858E-02 ppm1      4.460 ppm2      4.223 CV     1
 OR { 4009}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 8    and name HB  ))
 ASSI { 4013}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 7    and name HG2 ))
      3.800     1.800     1.800 peak  4013 spectrum    1 weight  0.10000E+01 volume  0.31434E-02 ppm1      4.561 ppm2      1.955 CV     1
 OR { 4013}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 7    and name HG3 ))
 ASSI { 4014}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 7    and name HB3 ))
      4.600     2.700     1.400 peak  4014 spectrum    1 weight  0.10000E+01 volume  0.10115E-02 ppm1      4.559 ppm2      2.237 CV     1
 ASSI { 4015}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 7    and name HD3 ))
      2.200     0.600     0.600 peak  4015 spectrum    1 weight  0.10000E+01 volume  0.81602E-02 ppm1      4.561 ppm2      3.552 CV     1
 ASSI { 4016}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 7    and name HD2 ))
      2.400     0.700     0.700 peak  4016 spectrum    1 weight  0.10000E+01 volume  0.10237E-01 ppm1      4.562 ppm2      3.814 CV     1
 ASSI { 4017}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 5    and name HA  ))
      4.000     2.000     2.000 peak  4017 spectrum    1 weight  0.10000E+01 volume  0.92203E-03 ppm1      4.563 ppm2      4.307 CV     1
 ASSI { 4018}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 43   and name HG1%)
      3.500     1.600     1.600 peak  4018 spectrum    1 weight  0.10000E+01 volume  0.12606E-02 ppm1      1.338 ppm2      0.744 CV     1
 OR { 4018}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 43   and name HG2%)
 ASSI { 4019}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 7    and name HB2 ))
      3.300     1.400     1.400 peak  4019 spectrum    1 weight  0.10000E+01 volume  0.35701E-02 ppm1      1.339 ppm2      1.733 CV     1
 ASSI { 4021}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 7    and name HB3 ))
      4.300     2.300     1.700 peak  4021 spectrum    1 weight  0.10000E+01 volume  0.15443E-02 ppm1      1.340 ppm2      2.231 CV     1
 ASSI { 4022}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 49   and name HG2 ))
      3.600     3.600     2.400 peak  4022 spectrum    1 weight  0.10000E+01 volume  0.13526E-02 ppm1      1.337 ppm2      2.574 CV     1
 ASSI { 4025}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 7    and name HD2 ))
      2.400     0.700     0.700 peak  4025 spectrum    1 weight  0.10000E+01 volume  0.44732E-02 ppm1      1.339 ppm2      3.815 CV     1
 ASSI { 4026}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 7    and name HD3 ))
      3.100     1.200     1.200 peak  4026 spectrum    1 weight  0.10000E+01 volume  0.56651E-02 ppm1      1.338 ppm2      3.551 CV     1
 ASSI { 4027}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 5    and name HA  ))
      3.800     1.800     1.800 peak  4027 spectrum    1 weight  0.10000E+01 volume  0.26404E-02 ppm1      1.339 ppm2      4.307 CV     1
 ASSI { 4029}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 49   and name HE21))
      3.400     1.400     1.400 peak  4029 spectrum    1 weight  0.10000E+01 volume  0.12076E-02 ppm1      1.338 ppm2      7.059 CV     1
 ASSI { 4030}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 49   and name HE22))
      3.500     1.600     1.600 peak  4030 spectrum    1 weight  0.10000E+01 volume  0.11445E-02 ppm1      1.337 ppm2      7.466 CV     1
 ASSI { 4033}
   (( segid "    " and resid 130  and name HA  ))
   (  segid "    " and resid 130  and name HD2%)
      2.700     0.900     0.900 peak  4033 spectrum    1 weight  0.10000E+01 volume  0.94593E-02 ppm1      4.299 ppm2      0.938 CV     1
 OR { 4033}
   (( segid "    " and resid 130  and name HA  ))
   (  segid "    " and resid 130  and name HD1%)
 ASSI { 4034}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 5    and name HG3 ))
      1.800     0.400     0.400 peak  4034 spectrum    1 weight  0.10000E+01 volume  0.46797E-01 ppm1      1.742 ppm2      1.632 CV     1
 OR { 4034}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 5    and name HG2 ))
 ASSI { 4035}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 5    and name HB3 ))
      1.200     0.200     1.000 peak  4035 spectrum    1 weight  0.10000E+01 volume  0.10992E+00 ppm1      1.742 ppm2      1.834 CV     1
 ASSI { 4036}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 86   and name HD3 ))
      2.300     0.700     0.700 peak  4036 spectrum    1 weight  0.10000E+01 volume  0.76129E-02 ppm1      1.804 ppm2      3.234 CV     1
 OR { 4036}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 86   and name HD2 ))
 ASSI { 4038}
   (  segid "    " and resid 118  and name HD1%)
   (  segid "    " and resid 88   and name HD% )
      3.500     1.600     1.600 peak  4038 spectrum    1 weight  0.10000E+01 volume  0.16604E-02 ppm1      0.504 ppm2      7.043 CV     1
 ASSI { 4041}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 118  and name H   ))
      3.300     1.400     1.400 peak  4041 spectrum    1 weight  0.10000E+01 volume  0.14240E-02 ppm1      0.504 ppm2      8.396 CV     1
 ASSI { 4044}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 123  and name H   ))
      4.200     2.200     1.800 peak  4044 spectrum    1 weight  0.10000E+01 volume  0.93013E-03 ppm1      0.503 ppm2      7.557 CV     1
 ASSI { 4045}
   (  segid "    " and resid 118  and name HD2%)
   (  segid "    " and resid 88   and name HE% )
      3.200     1.300     1.300 peak  4045 spectrum    1 weight  0.10000E+01 volume  0.11894E-02 ppm1      0.757 ppm2      7.194 CV     1
 ASSI { 4046}
   (  segid "    " and resid 118  and name HD2%)
   (  segid "    " and resid 88   and name HD% )
      2.800     1.000     1.000 peak  4046 spectrum    1 weight  0.10000E+01 volume  0.17464E-02 ppm1      0.755 ppm2      7.054 CV     1
 ASSI { 4048}
   (  segid "    " and resid 118  and name HD2%)
   (( segid "    " and resid 119  and name H   ))
      4.200     2.200     1.800 peak  4048 spectrum    1 weight  0.10000E+01 volume  0.93038E-03 ppm1      0.755 ppm2      7.874 CV     1
 ASSI { 4050}
   (  segid "    " and resid 118  and name HD2%)
   (( segid "    " and resid 118  and name H   ))
      3.600     1.700     1.700 peak  4050 spectrum    1 weight  0.10000E+01 volume  0.16653E-02 ppm1      0.756 ppm2      8.396 CV     1
 ASSI { 4052}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 123  and name HA  ))
      4.000     2.000     2.000 peak  4052 spectrum    1 weight  0.10000E+01 volume  0.15463E-02 ppm1      0.505 ppm2      3.954 CV     1
 ASSI { 4054}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 115  and name HA  ))
      4.200     2.200     1.800 peak  4054 spectrum    1 weight  0.10000E+01 volume  0.73532E-03 ppm1      0.505 ppm2      3.346 CV     1
 ASSI { 4055}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 88   and name HB3 ))
      3.400     1.400     1.400 peak  4055 spectrum    1 weight  0.10000E+01 volume  0.67166E-03 ppm1      0.505 ppm2      3.193 CV     1
 ASSI { 4056}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 88   and name HB2 ))
      3.300     1.400     1.400 peak  4056 spectrum    1 weight  0.10000E+01 volume  0.74399E-03 ppm1      0.504 ppm2      2.959 CV     1
 ASSI { 4057}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 85   and name HB2 ))
      3.800     1.800     1.800 peak  4057 spectrum    1 weight  0.10000E+01 volume  0.12611E-02 ppm1      0.504 ppm2      2.238 CV     1
 OR { 4057}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 85   and name HB3 ))
 ASSI { 4058}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 118  and name HB2 ))
      2.700     0.900     0.900 peak  4058 spectrum    1 weight  0.10000E+01 volume  0.25932E-02 ppm1      0.504 ppm2      2.009 CV     1
 ASSI { 4059}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 118  and name HG  ))
      2.300     0.700     0.700 peak  4059 spectrum    1 weight  0.10000E+01 volume  0.35489E-02 ppm1      0.504 ppm2      1.892 CV     1
 ASSI { 4066}
   (  segid "    " and resid 118  and name HD2%)
   (( segid "    " and resid 115  and name HA  ))
      2.700     0.900     0.900 peak  4066 spectrum    1 weight  0.10000E+01 volume  0.19871E-02 ppm1      0.755 ppm2      3.349 CV     1
 ASSI { 4069}
   (( segid "    " and resid 113  and name HG3 ))
   (( segid "    " and resid 127  and name HD3 ))
      4.000     2.000     2.000 peak  4069 spectrum    1 weight  0.10000E+01 volume  0.18669E-02 ppm1      1.875 ppm2      3.227 CV     1
 OR { 4069}
   (( segid "    " and resid 113  and name HG3 ))
   (( segid "    " and resid 127  and name HD2 ))
 OR { 4069}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 127  and name HD3 ))
 OR { 4069}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 127  and name HD2 ))
 ASSI { 4070}
   (( segid "    " and resid 119  and name HB3 ))
   (( segid "    " and resid 119  and name HA  ))
      2.900     1.100     1.100 peak  4070 spectrum    1 weight  0.10000E+01 volume  0.17738E-02 ppm1      1.536 ppm2      4.141 CV     1
 ASSI { 4071}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 87   and name H   ))
      3.400     1.500     1.500 peak  4071 spectrum    1 weight  0.10000E+01 volume  0.13788E-02 ppm1      1.032 ppm2      8.673 CV     1
 ASSI { 4077}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 104  and name HB2 ))
      3.000     1.100     1.100 peak  4077 spectrum    1 weight  0.10000E+01 volume  0.21315E-02 ppm1      1.104 ppm2      2.623 CV     1
 ASSI { 4081}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 101  and name HA  ))
      4.000     2.000     2.000 peak  4081 spectrum    1 weight  0.10000E+01 volume  0.98566E-03 ppm1      1.033 ppm2      3.624 CV     1
 ASSI { 4082}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 104  and name HB2 ))
      4.200     2.200     1.800 peak  4082 spectrum    1 weight  0.10000E+01 volume  0.74508E-03 ppm1      1.034 ppm2      2.612 CV     1
 ASSI { 4083}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 104  and name HB3 ))
      4.000     2.000     2.000 peak  4083 spectrum    1 weight  0.10000E+01 volume  0.71319E-03 ppm1      1.033 ppm2      2.896 CV     1
 ASSI { 4085}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 87   and name HG  ))
      2.400     0.700     0.700 peak  4085 spectrum    1 weight  0.10000E+01 volume  0.49246E-02 ppm1      1.033 ppm2      2.166 CV     1
 OR { 4085}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 87   and name HB2 ))
 ASSI { 4086}
   (  segid "    " and resid 87   and name HD2%)
   (  segid "    " and resid 91   and name HD% )
      4.300     2.300     1.700 peak  4086 spectrum    1 weight  0.10000E+01 volume  0.95621E-03 ppm1      1.031 ppm2      7.076 CV     1
 OR { 4086}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 91   and name HZ  ))
 ASSI { 4087}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 104  and name H   ))
      4.600     2.700     1.400 peak  4087 spectrum    1 weight  0.10000E+01 volume  0.46176E-03 ppm1      1.032 ppm2      7.358 CV     1
 ASSI { 4089}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 106  and name H   ))
      4.500     2.600     1.500 peak  4089 spectrum    1 weight  0.10000E+01 volume  0.35017E-03 ppm1      1.032 ppm2      9.154 CV     1
 ASSI { 4090}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 88   and name H   ))
      4.700     2.800     1.300 peak  4090 spectrum    1 weight  0.10000E+01 volume  0.54274E-03 ppm1      1.031 ppm2      8.897 CV     1
 ASSI { 4091}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 36   and name HA  ))
      5.000     3.100     1.000 peak  4091 spectrum    1 weight  0.10000E+01 volume  0.20871E-03 ppm1      1.144 ppm2      3.646 CV     1
 ASSI { 4092}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 40   and name HA  ))
      5.000     3.100     1.000 peak  4092 spectrum    1 weight  0.10000E+01 volume  0.34885E-03 ppm1      0.664 ppm2      4.457 CV     1
 ASSI { 4093}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 60   and name H   ))
      5.100     3.200     0.900 peak  4093 spectrum    1 weight  0.10000E+01 volume  0.37604E-03 ppm1      3.955 ppm2      7.066 CV     1
 ASSI { 4095}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 24   and name HD22))
      4.100     2.100     1.900 peak  4095 spectrum    1 weight  0.10000E+01 volume  0.13596E-02 ppm1      3.962 ppm2      7.482 CV     1
 ASSI { 4096}
   (( segid "    " and resid 108  and name HE3 ))
   (( segid "    " and resid 108  and name H   ))
      4.700     2.700     1.300 peak  4096 spectrum    1 weight  0.10000E+01 volume  0.21881E-03 ppm1      3.004 ppm2      8.178 CV     1
 OR { 4096}
   (( segid "    " and resid 108  and name HE2 ))
   (( segid "    " and resid 108  and name H   ))
 ASSI { 4099}
   (( segid "    " and resid 108  and name HE3 ))
   (( segid "    " and resid 109  and name H   ))
      4.800     2.900     1.200 peak  4099 spectrum    1 weight  0.10000E+01 volume  0.37256E-03 ppm1      2.960 ppm2      7.631 CV     1
 OR { 4099}
   (( segid "    " and resid 108  and name HE2 ))
   (( segid "    " and resid 109  and name H   ))
 ASSI { 4105}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 56   and name HB2 ))
      4.200     2.200     1.800 peak  4105 spectrum    1 weight  0.10000E+01 volume  0.28096E-03 ppm1      5.763 ppm2      1.717 CV     1
 ASSI { 4107}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 53   and name HA  ))
      3.900     1.900     1.900 peak  4107 spectrum    1 weight  0.10000E+01 volume  0.47038E-03 ppm1      5.766 ppm2      3.987 CV     1
 ASSI { 4111}
   (( segid "    " and resid 117  and name HD3 ))
   (( segid "    " and resid 117  and name HA  ))
      3.100     1.200     1.200 peak  4111 spectrum    1 weight  0.10000E+01 volume  0.96862E-03 ppm1      0.558 ppm2      4.009 CV     1
 ASSI { 4113}
   (( segid "    " and resid 117  and name HD3 ))
   (( segid "    " and resid 117  and name HD2 ))
      2.200     0.600     0.600 peak  4113 spectrum    1 weight  0.10000E+01 volume  0.17174E-02 ppm1      0.559 ppm2      1.170 CV     1
 ASSI { 4115}
   (( segid "    " and resid 117  and name HD2 ))
   (( segid "    " and resid 117  and name HA  ))
      3.800     1.800     1.800 peak  4115 spectrum    1 weight  0.10000E+01 volume  0.10777E-02 ppm1      1.169 ppm2      4.009 CV     1
 ASSI { 4116}
   (( segid "    " and resid 117  and name HB3 ))
   (( segid "    " and resid 117  and name HD3 ))
      3.700     1.700     1.700 peak  4116 spectrum    1 weight  0.10000E+01 volume  0.48269E-03 ppm1      1.558 ppm2      0.598 CV     1
 ASSI { 4117}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 117  and name HD3 ))
      4.500     2.600     1.500 peak  4117 spectrum    1 weight  0.10000E+01 volume  0.41806E-03 ppm1      1.322 ppm2      0.592 CV     1
 ASSI { 4118}
   (( segid "    " and resid 117  and name HB3 ))
   (( segid "    " and resid 117  and name H   ))
      5.200     3.400     0.800 peak  4118 spectrum    1 weight  0.10000E+01 volume  0.17088E-03 ppm1      1.560 ppm2      7.531 CV     1
 ASSI { 4119}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 117  and name H   ))
      3.900     1.900     1.900 peak  4119 spectrum    1 weight  0.10000E+01 volume  0.18534E-03 ppm1      1.333 ppm2      7.534 CV     1
 ASSI { 4120}
   (( segid "    " and resid 76   and name HH2 ))
   (  segid "    " and resid 84   and name HD2%)
      3.400     1.500     1.500 peak  4120 spectrum    1 weight  0.10000E+01 volume  0.78427E-03 ppm1      6.886 ppm2      0.612 CV     1
 ASSI { 4121}
   (( segid "    " and resid 76   and name HH2 ))
   (  segid "    " and resid 114  and name HD1%)
      3.500     1.500     1.500 peak  4121 spectrum    1 weight  0.10000E+01 volume  0.86896E-03 ppm1      6.885 ppm2      0.958 CV     1
 OR { 4121}
   (( segid "    " and resid 76   and name HH2 ))
   (  segid "    " and resid 114  and name HG2%)
 ASSI { 4124}
   (( segid "    " and resid 76   and name HH2 ))
   (( segid "    " and resid 114  and name HG13))
      4.700     2.700     1.300 peak  4124 spectrum    1 weight  0.10000E+01 volume  0.33517E-03 ppm1      6.898 ppm2      1.856 CV     1
 ASSI { 4125}
   (( segid "    " and resid 76   and name HH2 ))
   (( segid "    " and resid 114  and name HA  ))
      5.900     4.400     0.100 peak  4125 spectrum    1 weight  0.10000E+01 volume  0.13565E-03 ppm1      6.893 ppm2      3.869 CV     1
 ASSI { 4126}
   (( segid "    " and resid 9    and name HE3 ))
   (( segid "    " and resid 53   and name HD2 ))
      5.100     3.200     0.900 peak  4126 spectrum    1 weight  0.10000E+01 volume  0.11194E-03 ppm1      7.077 ppm2      5.789 CV     1
 ASSI { 4130}
   (( segid "    " and resid 53   and name HE1 ))
   (( segid "    " and resid 53   and name HB3 ))
      5.200     3.400     0.800 peak  4130 spectrum    1 weight  0.10000E+01 volume  0.25460E-03 ppm1      7.952 ppm2      2.899 CV     1
 ASSI { 4131}
   (( segid "    " and resid 53   and name HE1 ))
   (( segid "    " and resid 9    and name HZ2 ))
      5.700     4.000     0.300 peak  4131 spectrum    1 weight  0.10000E+01 volume  0.22615E-03 ppm1      7.952 ppm2      6.970 CV     1
 OR { 4131}
   (( segid "    " and resid 53   and name HE1 ))
   (( segid "    " and resid 9    and name HD1 ))
 ASSI { 4133}
   (( segid "    " and resid 66   and name HZ  ))
   (( segid "    " and resid 54   and name HA  ))
      3.100     3.100     2.900 peak  4133 spectrum    1 weight  0.10000E+01 volume  0.18819E-03 ppm1      6.941 ppm2      3.659 CV     1
 ASSI { 4136}
   (( segid "    " and resid 88   and name HZ  ))
   (  segid "    " and resid 88   and name HE% )
      2.400     0.700     0.700 peak  4136 spectrum    1 weight  0.10000E+01 volume  0.50048E-02 ppm1      7.049 ppm2      7.177 CV     1
 ASSI { 4140}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 89   and name HA  ))
      3.800     1.800     1.800 peak  4140 spectrum    1 weight  0.10000E+01 volume  0.36524E-03 ppm1      7.040 ppm2      3.739 CV     1
 ASSI { 4141}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 92   and name HA  ))
      5.700     4.000     0.300 peak  4141 spectrum    1 weight  0.10000E+01 volume  0.17217E-03 ppm1      7.045 ppm2      3.580 CV     1
 OR { 4141}
   (( segid "    " and resid 88   and name HZ  ))
   (( segid "    " and resid 92   and name HA  ))
 ASSI { 4143}
   (( segid "    " and resid 76   and name HZ3 ))
   (( segid "    " and resid 76   and name HE3 ))
      3.700     1.700     1.700 peak  4143 spectrum    1 weight  0.10000E+01 volume  0.44111E-03 ppm1      7.050 ppm2      7.370 CV     1
 ASSI { 4144}
   (( segid "    " and resid 76   and name HZ3 ))
   (( segid "    " and resid 76   and name HH2 ))
      3.500     1.500     1.500 peak  4144 spectrum    1 weight  0.10000E+01 volume  0.42833E-03 ppm1      7.047 ppm2      6.903 CV     1
 ASSI { 4145}
   (( segid "    " and resid 76   and name HZ3 ))
   (  segid "    " and resid 84   and name HD2%)
      4.000     2.000     2.000 peak  4145 spectrum    1 weight  0.10000E+01 volume  0.56908E-03 ppm1      7.047 ppm2      0.602 CV     1
 ASSI { 4148}
   (( segid "    " and resid 76   and name HZ3 ))
   (( segid "    " and resid 114  and name HG12))
      4.900     3.000     1.100 peak  4148 spectrum    1 weight  0.10000E+01 volume  0.27447E-03 ppm1      7.047 ppm2      1.210 CV     1
 ASSI { 4150}
   (( segid "    " and resid 76   and name HZ3 ))
   (( segid "    " and resid 84   and name HB2 ))
      4.200     2.200     1.800 peak  4150 spectrum    1 weight  0.10000E+01 volume  0.18393E-03 ppm1      7.048 ppm2      1.795 CV     1
 ASSI { 4151}
   (( segid "    " and resid 76   and name HZ3 ))
   (( segid "    " and resid 84   and name HB3 ))
      4.500     2.500     1.500 peak  4151 spectrum    1 weight  0.10000E+01 volume  0.16106E-03 ppm1      7.047 ppm2      2.023 CV     1
 ASSI { 4154}
   (( segid "    " and resid 76   and name HE3 ))
   (  segid "    " and resid 84   and name HD2%)
      4.700     2.800     1.300 peak  4154 spectrum    1 weight  0.10000E+01 volume  0.51567E-03 ppm1      7.365 ppm2      0.607 CV     1
 ASSI { 4161}
   (( segid "    " and resid 108  and name HG2 ))
   (( segid "    " and resid 108  and name H   ))
      2.800     1.000     1.000 peak  4161 spectrum    1 weight  0.10000E+01 volume  0.21779E-02 ppm1      1.457 ppm2      8.180 CV     1
 ASSI { 4162}
   (( segid "    " and resid 108  and name HG3 ))
   (( segid "    " and resid 108  and name H   ))
      3.300     1.400     1.400 peak  4162 spectrum    1 weight  0.10000E+01 volume  0.19100E-02 ppm1      1.401 ppm2      8.181 CV     1
 ASSI { 4163}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 109  and name HE  ))
      4.100     2.100     1.900 peak  4163 spectrum    1 weight  0.10000E+01 volume  0.24218E-03 ppm1      2.780 ppm2      6.508 CV     1
 ASSI { 4164}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 114  and name H   ))
      5.100     3.200     0.900 peak  4164 spectrum    1 weight  0.10000E+01 volume  0.22205E-03 ppm1      2.780 ppm2      8.095 CV     1
 ASSI { 4166}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 127  and name HA  ))
      3.900     1.900     1.900 peak  4166 spectrum    1 weight  0.10000E+01 volume  0.62734E-03 ppm1      6.741 ppm2      3.732 CV     1
 ASSI { 4168}
   (( segid "    " and resid 129  and name HG3 ))
   (( segid "    " and resid 131  and name H   ))
      5.000     3.100     1.000 peak  4168 spectrum    1 weight  0.10000E+01 volume  0.28551E-03 ppm1      2.397 ppm2      7.409 CV     1
 OR { 4168}
   (( segid "    " and resid 129  and name HG2 ))
   (( segid "    " and resid 131  and name H   ))
 ASSI { 4169}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 85   and name HE21))
      5.600     4.000     0.400 peak  4169 spectrum    1 weight  0.10000E+01 volume  0.14360E-03 ppm1      2.515 ppm2      6.839 CV     1
 ASSI { 4170}
   (( segid "    " and resid 73   and name HB  ))
   (  segid "    " and resid 73   and name HG2%)
      2.000     0.500     0.500 peak  4170 spectrum    1 weight  0.10000E+01 volume  0.18887E-01 ppm1      1.775 ppm2      0.827 CV     1
 OR { 4170}
   (( segid "    " and resid 73   and name HB  ))
   (  segid "    " and resid 73   and name HD1%)
 ASSI { 4171}
   (( segid "    " and resid 88   and name HZ  ))
   (( segid "    " and resid 89   and name HG3 ))
      6.000     4.800     0.000 peak  4171 spectrum    1 weight  0.10000E+01 volume  0.20983E-03 ppm1      7.092 ppm2      2.538 CV     1
 ASSI { 4172}
   (( segid "    " and resid 128  and name HB2 ))
   (  segid "    " and resid 131  and name HE% )
      4.800     2.900     1.200 peak  4172 spectrum    1 weight  0.10000E+01 volume  0.42512E-03 ppm1      1.858 ppm2      6.741 CV     1
 OR { 4172}
   (( segid "    " and resid 128  and name HB3 ))
   (  segid "    " and resid 131  and name HE% )
# Restraints file 3: ambig.tbl
 ASSI {    2}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 67   and name HA  ))
      2.400     0.700     0.700 peak     2 spectrum    1 weight  0.10000E+01 volume  0.63571E-02 ppm1      7.802 ppm2      4.411 CV     1
 OR {    2}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 65   and name HA  ))
 ASSI {    3}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 4    and name HA  ))
      2.300     0.600     0.600 peak     3 spectrum    1 weight  0.10000E+01 volume  0.94094E-02 ppm1      8.152 ppm2      4.316 CV     1
 OR {    3}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 5    and name HA  ))
 ASSI {    4}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 90   and name HA  ))
      2.800     1.000     1.000 peak     4 spectrum    1 weight  0.10000E+01 volume  0.27191E-02 ppm1      7.919 ppm2      3.746 CV     1
 OR {    4}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 89   and name HA  ))
 ASSI {   14}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 4    and name HD3 ))
      4.400     2.500     1.600 peak    14 spectrum    1 weight  0.10000E+01 volume  0.63327E-03 ppm1      8.156 ppm2      3.202 CV     1
 OR {   14}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 4    and name HD2 ))
 OR {   14}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 5    and name HD3 ))
 ASSI {   15}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 5    and name HB3 ))
      2.900     1.100     1.100 peak    15 spectrum    1 weight  0.10000E+01 volume  0.43327E-02 ppm1      8.152 ppm2      1.819 CV     1
 OR {   15}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 4    and name HB2 ))
 ASSI {   17}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 5    and name HG3 ))
      3.500     1.500     1.500 peak    17 spectrum    1 weight  0.10000E+01 volume  0.36307E-02 ppm1      8.153 ppm2      1.645 CV     1
 OR {   17}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 4    and name HG2 ))
 OR {   17}
   (( segid "    " and resid 5    and name H   ))
   (( segid "    " and resid 4    and name HG3 ))
 ASSI {   19}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 7    and name HA  ))
      3.200     3.200     2.800 peak    19 spectrum    1 weight  0.10000E+01 volume  0.28306E-02 ppm1      8.346 ppm2      4.411 CV     1
 OR {   19}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 43   and name HA  ))
 ASSI {   28}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 44   and name HG3 ))
      4.400     2.400     1.600 peak    28 spectrum    1 weight  0.10000E+01 volume  0.79959E-03 ppm1      8.343 ppm2      1.930 CV     1
 OR {   28}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 7    and name HG2 ))
 OR {   28}
   (( segid "    " and resid 6    and name H   ))
   (( segid "    " and resid 7    and name HG3 ))
 ASSI {   34}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 7    and name HD3 ))
      3.300     3.300     2.700 peak    34 spectrum    1 weight  0.10000E+01 volume  0.40993E-03 ppm1      8.349 ppm2      3.551 CV     1
 OR {   34}
   (( segid "    " and resid 8    and name H   ))
   (( segid "    " and resid 44   and name HD2 ))
 ASSI {   46}
   (( segid "    " and resid 9    and name HE1 ))
   (( segid "    " and resid 45   and name HD3 ))
      3.200     1.300     1.300 peak    46 spectrum    1 weight  0.10000E+01 volume  0.27388E-02 ppm1      9.902 ppm2      2.890 CV     1
 OR {   46}
   (( segid "    " and resid 9    and name HE1 ))
   (( segid "    " and resid 14   and name HG2 ))
 OR {   46}
   (( segid "    " and resid 9    and name HE1 ))
   (( segid "    " and resid 53   and name HB3 ))
 ASSI {   47}
   (( segid "    " and resid 9    and name HE1 ))
   (( segid "    " and resid 53   and name HB2 ))
      3.700     1.700     1.700 peak    47 spectrum    1 weight  0.10000E+01 volume  0.19245E-02 ppm1      9.903 ppm2      2.215 CV     1
 OR {   47}
   (( segid "    " and resid 9    and name HE1 ))
   (( segid "    " and resid 49   and name HB3 ))
 ASSI {   48}
   (( segid "    " and resid 9    and name HE1 ))
   (  segid "    " and resid 50   and name HD1%)
      4.300     2.400     1.700 peak    48 spectrum    1 weight  0.10000E+01 volume  0.50411E-03 ppm1      9.900 ppm2      0.912 CV     1
 OR {   48}
   (( segid "    " and resid 9    and name HE1 ))
   (  segid "    " and resid 40   and name HD2%)
 OR {   48}
   (( segid "    " and resid 9    and name HE1 ))
   (  segid "    " and resid 50   and name HG2%)
 ASSI {   49}
   (( segid "    " and resid 9    and name HE1 ))
   (  segid "    " and resid 43   and name HG2%)
      3.700     1.700     1.700 peak    49 spectrum    1 weight  0.10000E+01 volume  0.82912E-03 ppm1      9.906 ppm2      0.748 CV     1
 OR {   49}
   (( segid "    " and resid 9    and name HE1 ))
   (  segid "    " and resid 17   and name HD2%)
 ASSI {   60}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 14   and name HG3 ))
      4.100     2.100     1.900 peak    60 spectrum    1 weight  0.10000E+01 volume  0.55244E-03 ppm1      8.821 ppm2      2.145 CV     1
 OR {   60}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 12   and name HB2 ))
 OR {   60}
   (( segid "    " and resid 10   and name H   ))
   (( segid "    " and resid 11   and name HG2 ))
 ASSI {   64}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 11   and name HA  ))
      3.000     1.100     1.100 peak    64 spectrum    1 weight  0.10000E+01 volume  0.16562E-02 ppm1      8.971 ppm2      4.509 CV     1
 OR {   64}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 10   and name HB2 ))
 ASSI {   66}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 12   and name HG2 ))
      3.300     1.400     1.400 peak    66 spectrum    1 weight  0.10000E+01 volume  0.34632E-02 ppm1      8.971 ppm2      2.432 CV     1
 OR {   66}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 13   and name HB2 ))
 OR {   66}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 14   and name HB2 ))
 ASSI {   67}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 12   and name HG3 ))
      3.300     1.300     1.300 peak    67 spectrum    1 weight  0.10000E+01 volume  0.34572E-02 ppm1      8.972 ppm2      2.296 CV     1
 OR {   67}
   (( segid "    " and resid 12   and name H   ))
   (( segid "    " and resid 11   and name HG3 ))
 ASSI {   81}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 13   and name HA  ))
      3.400     1.500     1.500 peak    81 spectrum    1 weight  0.10000E+01 volume  0.13040E-02 ppm1      8.720 ppm2      4.240 CV     1
 OR {   81}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 15   and name HA  ))
 ASSI {   83}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 14   and name HG2 ))
      3.300     1.400     1.400 peak    83 spectrum    1 weight  0.10000E+01 volume  0.23848E-02 ppm1      8.720 ppm2      2.859 CV     1
 OR {   83}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 9    and name HB2 ))
 ASSI {   84}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 13   and name HB3 ))
      2.300     0.700     0.700 peak    84 spectrum    1 weight  0.10000E+01 volume  0.53019E-02 ppm1      8.722 ppm2      2.403 CV     1
 OR {   84}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 14   and name HB2 ))
 OR {   84}
   (( segid "    " and resid 14   and name H   ))
   (( segid "    " and resid 13   and name HB2 ))
 ASSI {   89}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 15   and name HA  ))
      2.300     0.700     0.700 peak    89 spectrum    1 weight  0.10000E+01 volume  0.61842E-02 ppm1      8.277 ppm2      4.201 CV     1
 OR {   89}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 13   and name HA  ))
 ASSI {   92}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 14   and name HG2 ))
      4.500     2.500     1.500 peak    92 spectrum    1 weight  0.10000E+01 volume  0.91864E-03 ppm1      8.279 ppm2      2.862 CV     1
 OR {   92}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 9    and name HB2 ))
 ASSI {   93}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 14   and name HB2 ))
      2.800     1.000     1.000 peak    93 spectrum    1 weight  0.10000E+01 volume  0.33576E-02 ppm1      8.276 ppm2      2.400 CV     1
 OR {   93}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 13   and name HB3 ))
 OR {   93}
   (( segid "    " and resid 15   and name H   ))
   (( segid "    " and resid 13   and name HB2 ))
 ASSI {  100}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 13   and name HA  ))
      3.000     1.100     1.100 peak   100 spectrum    1 weight  0.10000E+01 volume  0.18956E-02 ppm1      7.987 ppm2      4.225 CV     1
 OR {  100}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 15   and name HA  ))
 ASSI {  103}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 13   and name HG3 ))
      3.900     1.900     1.900 peak   103 spectrum    1 weight  0.10000E+01 volume  0.11878E-02 ppm1      7.987 ppm2      2.393 CV     1
 OR {  103}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 14   and name HB2 ))
 OR {  103}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 13   and name HB3 ))
 OR {  103}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 13   and name HB2 ))
 OR {  103}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 19   and name HG3 ))
 ASSI {  110}
   (( segid "    " and resid 16   and name H   ))
   (  segid "    " and resid 40   and name HD1%)
      4.300     2.300     1.700 peak   110 spectrum    1 weight  0.10000E+01 volume  0.90446E-03 ppm1      7.991 ppm2      0.985 CV     1
 OR {  110}
   (( segid "    " and resid 16   and name H   ))
   (  segid "    " and resid 40   and name HD2%)
 OR {  110}
   (( segid "    " and resid 16   and name H   ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI {  111}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 19   and name HB3 ))
      4.100     2.100     1.900 peak   111 spectrum    1 weight  0.10000E+01 volume  0.11965E-02 ppm1      7.981 ppm2      2.202 CV     1
 OR {  111}
   (( segid "    " and resid 16   and name H   ))
   (( segid "    " and resid 17   and name HB3 ))
 ASSI {  115}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 15   and name HA  ))
      4.000     2.000     2.000 peak   115 spectrum    1 weight  0.10000E+01 volume  0.71767E-03 ppm1      8.778 ppm2      4.235 CV     1
 OR {  115}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 13   and name HA  ))
 ASSI {  116}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 14   and name HA  ))
      2.500     0.800     0.800 peak   116 spectrum    1 weight  0.10000E+01 volume  0.32581E-02 ppm1      8.775 ppm2      3.972 CV     1
 OR {  116}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI {  122}
   (( segid "    " and resid 17   and name H   ))
   (  segid "    " and resid 40   and name HD1%)
      3.400     1.400     1.400 peak   122 spectrum    1 weight  0.10000E+01 volume  0.23328E-02 ppm1      8.776 ppm2      0.972 CV     1
 OR {  122}
   (( segid "    " and resid 17   and name H   ))
   (  segid "    " and resid 40   and name HD2%)
 OR {  122}
   (( segid "    " and resid 17   and name H   ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI {  125}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 18   and name H   ))
      2.700     0.900     0.900 peak   125 spectrum    1 weight  0.10000E+01 volume  0.20345E-02 ppm1      8.776 ppm2      8.309 CV     1
 OR {  125}
   (( segid "    " and resid 17   and name H   ))
   (( segid "    " and resid 15   and name H   ))
 ASSI {  128}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 17   and name HA  ))
      3.300     1.300     1.300 peak   128 spectrum    1 weight  0.10000E+01 volume  0.19055E-02 ppm1      8.314 ppm2      3.982 CV     1
 OR {  128}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 14   and name HA  ))
 OR {  128}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI {  131}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 18   and name HB3 ))
      2.300     0.700     0.700 peak   131 spectrum    1 weight  0.10000E+01 volume  0.46343E-02 ppm1      8.313 ppm2      2.089 CV     1
 OR {  131}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 14   and name HB3 ))
 ASSI {  132}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 17   and name HB2 ))
      3.000     1.100     1.100 peak   132 spectrum    1 weight  0.10000E+01 volume  0.44749E-02 ppm1      8.314 ppm2      1.792 CV     1
 OR {  132}
   (( segid "    " and resid 18   and name H   ))
   (( segid "    " and resid 18   and name HB2 ))
 ASSI {  133}
   (( segid "    " and resid 18   and name H   ))
   (  segid "    " and resid 36   and name HG2%)
      3.900     1.900     1.900 peak   133 spectrum    1 weight  0.10000E+01 volume  0.16502E-02 ppm1      8.314 ppm2      0.957 CV     1
 OR {  133}
   (( segid "    " and resid 18   and name H   ))
   (  segid "    " and resid 40   and name HD1%)
 OR {  133}
   (( segid "    " and resid 18   and name H   ))
   (  segid "    " and resid 22   and name HD2%)
 OR {  133}
   (( segid "    " and resid 18   and name H   ))
   (  segid "    " and resid 22   and name HD1%)
 OR {  133}
   (( segid "    " and resid 18   and name H   ))
   (  segid "    " and resid 59   and name HD2%)
 ASSI {  142}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 18   and name HB2 ))
      3.500     1.600     1.600 peak   142 spectrum    1 weight  0.10000E+01 volume  0.16055E-02 ppm1      7.991 ppm2      1.785 CV     1
 OR {  142}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 17   and name HB2 ))
 ASSI {  144}
   (( segid "    " and resid 19   and name H   ))
   (( segid "    " and resid 18   and name HG2 ))
      3.100     1.200     1.200 peak   144 spectrum    1 weight  0.10000E+01 volume  0.14854E-02 ppm1      7.989 ppm2      1.614 CV     1
 OR {  144}
   (( segid "    " and resid 19   and name H   ))
   (  segid "    " and resid 15   and name HB% )
 ASSI {  145}
   (( segid "    " and resid 19   and name H   ))
   (  segid "    " and resid 22   and name HD1%)
      4.100     2.100     1.900 peak   145 spectrum    1 weight  0.10000E+01 volume  0.93116E-03 ppm1      7.983 ppm2      0.955 CV     1
 OR {  145}
   (( segid "    " and resid 19   and name H   ))
   (  segid "    " and resid 22   and name HD2%)
 OR {  145}
   (( segid "    " and resid 19   and name H   ))
   (  segid "    " and resid 36   and name HG2%)
 OR {  145}
   (( segid "    " and resid 19   and name H   ))
   (  segid "    " and resid 36   and name HD1%)
 OR {  145}
   (( segid "    " and resid 19   and name H   ))
   (  segid "    " and resid 59   and name HD2%)
 ASSI {  146}
   (( segid "    " and resid 19   and name H   ))
   (  segid "    " and resid 59   and name HD2%)
      4.900     3.000     1.100 peak   146 spectrum    1 weight  0.10000E+01 volume  0.58473E-03 ppm1      7.992 ppm2      0.884 CV     1
 OR {  146}
   (( segid "    " and resid 19   and name H   ))
   (  segid "    " and resid 50   and name HG2%)
 ASSI {  150}
   (( segid "    " and resid 63   and name H   ))
   (( segid "    " and resid 62   and name HB2 ))
      2.500     0.800     0.800 peak   150 spectrum    1 weight  0.10000E+01 volume  0.61969E-02 ppm1      8.670 ppm2      3.983 CV     1
 OR {  150}
   (( segid "    " and resid 63   and name H   ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI {  153}
   (( segid "    " and resid 20   and name H   ))
   (( segid "    " and resid 20   and name HB3 ))
      3.400     1.400     1.400 peak   153 spectrum    1 weight  0.10000E+01 volume  0.18674E-02 ppm1      8.677 ppm2      2.059 CV     1
 OR {  153}
   (( segid "    " and resid 20   and name H   ))
   (( segid "    " and resid 36   and name HG13))
 ASSI {  154}
   (( segid "    " and resid 20   and name H   ))
   (( segid "    " and resid 20   and name HG  ))
      3.800     1.800     1.800 peak   154 spectrum    1 weight  0.10000E+01 volume  0.22794E-02 ppm1      8.676 ppm2      1.677 CV     1
 OR {  154}
   (( segid "    " and resid 20   and name H   ))
   (( segid "    " and resid 18   and name HG3 ))
 ASSI {  157}
   (( segid "    " and resid 21   and name H   ))
   (( segid "    " and resid 21   and name HA  ))
      2.700     0.900     0.900 peak   157 spectrum    1 weight  0.10000E+01 volume  0.26514E-02 ppm1      8.941 ppm2      4.004 CV     1
 OR {  157}
   (( segid "    " and resid 21   and name H   ))
   (( segid "    " and resid 20   and name HA  ))
 ASSI {  160}
   (( segid "    " and resid 21   and name H   ))
   (( segid "    " and resid 20   and name HB3 ))
      3.100     1.200     1.200 peak   160 spectrum    1 weight  0.10000E+01 volume  0.14313E-02 ppm1      8.941 ppm2      2.075 CV     1
 OR {  160}
   (( segid "    " and resid 21   and name H   ))
   (( segid "    " and resid 36   and name HG13))
 OR {  160}
   (( segid "    " and resid 21   and name H   ))
   (( segid "    " and resid 22   and name HG  ))
 ASSI {  161}
   (( segid "    " and resid 21   and name H   ))
   (  segid "    " and resid 36   and name HD1%)
      3.300     1.400     1.400 peak   161 spectrum    1 weight  0.10000E+01 volume  0.25653E-02 ppm1      8.942 ppm2      0.954 CV     1
 OR {  161}
   (( segid "    " and resid 21   and name H   ))
   (  segid "    " and resid 36   and name HG2%)
 OR {  161}
   (( segid "    " and resid 21   and name H   ))
   (  segid "    " and resid 22   and name HD2%)
 OR {  161}
   (( segid "    " and resid 21   and name H   ))
   (  segid "    " and resid 22   and name HD1%)
 ASSI {  167}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 21   and name HA  ))
      3.400     1.400     1.400 peak   167 spectrum    1 weight  0.10000E+01 volume  0.10763E-02 ppm1      8.556 ppm2      4.019 CV     1
 OR {  167}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI {  172}
   (( segid "    " and resid 22   and name H   ))
   (( segid "    " and resid 22   and name HB3 ))
      3.500     1.600     1.600 peak   172 spectrum    1 weight  0.10000E+01 volume  0.19491E-02 ppm1      8.556 ppm2      1.444 CV     1
 OR {  172}
   (( segid "    " and resid 22   and name H   ))
   (  segid "    " and resid 23   and name HB% )
 ASSI {  177}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 20   and name HA  ))
      2.900     1.100     1.100 peak   177 spectrum    1 weight  0.10000E+01 volume  0.23529E-02 ppm1      7.851 ppm2      3.994 CV     1
 OR {  177}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 21   and name HA  ))
 OR {  177}
   (( segid "    " and resid 23   and name H   ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI {  185}
   (( segid "    " and resid 23   and name H   ))
   (  segid "    " and resid 22   and name HD2%)
      3.300     1.400     1.400 peak   185 spectrum    1 weight  0.10000E+01 volume  0.32120E-02 ppm1      7.846 ppm2      0.951 CV     1
 OR {  185}
   (( segid "    " and resid 23   and name H   ))
   (  segid "    " and resid 36   and name HD1%)
 ASSI {  191}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 21   and name HA  ))
      3.300     1.400     1.400 peak   191 spectrum    1 weight  0.10000E+01 volume  0.10882E-02 ppm1      7.280 ppm2      4.001 CV     1
 OR {  191}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 20   and name HA  ))
 OR {  191}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 32   and name HA  ))
 ASSI {  201}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 22   and name H   ))
      4.000     2.000     2.000 peak   201 spectrum    1 weight  0.10000E+01 volume  0.87079E-03 ppm1      7.281 ppm2      8.554 CV     1
 OR {  201}
   (( segid "    " and resid 24   and name H   ))
   (( segid "    " and resid 26   and name H   ))
 ASSI {  205}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 21   and name HA  ))
      3.800     1.800     1.800 peak   205 spectrum    1 weight  0.10000E+01 volume  0.76505E-03 ppm1      8.052 ppm2      3.979 CV     1
 OR {  205}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 32   and name HA  ))
 ASSI {  206}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 24   and name HB2 ))
      4.000     2.000     2.000 peak   206 spectrum    1 weight  0.10000E+01 volume  0.80463E-03 ppm1      8.050 ppm2      2.475 CV     1
 OR {  206}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 26   and name HB3 ))
 ASSI {  214}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 24   and name H   ))
      2.800     0.900     0.900 peak   214 spectrum    1 weight  0.10000E+01 volume  0.24667E-02 ppm1      8.045 ppm2      7.283 CV     1
 OR {  214}
   (( segid "    " and resid 25   and name H   ))
   (( segid "    " and resid 27   and name H   ))
 ASSI {  216}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 113  and name HB2 ))
      4.500     2.500     1.500 peak   216 spectrum    1 weight  0.10000E+01 volume  0.62064E-03 ppm1      8.536 ppm2      2.240 CV     1
 OR {  216}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 113  and name HB3 ))
 OR {  216}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 114  and name HB  ))
 ASSI {  217}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 113  and name HB2 ))
      4.500     2.600     1.500 peak   217 spectrum    1 weight  0.10000E+01 volume  0.62290E-03 ppm1      8.534 ppm2      2.173 CV     1
 OR {  217}
   (( segid "    " and resid 112  and name H   ))
   (  segid "    " and resid 102  and name HE% )
 OR {  217}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 113  and name HB3 ))
 ASSI {  218}
   (( segid "    " and resid 26   and name H   ))
   (  segid "    " and resid 27   and name HG1%)
      3.700     1.700     1.700 peak   218 spectrum    1 weight  0.10000E+01 volume  0.19355E-02 ppm1      8.538 ppm2      0.936 CV     1
 OR {  218}
   (( segid "    " and resid 112  and name H   ))
   (  segid "    " and resid 115  and name HG2%)
 ASSI {  219}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 25   and name HA  ))
      3.100     1.200     1.200 peak   219 spectrum    1 weight  0.10000E+01 volume  0.20328E-02 ppm1      8.546 ppm2      3.861 CV     1
 OR {  219}
   (( segid "    " and resid 26   and name H   ))
   (( segid "    " and resid 27   and name HA  ))
 ASSI {  233}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 26   and name HB3 ))
      4.200     2.200     1.800 peak   233 spectrum    1 weight  0.10000E+01 volume  0.89966E-03 ppm1      7.303 ppm2      2.492 CV     1
 OR {  233}
   (( segid "    " and resid 27   and name H   ))
   (( segid "    " and resid 24   and name HB2 ))
 ASSI {  246}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 27   and name HA  ))
      2.700     2.700     3.300 peak   246 spectrum    1 weight  0.10000E+01 volume  0.84275E-03 ppm1      8.853 ppm2      3.886 CV     1
 OR {  246}
   (( segid "    " and resid 29   and name H   ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI {  253}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 29   and name HA2 ))
      3.200     1.300     1.300 peak   253 spectrum    1 weight  0.10000E+01 volume  0.20691E-02 ppm1      7.495 ppm2      4.099 CV     1
 OR {  253}
   (( segid "    " and resid 30   and name H   ))
   (( segid "    " and resid 28   and name HA  ))
 ASSI {  284}
   (( segid "    " and resid 32   and name H   ))
   (  segid "    " and resid 33   and name HG1%)
      4.300     2.300     1.700 peak   284 spectrum    1 weight  0.10000E+01 volume  0.68997E-03 ppm1      9.099 ppm2      0.944 CV     1
 OR {  284}
   (( segid "    " and resid 32   and name H   ))
   (  segid "    " and resid 27   and name HG1%)
 OR {  284}
   (( segid "    " and resid 32   and name H   ))
   (  segid "    " and resid 36   and name HD1%)
 OR {  284}
   (( segid "    " and resid 32   and name H   ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI {  286}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 32   and name HA  ))
      3.500     1.600     1.600 peak   286 spectrum    1 weight  0.10000E+01 volume  0.11405E-02 ppm1      7.982 ppm2      3.966 CV     1
 OR {  286}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 34   and name HA  ))
 OR {  286}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI {  288}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 33   and name HB  ))
      2.600     0.800     0.800 peak   288 spectrum    1 weight  0.10000E+01 volume  0.31399E-02 ppm1      7.981 ppm2      2.337 CV     1
 OR {  288}
   (( segid "    " and resid 33   and name H   ))
   (( segid "    " and resid 32   and name HB  ))
 ASSI {  292}
   (( segid "    " and resid 33   and name H   ))
   (  segid "    " and resid 33   and name HG1%)
      2.400     0.700     0.700 peak   292 spectrum    1 weight  0.10000E+01 volume  0.54785E-02 ppm1      7.982 ppm2      0.946 CV     1
 OR {  292}
   (( segid "    " and resid 33   and name H   ))
   (  segid "    " and resid 33   and name HG2%)
 OR {  292}
   (( segid "    " and resid 33   and name H   ))
   (  segid "    " and resid 36   and name HD1%)
 ASSI {  304}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 34   and name HA  ))
      2.700     0.900     0.900 peak   304 spectrum    1 weight  0.10000E+01 volume  0.31582E-02 ppm1      7.876 ppm2      3.978 CV     1
 OR {  304}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 32   and name HA  ))
 ASSI {  307}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 131  and name HB2 ))
      3.700     1.700     1.700 peak   307 spectrum    1 weight  0.10000E+01 volume  0.24447E-02 ppm1      7.871 ppm2      2.834 CV     1
 OR {  307}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 31   and name HB3 ))
 ASSI {  312}
   (( segid "    " and resid 35   and name H   ))
   (  segid "    " and resid 33   and name HG1%)
      3.400     1.400     1.400 peak   312 spectrum    1 weight  0.10000E+01 volume  0.33617E-02 ppm1      7.876 ppm2      0.956 CV     1
 OR {  312}
   (( segid "    " and resid 35   and name H   ))
   (  segid "    " and resid 36   and name HD1%)
 OR {  312}
   (( segid "    " and resid 35   and name H   ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI {  314}
   (( segid "    " and resid 132  and name H   ))
   (( segid "    " and resid 131  and name H   ))
      3.100     1.200     1.200 peak   314 spectrum    1 weight  0.10000E+01 volume  0.49476E-02 ppm1      7.873 ppm2      7.420 CV     1
 OR {  314}
   (( segid "    " and resid 35   and name H   ))
   (( segid "    " and resid 39   and name HD2 ))
 ASSI {  315}
   (( segid "    " and resid 132  and name H   ))
   (  segid "    " and resid 131  and name HD% )
      2.700     2.700     3.300 peak   315 spectrum    1 weight  0.10000E+01 volume  0.14132E-02 ppm1      7.873 ppm2      7.131 CV     1
 OR {  315}
   (( segid "    " and resid 35   and name H   ))
   (  segid "    " and resid 66   and name HE% )
 ASSI {  321}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 34   and name HA  ))
      3.800     1.800     1.800 peak   321 spectrum    1 weight  0.10000E+01 volume  0.84389E-03 ppm1      8.112 ppm2      3.967 CV     1
 OR {  321}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 32   and name HA  ))
 OR {  321}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 37   and name HA  ))
 OR {  321}
   (( segid "    " and resid 36   and name H   ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI {  327}
   (( segid "    " and resid 36   and name H   ))
   (  segid "    " and resid 36   and name HD1%)
      3.000     1.200     1.200 peak   327 spectrum    1 weight  0.10000E+01 volume  0.50852E-02 ppm1      8.112 ppm2      0.979 CV     1
 OR {  327}
   (( segid "    " and resid 36   and name H   ))
   (  segid "    " and resid 36   and name HG2%)
 OR {  327}
   (( segid "    " and resid 36   and name H   ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI {  328}
   (( segid "    " and resid 36   and name H   ))
   (  segid "    " and resid 51   and name HD1%)
      4.900     3.000     1.100 peak   328 spectrum    1 weight  0.10000E+01 volume  0.70905E-03 ppm1      8.116 ppm2      0.750 CV     1
 OR {  328}
   (( segid "    " and resid 36   and name H   ))
   (  segid "    " and resid 17   and name HD2%)
 ASSI {  332}
   (( segid "    " and resid 37   and name H   ))
   (( segid "    " and resid 37   and name HA  ))
      2.700     0.900     0.900 peak   332 spectrum    1 weight  0.10000E+01 volume  0.23478E-02 ppm1      8.591 ppm2      3.944 CV     1
 OR {  332}
   (( segid "    " and resid 37   and name H   ))
   (( segid "    " and resid 34   and name HA  ))
 ASSI {  335}
   (( segid "    " and resid 37   and name H   ))
   (( segid "    " and resid 50   and name HG12))
      3.100     1.200     1.200 peak   335 spectrum    1 weight  0.10000E+01 volume  0.26483E-02 ppm1      8.593 ppm2      1.566 CV     1
 OR {  335}
   (( segid "    " and resid 37   and name H   ))
   (( segid "    " and resid 37   and name HB2 ))
 OR {  335}
   (( segid "    " and resid 37   and name H   ))
   (( segid "    " and resid 50   and name HG13))
 ASSI {  337}
   (( segid "    " and resid 37   and name H   ))
   (  segid "    " and resid 50   and name HG2%)
      2.400     0.700     0.700 peak   337 spectrum    1 weight  0.10000E+01 volume  0.40832E-02 ppm1      8.592 ppm2      0.931 CV     1
 OR {  337}
   (( segid "    " and resid 37   and name H   ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI {  339}
   (( segid "    " and resid 37   and name H   ))
   (( segid "    " and resid 37   and name HB3 ))
      2.600     0.800     0.800 peak   339 spectrum    1 weight  0.10000E+01 volume  0.28376E-02 ppm1      8.591 ppm2      1.854 CV     1
 OR {  339}
   (( segid "    " and resid 37   and name H   ))
   (( segid "    " and resid 47   and name HB3 ))
 ASSI {  348}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 37   and name HB3 ))
      3.400     1.400     1.400 peak   348 spectrum    1 weight  0.10000E+01 volume  0.20341E-02 ppm1      7.592 ppm2      1.860 CV     1
 OR {  348}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 40   and name HB2 ))
 ASSI {  349}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 37   and name HB2 ))
      3.200     1.300     1.300 peak   349 spectrum    1 weight  0.10000E+01 volume  0.23685E-02 ppm1      7.593 ppm2      1.555 CV     1
 OR {  349}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 50   and name HG12))
 OR {  349}
   (( segid "    " and resid 38   and name H   ))
   (( segid "    " and resid 50   and name HG13))
 ASSI {  351}
   (( segid "    " and resid 38   and name H   ))
   (  segid "    " and resid 36   and name HG2%)
      3.500     1.500     1.500 peak   351 spectrum    1 weight  0.10000E+01 volume  0.20401E-02 ppm1      7.592 ppm2      0.937 CV     1
 OR {  351}
   (( segid "    " and resid 38   and name H   ))
   (  segid "    " and resid 50   and name HG2%)
 OR {  351}
   (( segid "    " and resid 38   and name H   ))
   (  segid "    " and resid 50   and name HD1%)
 ASSI {  363}
   (( segid "    " and resid 39   and name H   ))
   (( segid "    " and resid 40   and name HB3 ))
      4.200     2.200     1.800 peak   363 spectrum    1 weight  0.10000E+01 volume  0.10964E-02 ppm1      7.537 ppm2      1.545 CV     1
 OR {  363}
   (( segid "    " and resid 39   and name H   ))
   (( segid "    " and resid 37   and name HB2 ))
 ASSI {  365}
   (( segid "    " and resid 39   and name H   ))
   (  segid "    " and resid 36   and name HG2%)
      4.200     2.200     1.800 peak   365 spectrum    1 weight  0.10000E+01 volume  0.96964E-03 ppm1      7.541 ppm2      0.958 CV     1
 OR {  365}
   (( segid "    " and resid 39   and name H   ))
   (  segid "    " and resid 40   and name HD2%)
 OR {  365}
   (( segid "    " and resid 39   and name H   ))
   (  segid "    " and resid 40   and name HD1%)
 ASSI {  398}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 40   and name HA  ))
      4.000     2.000     2.000 peak   398 spectrum    1 weight  0.10000E+01 volume  0.78627E-03 ppm1      8.182 ppm2      4.427 CV     1
 OR {  398}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 43   and name HA  ))
 ASSI {  400}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 40   and name HG  ))
      4.000     2.000     2.000 peak   400 spectrum    1 weight  0.10000E+01 volume  0.52098E-03 ppm1      8.178 ppm2      1.902 CV     1
 OR {  400}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 40   and name HB2 ))
 OR {  400}
   (( segid "    " and resid 42   and name H   ))
   (( segid "    " and resid 43   and name HB  ))
 ASSI {  407}
   (( segid "    " and resid 43   and name H   ))
   (( segid "    " and resid 43   and name HB  ))
      3.100     1.200     1.200 peak   407 spectrum    1 weight  0.10000E+01 volume  0.30039E-02 ppm1      7.980 ppm2      1.905 CV     1
 OR {  407}
   (( segid "    " and resid 43   and name H   ))
   (( segid "    " and resid 40   and name HG  ))
 ASSI {  430}
   (( segid "    " and resid 47   and name H   ))
   (  segid "    " and resid 50   and name HD1%)
      4.200     2.200     1.800 peak   430 spectrum    1 weight  0.10000E+01 volume  0.97402E-03 ppm1      9.008 ppm2      0.926 CV     1
 OR {  430}
   (( segid "    " and resid 47   and name H   ))
   (  segid "    " and resid 50   and name HG2%)
 OR {  430}
   (( segid "    " and resid 47   and name H   ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI {  433}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 48   and name HB2 ))
      2.600     0.900     0.900 peak   433 spectrum    1 weight  0.10000E+01 volume  0.73754E-02 ppm1      8.341 ppm2      1.727 CV     1
 OR {  433}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 48   and name HD3 ))
 OR {  433}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 47   and name HG3 ))
 ASSI {  438}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 48   and name HB3 ))
      2.100     0.600     0.600 peak   438 spectrum    1 weight  0.10000E+01 volume  0.81660E-02 ppm1      8.337 ppm2      1.861 CV     1
 OR {  438}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 47   and name HB3 ))
 OR {  438}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 47   and name HB2 ))
 ASSI {  439}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 48   and name HG3 ))
      3.600     1.700     1.700 peak   439 spectrum    1 weight  0.10000E+01 volume  0.25779E-02 ppm1      8.338 ppm2      1.518 CV     1
 OR {  439}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 47   and name HG2 ))
 ASSI {  440}
   (( segid "    " and resid 48   and name H   ))
   (  segid "    " and resid 33   and name HG2%)
      4.300     2.300     1.700 peak   440 spectrum    1 weight  0.10000E+01 volume  0.98880E-03 ppm1      8.337 ppm2      0.945 CV     1
 OR {  440}
   (( segid "    " and resid 48   and name H   ))
   (  segid "    " and resid 63   and name HG2%)
 OR {  440}
   (( segid "    " and resid 48   and name H   ))
   (  segid "    " and resid 50   and name HG2%)
 OR {  440}
   (( segid "    " and resid 48   and name H   ))
   (  segid "    " and resid 33   and name HG1%)
 ASSI {  442}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 50   and name H   ))
      3.600     1.700     1.700 peak   442 spectrum    1 weight  0.10000E+01 volume  0.12307E-02 ppm1      8.337 ppm2      8.232 CV     1
 OR {  442}
   (( segid "    " and resid 48   and name H   ))
   (( segid "    " and resid 51   and name H   ))
 ASSI {  449}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 48   and name HB3 ))
      2.900     1.100     1.100 peak   449 spectrum    1 weight  0.10000E+01 volume  0.21641E-02 ppm1      7.713 ppm2      1.859 CV     1
 OR {  449}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 47   and name HB2 ))
 ASSI {  450}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 48   and name HB2 ))
      3.200     1.300     1.300 peak   450 spectrum    1 weight  0.10000E+01 volume  0.35003E-02 ppm1      7.716 ppm2      1.706 CV     1
 OR {  450}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 45   and name HB2 ))
 OR {  450}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 45   and name HB3 ))
 ASSI {  452}
   (( segid "    " and resid 49   and name H   ))
   (  segid "    " and resid 33   and name HG2%)
      4.200     2.200     1.800 peak   452 spectrum    1 weight  0.10000E+01 volume  0.10126E-02 ppm1      7.714 ppm2      0.966 CV     1
 OR {  452}
   (( segid "    " and resid 49   and name H   ))
   (  segid "    " and resid 63   and name HG2%)
 OR {  452}
   (( segid "    " and resid 49   and name H   ))
   (  segid "    " and resid 33   and name HG1%)
 OR {  452}
   (( segid "    " and resid 49   and name H   ))
   (  segid "    " and resid 36   and name HG2%)
 OR {  452}
   (( segid "    " and resid 49   and name H   ))
   (  segid "    " and resid 40   and name HD2%)
 ASSI {  456}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 50   and name H   ))
      2.700     0.900     0.900 peak   456 spectrum    1 weight  0.10000E+01 volume  0.28203E-02 ppm1      7.712 ppm2      8.211 CV     1
 OR {  456}
   (( segid "    " and resid 49   and name H   ))
   (( segid "    " and resid 51   and name H   ))
 ASSI {  459}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 50   and name HB  ))
      2.300     0.700     0.700 peak   459 spectrum    1 weight  0.10000E+01 volume  0.33162E-02 ppm1      8.202 ppm2      2.195 CV     1
 OR {  459}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 49   and name HB3 ))
 OR {  459}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 49   and name HB2 ))
 ASSI {  460}
   (( segid "    " and resid 108  and name H   ))
   (( segid "    " and resid 108  and name HG2 ))
      2.500     0.800     0.800 peak   460 spectrum    1 weight  0.10000E+01 volume  0.58259E-02 ppm1      8.195 ppm2      1.493 CV     1
 OR {  460}
   (( segid "    " and resid 50   and name H   ))
   (( segid "    " and resid 45   and name HG2 ))
 ASSI {  465}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 50   and name HA  ))
      3.700     1.700     1.700 peak   465 spectrum    1 weight  0.10000E+01 volume  0.52088E-03 ppm1      8.228 ppm2      3.782 CV     1
 OR {  465}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI {  468}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 50   and name HB  ))
      3.000     1.100     1.100 peak   468 spectrum    1 weight  0.10000E+01 volume  0.13183E-02 ppm1      8.220 ppm2      2.185 CV     1
 OR {  468}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 49   and name HB3 ))
 OR {  468}
   (( segid "    " and resid 51   and name H   ))
   (( segid "    " and resid 49   and name HB2 ))
 ASSI {  471}
   (( segid "    " and resid 51   and name H   ))
   (  segid "    " and resid 50   and name HG2%)
      3.000     1.100     1.100 peak   471 spectrum    1 weight  0.10000E+01 volume  0.28739E-02 ppm1      8.222 ppm2      0.930 CV     1
 OR {  471}
   (( segid "    " and resid 51   and name H   ))
   (  segid "    " and resid 33   and name HG2%)
 OR {  471}
   (( segid "    " and resid 51   and name H   ))
   (  segid "    " and resid 33   and name HG1%)
 ASSI {  479}
   (( segid "    " and resid 52   and name H   ))
   (( segid "    " and resid 48   and name HA  ))
      3.800     1.800     1.800 peak   479 spectrum    1 weight  0.10000E+01 volume  0.12652E-02 ppm1      8.229 ppm2      3.910 CV     1
 OR {  479}
   (( segid "    " and resid 52   and name H   ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI {  482}
   (( segid "    " and resid 52   and name H   ))
   (( segid "    " and resid 53   and name HB2 ))
      3.900     1.900     1.900 peak   482 spectrum    1 weight  0.10000E+01 volume  0.78968E-03 ppm1      8.229 ppm2      2.195 CV     1
 OR {  482}
   (( segid "    " and resid 52   and name H   ))
   (( segid "    " and resid 49   and name HB3 ))
 OR {  482}
   (( segid "    " and resid 52   and name H   ))
   (( segid "    " and resid 56   and name HG2 ))
 ASSI {  484}
   (( segid "    " and resid 52   and name H   ))
   (  segid "    " and resid 50   and name HG2%)
      3.600     1.600     1.600 peak   484 spectrum    1 weight  0.10000E+01 volume  0.15235E-02 ppm1      8.228 ppm2      0.928 CV     1
 OR {  484}
   (( segid "    " and resid 52   and name H   ))
   (  segid "    " and resid 33   and name HG2%)
 OR {  484}
   (( segid "    " and resid 52   and name H   ))
   (  segid "    " and resid 63   and name HG2%)
 OR {  484}
   (( segid "    " and resid 52   and name H   ))
   (  segid "    " and resid 33   and name HG1%)
 ASSI {  485}
   (( segid "    " and resid 52   and name H   ))
   (  segid "    " and resid 50   and name HG2%)
      3.200     1.300     1.300 peak   485 spectrum    1 weight  0.10000E+01 volume  0.17344E-02 ppm1      8.228 ppm2      0.864 CV     1
 OR {  485}
   (( segid "    " and resid 52   and name H   ))
   (  segid "    " and resid 55   and name HG1%)
 ASSI {  486}
   (( segid "    " and resid 52   and name H   ))
   (  segid "    " and resid 51   and name HD1%)
      3.400     1.500     1.500 peak   486 spectrum    1 weight  0.10000E+01 volume  0.28483E-02 ppm1      8.227 ppm2      0.748 CV     1
 OR {  486}
   (( segid "    " and resid 52   and name H   ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI {  490}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 53   and name HA  ))
      2.600     0.900     0.900 peak   490 spectrum    1 weight  0.10000E+01 volume  0.31604E-02 ppm1      8.140 ppm2      4.021 CV     1
 OR {  490}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 52   and name HA  ))
 ASSI {  491}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 50   and name HA  ))
      3.400     1.400     1.400 peak   491 spectrum    1 weight  0.10000E+01 volume  0.77495E-03 ppm1      8.138 ppm2      3.792 CV     1
 OR {  491}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 56   and name HA  ))
 ASSI {  496}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 54   and name HB3 ))
      4.500     2.500     1.500 peak   496 spectrum    1 weight  0.10000E+01 volume  0.80555E-03 ppm1      8.150 ppm2      1.937 CV     1
 OR {  496}
   (( segid "    " and resid 53   and name H   ))
   (  segid "    " and resid 57   and name HE% )
 ASSI {  498}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 56   and name HB2 ))
      3.700     1.700     1.700 peak   498 spectrum    1 weight  0.10000E+01 volume  0.14711E-02 ppm1      8.143 ppm2      1.720 CV     1
 OR {  498}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 54   and name HG  ))
 ASSI {  500}
   (( segid "    " and resid 53   and name H   ))
   (  segid "    " and resid 17   and name HD2%)
      3.700     1.700     1.700 peak   500 spectrum    1 weight  0.10000E+01 volume  0.15514E-02 ppm1      8.143 ppm2      0.764 CV     1
 OR {  500}
   (( segid "    " and resid 53   and name H   ))
   (( segid "    " and resid 54   and name HB2 ))
 ASSI {  503}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 53   and name HA  ))
      3.100     1.200     1.200 peak   503 spectrum    1 weight  0.10000E+01 volume  0.14954E-02 ppm1      8.303 ppm2      4.017 CV     1
 OR {  503}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 52   and name HA  ))
 ASSI {  504}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 50   and name HA  ))
      3.600     1.600     1.600 peak   504 spectrum    1 weight  0.10000E+01 volume  0.90005E-03 ppm1      8.306 ppm2      3.768 CV     1
 OR {  504}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 56   and name HA  ))
 ASSI {  507}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 53   and name HB2 ))
      3.100     1.200     1.200 peak   507 spectrum    1 weight  0.10000E+01 volume  0.12455E-02 ppm1      8.303 ppm2      2.197 CV     1
 OR {  507}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 56   and name HG2 ))
 ASSI {  510}
   (( segid "    " and resid 54   and name H   ))
   (  segid "    " and resid 17   and name HD1%)
      4.000     2.000     2.000 peak   510 spectrum    1 weight  0.10000E+01 volume  0.10857E-02 ppm1      8.304 ppm2      1.042 CV     1
 OR {  510}
   (( segid "    " and resid 54   and name H   ))
   (  segid "    " and resid 36   and name HD1%)
 ASSI {  511}
   (( segid "    " and resid 54   and name H   ))
   (( segid "    " and resid 54   and name HB2 ))
      2.300     0.700     0.700 peak   511 spectrum    1 weight  0.10000E+01 volume  0.46765E-02 ppm1      8.306 ppm2      0.751 CV     1
 OR {  511}
   (( segid "    " and resid 54   and name H   ))
   (  segid "    " and resid 17   and name HD2%)
 ASSI {  516}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 55   and name HA  ))
      2.800     1.000     1.000 peak   516 spectrum    1 weight  0.10000E+01 volume  0.25007E-02 ppm1      7.495 ppm2      3.985 CV     1
 OR {  516}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 52   and name HA  ))
 ASSI {  518}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 54   and name HG  ))
      4.100     2.100     1.900 peak   518 spectrum    1 weight  0.10000E+01 volume  0.93162E-03 ppm1      7.503 ppm2      1.758 CV     1
 OR {  518}
   (( segid "    " and resid 55   and name H   ))
   (( segid "    " and resid 56   and name HB2 ))
 ASSI {  522}
   (( segid "    " and resid 56   and name H   ))
   (( segid "    " and resid 55   and name HA  ))
      3.000     1.100     1.100 peak   522 spectrum    1 weight  0.10000E+01 volume  0.28279E-02 ppm1      8.079 ppm2      4.008 CV     1
 OR {  522}
   (( segid "    " and resid 56   and name H   ))
   (( segid "    " and resid 53   and name HA  ))
 OR {  522}
   (( segid "    " and resid 56   and name H   ))
   (( segid "    " and resid 57   and name HA  ))
 ASSI {  524}
   (( segid "    " and resid 56   and name H   ))
   (( segid "    " and resid 56   and name HG3 ))
      2.500     0.800     0.800 peak   524 spectrum    1 weight  0.10000E+01 volume  0.32656E-02 ppm1      8.084 ppm2      2.137 CV     1
 OR {  524}
   (( segid "    " and resid 56   and name H   ))
   (( segid "    " and resid 57   and name HB2 ))
 ASSI {  527}
   (( segid "    " and resid 56   and name H   ))
   (( segid "    " and resid 57   and name H   ))
      2.800     1.000     1.000 peak   527 spectrum    1 weight  0.10000E+01 volume  0.16727E-02 ppm1      8.082 ppm2      7.878 CV     1
 OR {  527}
   (( segid "    " and resid 56   and name H   ))
   (( segid "    " and resid 58   and name H   ))
 ASSI {  539}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 57   and name HA  ))
      2.700     0.900     0.900 peak   539 spectrum    1 weight  0.10000E+01 volume  0.43632E-02 ppm1      7.869 ppm2      3.976 CV     1
 OR {  539}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 53   and name HA  ))
 ASSI {  544}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 57   and name HB3 ))
      2.400     0.700     0.700 peak   544 spectrum    1 weight  0.10000E+01 volume  0.45445E-02 ppm1      7.868 ppm2      1.709 CV     1
 OR {  544}
   (( segid "    " and resid 57   and name H   ))
   (( segid "    " and resid 56   and name HB2 ))
 ASSI {  546}
   (( segid "    " and resid 57   and name H   ))
   (  segid "    " and resid 55   and name HG2%)
      4.100     2.100     1.900 peak   546 spectrum    1 weight  0.10000E+01 volume  0.14164E-02 ppm1      7.871 ppm2      0.817 CV     1
 OR {  546}
   (( segid "    " and resid 57   and name H   ))
   (  segid "    " and resid 55   and name HG1%)
 OR {  546}
   (( segid "    " and resid 57   and name H   ))
   (  segid "    " and resid 59   and name HD1%)
 ASSI {  551}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 58   and name HA2 ))
      2.300     0.700     0.700 peak   551 spectrum    1 weight  0.10000E+01 volume  0.73729E-02 ppm1      7.925 ppm2      3.939 CV     1
 OR {  551}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 57   and name HA  ))
 ASSI {  554}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 57   and name HB3 ))
      3.900     1.900     1.900 peak   554 spectrum    1 weight  0.10000E+01 volume  0.79594E-03 ppm1      7.923 ppm2      1.714 CV     1
 OR {  554}
   (( segid "    " and resid 58   and name H   ))
   (( segid "    " and resid 56   and name HB2 ))
 ASSI {  556}
   (( segid "    " and resid 58   and name H   ))
   (  segid "    " and resid 55   and name HG2%)
      4.100     2.100     1.900 peak   556 spectrum    1 weight  0.10000E+01 volume  0.12014E-02 ppm1      7.927 ppm2      0.831 CV     1
 OR {  556}
   (( segid "    " and resid 58   and name H   ))
   (  segid "    " and resid 55   and name HG1%)
 OR {  556}
   (( segid "    " and resid 58   and name H   ))
   (  segid "    " and resid 59   and name HD1%)
 ASSI {  562}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 55   and name HA  ))
      3.100     1.200     1.200 peak   562 spectrum    1 weight  0.10000E+01 volume  0.34184E-02 ppm1      7.671 ppm2      3.961 CV     1
 OR {  562}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 57   and name HA  ))
 ASSI {  571}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 58   and name H   ))
      2.500     0.800     0.800 peak   571 spectrum    1 weight  0.10000E+01 volume  0.47228E-02 ppm1      7.668 ppm2      7.917 CV     1
 OR {  571}
   (( segid "    " and resid 59   and name H   ))
   (( segid "    " and resid 57   and name H   ))
 ASSI {  576}
   (( segid "    " and resid 60   and name H   ))
   (  segid "    " and resid 60   and name HB% )
      2.500     0.800     0.800 peak   576 spectrum    1 weight  0.10000E+01 volume  0.45908E-02 ppm1      7.067 ppm2      1.248 CV     1
 OR {  576}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI {  579}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 58   and name H   ))
      3.400     1.400     1.400 peak   579 spectrum    1 weight  0.10000E+01 volume  0.15146E-02 ppm1      7.070 ppm2      7.912 CV     1
 OR {  579}
   (( segid "    " and resid 60   and name H   ))
   (( segid "    " and resid 57   and name H   ))
 ASSI {  582}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 60   and name HA  ))
      2.300     0.600     0.600 peak   582 spectrum    1 weight  0.10000E+01 volume  0.93921E-02 ppm1      8.648 ppm2      4.546 CV     1
 OR {  582}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 61   and name HA  ))
 ASSI {  587}
   (( segid "    " and resid 61   and name H   ))
   (( segid "    " and resid 60   and name H   ))
      4.500     2.500     1.500 peak   587 spectrum    1 weight  0.10000E+01 volume  0.55131E-03 ppm1      8.649 ppm2      7.068 CV     1
 OR {  587}
   (( segid "    " and resid 61   and name H   ))
   (  segid "    " and resid 66   and name HE% )
 ASSI {  588}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 62   and name HA  ))
      2.500     0.800     0.800 peak   588 spectrum    1 weight  0.10000E+01 volume  0.68880E-02 ppm1      7.868 ppm2      4.561 CV     1
 OR {  588}
   (( segid "    " and resid 62   and name H   ))
   (( segid "    " and resid 61   and name HA  ))
 ASSI {  604}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 62   and name HB2 ))
      2.500     0.800     0.800 peak   604 spectrum    1 weight  0.10000E+01 volume  0.46202E-02 ppm1      8.295 ppm2      3.989 CV     1
 OR {  604}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 98   and name HA  ))
 OR {  604}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 100  and name HA  ))
 ASSI {  605}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 63   and name HB  ))
      3.300     1.400     1.400 peak   605 spectrum    1 weight  0.10000E+01 volume  0.34117E-02 ppm1      8.300 ppm2      2.238 CV     1
 OR {  605}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI {  609}
   (( segid "    " and resid 64   and name H   ))
   (  segid "    " and resid 63   and name HG1%)
      2.500     0.800     0.800 peak   609 spectrum    1 weight  0.10000E+01 volume  0.84560E-02 ppm1      8.299 ppm2      0.971 CV     1
 OR {  609}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 100  and name HB3 ))
 OR {  609}
   (( segid "    " and resid 101  and name H   ))
   (  segid "    " and resid 101  and name HD1%)
 OR {  609}
   (( segid "    " and resid 101  and name H   ))
   (  segid "    " and resid 101  and name HG2%)
 ASSI {  613}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 102  and name HG2 ))
      4.400     2.400     1.600 peak   613 spectrum    1 weight  0.10000E+01 volume  0.48680E-03 ppm1      8.287 ppm2      2.706 CV     1
 OR {  613}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 91   and name HB3 ))
 OR {  613}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 61   and name HB3 ))
 ASSI {  615}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 62   and name H   ))
      3.700     1.700     1.700 peak   615 spectrum    1 weight  0.10000E+01 volume  0.96592E-03 ppm1      8.298 ppm2      7.826 CV     1
 OR {  615}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 99   and name H   ))
 OR {  615}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 67   and name H   ))
 ASSI {  616}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 100  and name H   ))
      2.300     0.700     0.700 peak   616 spectrum    1 weight  0.10000E+01 volume  0.41689E-02 ppm1      8.294 ppm2      7.708 CV     1
 OR {  616}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 65   and name H   ))
 ASSI {  617}
   (( segid "    " and resid 64   and name H   ))
   (( segid "    " and resid 66   and name H   ))
      4.100     2.100     1.900 peak   617 spectrum    1 weight  0.10000E+01 volume  0.35343E-03 ppm1      8.287 ppm2      7.505 CV     1
 OR {  617}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 103  and name H   ))
 ASSI {  618}
   (( segid "    " and resid 64   and name H   ))
   (  segid "    " and resid 66   and name HE% )
      4.500     2.500     1.500 peak   618 spectrum    1 weight  0.10000E+01 volume  0.48613E-03 ppm1      8.300 ppm2      7.087 CV     1
 OR {  618}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 100  and name HD2 ))
 OR {  618}
   (( segid "    " and resid 101  and name H   ))
   (  segid "    " and resid 91   and name HD% )
 ASSI {  620}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 62   and name HA  ))
      3.800     1.800     1.800 peak   620 spectrum    1 weight  0.10000E+01 volume  0.15380E-02 ppm1      7.702 ppm2      4.560 CV     1
 OR {  620}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 66   and name HA  ))
 OR {  620}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 60   and name HA  ))
 ASSI {  629}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 63   and name H   ))
      4.500     2.500     1.500 peak   629 spectrum    1 weight  0.10000E+01 volume  0.61645E-03 ppm1      7.707 ppm2      8.666 CV     1
 OR {  629}
   (( segid "    " and resid 65   and name H   ))
   (( segid "    " and resid 61   and name H   ))
 ASSI {  632}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 65   and name HA  ))
      3.100     1.200     1.200 peak   632 spectrum    1 weight  0.10000E+01 volume  0.21444E-02 ppm1      7.516 ppm2      4.420 CV     1
 OR {  632}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 67   and name HA  ))
 ASSI {  637}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 65   and name HB3 ))
      2.900     1.000     1.000 peak   637 spectrum    1 weight  0.10000E+01 volume  0.20998E-02 ppm1      7.519 ppm2      2.413 CV     1
 OR {  637}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 67   and name HG2 ))
 OR {  637}
   (( segid "    " and resid 66   and name H   ))
   (( segid "    " and resid 67   and name HG3 ))
 ASSI {  639}
   (( segid "    " and resid 66   and name H   ))
   (  segid "    " and resid 63   and name HG2%)
      5.300     3.500     0.700 peak   639 spectrum    1 weight  0.10000E+01 volume  0.69202E-03 ppm1      7.511 ppm2      0.939 CV     1
 OR {  639}
   (( segid "    " and resid 66   and name H   ))
   (  segid "    " and resid 33   and name HG1%)
 OR {  639}
   (( segid "    " and resid 66   and name H   ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI {  646}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 67   and name HG2 ))
      2.600     0.900     0.900 peak   646 spectrum    1 weight  0.10000E+01 volume  0.44768E-02 ppm1      7.803 ppm2      2.424 CV     1
 OR {  646}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 67   and name HG3 ))
 OR {  646}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 65   and name HB3 ))
 ASSI {  649}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 64   and name HD2 ))
      4.400     2.400     1.600 peak   649 spectrum    1 weight  0.10000E+01 volume  0.54005E-03 ppm1      7.801 ppm2      1.650 CV     1
 OR {  649}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 64   and name HD3 ))
 OR {  649}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 51   and name HB  ))
 OR {  649}
   (( segid "    " and resid 67   and name H   ))
   (( segid "    " and resid 68   and name HG2 ))
 ASSI {  659}
   (( segid "    " and resid 67   and name HE22))
   (  segid "    " and resid 63   and name HG2%)
      2.500     2.500     3.500 peak   659 spectrum    1 weight  0.10000E+01 volume  0.70455E-03 ppm1      6.949 ppm2      0.959 CV     1
 OR {  659}
   (( segid "    " and resid 67   and name HE22))
   (  segid "    " and resid 33   and name HG1%)
 OR {  659}
   (( segid "    " and resid 67   and name HE22))
   (  segid "    " and resid 33   and name HG2%)
 ASSI {  681}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 71   and name HB  ))
      3.300     1.300     1.300 peak   681 spectrum    1 weight  0.10000E+01 volume  0.17863E-02 ppm1      8.099 ppm2      4.165 CV     1
 OR {  681}
   (( segid "    " and resid 71   and name H   ))
   (( segid "    " and resid 121  and name HA  ))
 ASSI {  686}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 117  and name HB3 ))
      4.200     2.200     1.800 peak   686 spectrum    1 weight  0.10000E+01 volume  0.76200E-03 ppm1      8.164 ppm2      1.595 CV     1
 OR {  686}
   (( segid "    " and resid 73   and name H   ))
   (( segid "    " and resid 121  and name HG  ))
 ASSI {  695}
   (( segid "    " and resid 74   and name H   ))
   (( segid "    " and resid 73   and name HA  ))
      2.300     0.700     0.700 peak   695 spectrum    1 weight  0.10000E+01 volume  0.37884E-02 ppm1      8.396 ppm2      4.137 CV     1
 OR {  695}
   (( segid "    " and resid 74   and name H   ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI {  705}
   (( segid "    " and resid 75   and name H   ))
   (  segid "    " and resid 75   and name HD1%)
      2.800     1.000     1.000 peak   705 spectrum    1 weight  0.10000E+01 volume  0.38106E-02 ppm1      8.394 ppm2      0.898 CV     1
 OR {  705}
   (( segid "    " and resid 75   and name H   ))
   (  segid "    " and resid 75   and name HD2%)
 OR {  705}
   (( segid "    " and resid 75   and name H   ))
   (  segid "    " and resid 74   and name HG2%)
 ASSI {  710}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 76   and name HB2 ))
      3.100     1.200     1.200 peak   710 spectrum    1 weight  0.10000E+01 volume  0.17585E-02 ppm1      8.660 ppm2      3.094 CV     1
 OR {  710}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 76   and name HB3 ))
 OR {  710}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 76   and name HB3 ))
 ASSI {  713}
   (( segid "    " and resid 76   and name H   ))
   (  segid "    " and resid 74   and name HG1%)
      3.000     1.200     1.200 peak   713 spectrum    1 weight  0.10000E+01 volume  0.24735E-02 ppm1      8.662 ppm2      0.906 CV     1
 OR {  713}
   (( segid "    " and resid 76   and name H   ))
   (  segid "    " and resid 74   and name HG2%)
 OR {  713}
   (( segid "    " and resid 81   and name H   ))
   (  segid "    " and resid 82   and name HD2%)
 ASSI {  715}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 81   and name HG2 ))
      3.300     1.400     1.400 peak   715 spectrum    1 weight  0.10000E+01 volume  0.14592E-02 ppm1      8.652 ppm2      2.827 CV     1
 OR {  715}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 80   and name HG3 ))
 ASSI {  716}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 81   and name HB2 ))
      3.100     1.200     1.200 peak   716 spectrum    1 weight  0.10000E+01 volume  0.16914E-02 ppm1      8.649 ppm2      1.779 CV     1
 OR {  716}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 73   and name HB  ))
 ASSI {  718}
   (( segid "    " and resid 76   and name H   ))
   (( segid "    " and resid 76   and name HD1 ))
      3.200     1.300     1.300 peak   718 spectrum    1 weight  0.10000E+01 volume  0.19170E-02 ppm1      8.662 ppm2      7.369 CV     1
 OR {  718}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 76   and name HE3 ))
 ASSI {  720}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 82   and name H   ))
      3.100     1.200     1.200 peak   720 spectrum    1 weight  0.10000E+01 volume  0.12722E-02 ppm1      8.650 ppm2      8.148 CV     1
 OR {  720}
   (( segid "    " and resid 81   and name H   ))
   (( segid "    " and resid 83   and name H   ))
 ASSI {  721}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 74   and name HB  ))
      4.400     2.500     1.600 peak   721 spectrum    1 weight  0.10000E+01 volume  0.45764E-03 ppm1     10.469 ppm2      2.055 CV     1
 OR {  721}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 84   and name HB3 ))
 ASSI {  722}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 81   and name HB3 ))
      4.200     2.300     1.800 peak   722 spectrum    1 weight  0.10000E+01 volume  0.65489E-03 ppm1     10.472 ppm2      1.959 CV     1
 OR {  722}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 113  and name HG2 ))
 OR {  722}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 113  and name HG3 ))
 OR {  722}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 105  and name HB  ))
 ASSI {  724}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 109  and name HB2 ))
      4.100     2.100     1.900 peak   724 spectrum    1 weight  0.10000E+01 volume  0.59537E-03 ppm1     10.461 ppm2      1.818 CV     1
 OR {  724}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 73   and name HB  ))
 OR {  724}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 84   and name HB2 ))
 OR {  724}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 114  and name HG13))
 ASSI {  725}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 109  and name HB2 ))
      4.100     2.100     1.900 peak   725 spectrum    1 weight  0.10000E+01 volume  0.53664E-03 ppm1     10.468 ppm2      1.795 CV     1
 OR {  725}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 73   and name HB  ))
 OR {  725}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI {  726}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 109  and name HG2 ))
      4.100     2.100     1.900 peak   726 spectrum    1 weight  0.10000E+01 volume  0.82354E-03 ppm1     10.471 ppm2      1.401 CV     1
 OR {  726}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 105  and name HG13))
 ASSI {  727}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 114  and name HG12))
      4.500     2.500     1.500 peak   727 spectrum    1 weight  0.10000E+01 volume  0.60973E-03 ppm1     10.470 ppm2      1.274 CV     1
 OR {  727}
   (( segid "    " and resid 76   and name HE1 ))
   (  segid "    " and resid 106  and name HG2%)
 ASSI {  730}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 76   and name H   ))
      4.700     2.800     1.300 peak   730 spectrum    1 weight  0.10000E+01 volume  0.43301E-03 ppm1     10.464 ppm2      8.663 CV     1
 OR {  730}
   (( segid "    " and resid 76   and name HE1 ))
   (( segid "    " and resid 77   and name H   ))
 ASSI {  753}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 79   and name HB3 ))
      3.900     1.900     1.900 peak   753 spectrum    1 weight  0.10000E+01 volume  0.14850E-02 ppm1      7.888 ppm2      2.693 CV     1
 OR {  753}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 80   and name HG2 ))
 ASSI {  754}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 80   and name HB3 ))
      2.800     1.000     1.000 peak   754 spectrum    1 weight  0.10000E+01 volume  0.23512E-02 ppm1      7.890 ppm2      2.567 CV     1
 OR {  754}
   (( segid "    " and resid 80   and name H   ))
   (( segid "    " and resid 79   and name HB2 ))
 ASSI {  760}
   (( segid "    " and resid 49   and name HE21))
   (  segid "    " and resid 6    and name HB% )
      2.600     2.600     3.400 peak   760 spectrum    1 weight  0.10000E+01 volume  0.97923E-03 ppm1      7.057 ppm2      1.315 CV     1
 OR {  760}
   (( segid "    " and resid 49   and name HE21))
   (( segid "    " and resid 48   and name HG2 ))
 ASSI {  762}
   (( segid "    " and resid 49   and name HE21))
   (( segid "    " and resid 46   and name H   ))
      3.500     1.500     1.500 peak   762 spectrum    1 weight  0.10000E+01 volume  0.98008E-03 ppm1      7.061 ppm2      7.691 CV     1
 OR {  762}
   (( segid "    " and resid 49   and name HE21))
   (( segid "    " and resid 49   and name H   ))
 ASSI {  766}
   (( segid "    " and resid 49   and name HE22))
   (( segid "    " and resid 46   and name H   ))
      4.200     2.200     1.800 peak   766 spectrum    1 weight  0.10000E+01 volume  0.76409E-03 ppm1      7.469 ppm2      7.704 CV     1
 OR {  766}
   (( segid "    " and resid 49   and name HE22))
   (( segid "    " and resid 49   and name H   ))
 ASSI {  773}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 81   and name HG3 ))
      3.200     1.200     1.200 peak   773 spectrum    1 weight  0.10000E+01 volume  0.18031E-02 ppm1      8.151 ppm2      2.465 CV     1
 OR {  773}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 83   and name HG3 ))
 ASSI {  774}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 83   and name HB3 ))
      4.100     2.100     1.900 peak   774 spectrum    1 weight  0.10000E+01 volume  0.15384E-02 ppm1      8.152 ppm2      2.219 CV     1
 OR {  774}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 85   and name HB3 ))
 ASSI {  775}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 82   and name HB2 ))
      2.600     0.800     0.800 peak   775 spectrum    1 weight  0.10000E+01 volume  0.44104E-02 ppm1      8.154 ppm2      1.908 CV     1
 OR {  775}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 81   and name HB3 ))
 ASSI {  776}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 81   and name HB2 ))
      2.700     0.900     0.900 peak   776 spectrum    1 weight  0.10000E+01 volume  0.43512E-02 ppm1      8.152 ppm2      1.817 CV     1
 OR {  776}
   (( segid "    " and resid 82   and name H   ))
   (( segid "    " and resid 82   and name HG  ))
 ASSI {  781}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 83   and name HA  ))
      3.100     1.200     1.200 peak   781 spectrum    1 weight  0.10000E+01 volume  0.17829E-02 ppm1      8.104 ppm2      4.060 CV     1
 OR {  781}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI {  784}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 67   and name HB2 ))
      3.700     1.700     1.700 peak   784 spectrum    1 weight  0.10000E+01 volume  0.14415E-02 ppm1      8.104 ppm2      2.009 CV     1
 OR {  784}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 84   and name HB3 ))
 OR {  784}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 86   and name HB2 ))
 ASSI {  786}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 69   and name HB2 ))
      3.100     1.200     1.200 peak   786 spectrum    1 weight  0.10000E+01 volume  0.19616E-02 ppm1      8.105 ppm2      1.819 CV     1
 OR {  786}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 69   and name HB3 ))
 OR {  786}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 68   and name HB3 ))
 OR {  786}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 68   and name HB2 ))
 ASSI {  787}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 64   and name HD2 ))
      2.900     1.100     1.100 peak   787 spectrum    1 weight  0.10000E+01 volume  0.22675E-02 ppm1      8.106 ppm2      1.704 CV     1
 OR {  787}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 64   and name HD3 ))
 OR {  787}
   (( segid "    " and resid 83   and name H   ))
   (( segid "    " and resid 82   and name HB3 ))
 OR {  787}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 68   and name HG3 ))
 OR {  787}
   (( segid "    " and resid 69   and name H   ))
   (( segid "    " and resid 68   and name HG2 ))
 ASSI {  788}
   (( segid "    " and resid 69   and name H   ))
   (  segid "    " and resid 63   and name HG1%)
      3.100     1.200     1.200 peak   788 spectrum    1 weight  0.10000E+01 volume  0.17495E-02 ppm1      8.103 ppm2      0.985 CV     1
 OR {  788}
   (( segid "    " and resid 83   and name H   ))
   (  segid "    " and resid 82   and name HD1%)
 OR {  788}
   (( segid "    " and resid 69   and name H   ))
   (  segid "    " and resid 63   and name HG2%)
 ASSI {  796}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 83   and name HB3 ))
      3.200     1.300     1.300 peak   796 spectrum    1 weight  0.10000E+01 volume  0.13594E-02 ppm1      8.028 ppm2      2.196 CV     1
 OR {  796}
   (( segid "    " and resid 84   and name H   ))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI {  797}
   (( segid "    " and resid 84   and name H   ))
   (  segid "    " and resid 84   and name HD1%)
      4.000     2.000     2.000 peak   797 spectrum    1 weight  0.10000E+01 volume  0.11007E-02 ppm1      8.025 ppm2      1.063 CV     1
 OR {  797}
   (( segid "    " and resid 84   and name H   ))
   (  segid "    " and resid 105  and name HD1%)
 OR {  797}
   (( segid "    " and resid 84   and name H   ))
   (  segid "    " and resid 87   and name HD2%)
 ASSI {  798}
   (( segid "    " and resid 84   and name H   ))
   (  segid "    " and resid 82   and name HD1%)
      4.400     2.400     1.600 peak   798 spectrum    1 weight  0.10000E+01 volume  0.74713E-03 ppm1      8.022 ppm2      0.960 CV     1
 OR {  798}
   (( segid "    " and resid 84   and name H   ))
   (  segid "    " and resid 82   and name HD2%)
 OR {  798}
   (( segid "    " and resid 84   and name H   ))
   (  segid "    " and resid 101  and name HG2%)
 OR {  798}
   (( segid "    " and resid 84   and name H   ))
   (  segid "    " and resid 114  and name HG2%)
 ASSI {  801}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 84   and name HA  ))
      3.300     1.400     1.400 peak   801 spectrum    1 weight  0.10000E+01 volume  0.15273E-02 ppm1      8.133 ppm2      4.126 CV     1
 OR {  801}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 86   and name HA  ))
 ASSI {  807}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 82   and name HB3 ))
      4.000     2.000     2.000 peak   807 spectrum    1 weight  0.10000E+01 volume  0.10445E-02 ppm1      8.145 ppm2      1.721 CV     1
 OR {  807}
   (( segid "    " and resid 85   and name H   ))
   (( segid "    " and resid 90   and name HG3 ))
 ASSI {  808}
   (( segid "    " and resid 85   and name H   ))
   (  segid "    " and resid 84   and name HD1%)
      3.500     1.500     1.500 peak   808 spectrum    1 weight  0.10000E+01 volume  0.15297E-02 ppm1      8.134 ppm2      1.045 CV     1
 OR {  808}
   (( segid "    " and resid 85   and name H   ))
   (  segid "    " and resid 87   and name HD2%)
 OR {  808}
   (( segid "    " and resid 85   and name H   ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI {  809}
   (( segid "    " and resid 85   and name H   ))
   (  segid "    " and resid 84   and name HD2%)
      3.600     1.600     1.600 peak   809 spectrum    1 weight  0.10000E+01 volume  0.15428E-02 ppm1      8.133 ppm2      0.606 CV     1
 OR {  809}
   (( segid "    " and resid 85   and name H   ))
   (  segid "    " and resid 121  and name HD2%)
 ASSI {  813}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 82   and name HG  ))
      4.800     2.900     1.200 peak   813 spectrum    1 weight  0.10000E+01 volume  0.43454E-03 ppm1      6.845 ppm2      1.784 CV     1
 OR {  813}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 86   and name HG2 ))
 OR {  813}
   (( segid "    " and resid 85   and name HE21))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI {  816}
   (( segid "    " and resid 85   and name HE21))
   (  segid "    " and resid 121  and name HD2%)
      3.800     1.800     1.800 peak   816 spectrum    1 weight  0.10000E+01 volume  0.94306E-03 ppm1      6.851 ppm2      0.618 CV     1
 OR {  816}
   (( segid "    " and resid 85   and name HE21))
   (  segid "    " and resid 123  and name HD2%)
 ASSI {  817}
   (( segid "    " and resid 85   and name HE21))
   (  segid "    " and resid 73   and name HD1%)
      3.300     1.400     1.400 peak   817 spectrum    1 weight  0.10000E+01 volume  0.10583E-02 ppm1      6.856 ppm2      0.806 CV     1
 OR {  817}
   (( segid "    " and resid 85   and name HE21))
   (  segid "    " and resid 123  and name HD1%)
 ASSI {  824}
   (( segid "    " and resid 85   and name HE22))
   (  segid "    " and resid 73   and name HD1%)
      3.400     1.400     1.400 peak   824 spectrum    1 weight  0.10000E+01 volume  0.17783E-02 ppm1      7.239 ppm2      0.799 CV     1
 OR {  824}
   (( segid "    " and resid 85   and name HE22))
   (  segid "    " and resid 123  and name HD1%)
 ASSI {  825}
   (( segid "    " and resid 85   and name HE22))
   (  segid "    " and resid 123  and name HD2%)
      3.300     1.400     1.400 peak   825 spectrum    1 weight  0.10000E+01 volume  0.13678E-02 ppm1      7.237 ppm2      0.599 CV     1
 OR {  825}
   (( segid "    " and resid 85   and name HE22))
   (  segid "    " and resid 121  and name HD2%)
 ASSI {  827}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 121  and name H   ))
      4.200     2.200     1.800 peak   827 spectrum    1 weight  0.10000E+01 volume  0.56029E-03 ppm1      7.236 ppm2      8.139 CV     1
 OR {  827}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 71   and name H   ))
 OR {  827}
   (( segid "    " and resid 85   and name HE22))
   (( segid "    " and resid 73   and name H   ))
 ASSI {  831}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 85   and name HB3 ))
      2.300     0.600     0.600 peak   831 spectrum    1 weight  0.10000E+01 volume  0.37946E-02 ppm1      8.379 ppm2      2.216 CV     1
 OR {  831}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI {  835}
   (( segid "    " and resid 86   and name H   ))
   (  segid "    " and resid 87   and name HD2%)
      3.600     1.600     1.600 peak   835 spectrum    1 weight  0.10000E+01 volume  0.20940E-02 ppm1      8.385 ppm2      1.031 CV     1
 OR {  835}
   (( segid "    " and resid 86   and name H   ))
   (  segid "    " and resid 84   and name HD1%)
 OR {  835}
   (( segid "    " and resid 86   and name H   ))
   (( segid "    " and resid 90   and name HG2 ))
 OR {  835}
   (( segid "    " and resid 86   and name H   ))
   (  segid "    " and resid 101  and name HD1%)
 OR {  835}
   (( segid "    " and resid 86   and name H   ))
   (  segid "    " and resid 101  and name HG2%)
 ASSI {  840}
   (( segid "    " and resid 87   and name H   ))
   (( segid "    " and resid 84   and name HA  ))
      3.400     1.500     1.500 peak   840 spectrum    1 weight  0.10000E+01 volume  0.11753E-02 ppm1      8.687 ppm2      4.130 CV     1
 OR {  840}
   (( segid "    " and resid 87   and name H   ))
   (( segid "    " and resid 86   and name HA  ))
 ASSI {  844}
   (( segid "    " and resid 87   and name H   ))
   (  segid "    " and resid 87   and name HD2%)
      3.200     1.300     1.300 peak   844 spectrum    1 weight  0.10000E+01 volume  0.28293E-02 ppm1      8.682 ppm2      1.030 CV     1
 OR {  844}
   (( segid "    " and resid 87   and name H   ))
   (  segid "    " and resid 84   and name HD1%)
 OR {  844}
   (( segid "    " and resid 87   and name H   ))
   (  segid "    " and resid 101  and name HD1%)
 OR {  844}
   (( segid "    " and resid 87   and name H   ))
   (  segid "    " and resid 101  and name HG2%)
 ASSI {  850}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 87   and name HB2 ))
      3.200     1.300     1.300 peak   850 spectrum    1 weight  0.10000E+01 volume  0.11535E-02 ppm1      8.901 ppm2      2.206 CV     1
 OR {  850}
   (( segid "    " and resid 88   and name H   ))
   (( segid "    " and resid 89   and name HB3 ))
 ASSI {  853}
   (( segid "    " and resid 88   and name H   ))
   (  segid "    " and resid 101  and name HD1%)
      3.100     1.200     1.200 peak   853 spectrum    1 weight  0.10000E+01 volume  0.31154E-02 ppm1      8.902 ppm2      1.036 CV     1
 OR {  853}
   (( segid "    " and resid 88   and name H   ))
   (  segid "    " and resid 84   and name HD1%)
 OR {  853}
   (( segid "    " and resid 88   and name H   ))
   (  segid "    " and resid 97   and name HG2%)
 OR {  853}
   (( segid "    " and resid 88   and name H   ))
   (  segid "    " and resid 87   and name HD2%)
 ASSI {  866}
   (( segid "    " and resid 89   and name H   ))
   (  segid "    " and resid 97   and name HG2%)
      4.300     2.400     1.700 peak   866 spectrum    1 weight  0.10000E+01 volume  0.10675E-02 ppm1      8.192 ppm2      1.024 CV     1
 OR {  866}
   (( segid "    " and resid 89   and name H   ))
   (  segid "    " and resid 101  and name HD1%)
 OR {  866}
   (( segid "    " and resid 89   and name H   ))
   (( segid "    " and resid 90   and name HG2 ))
 OR {  866}
   (( segid "    " and resid 89   and name H   ))
   (  segid "    " and resid 97   and name HG1%)
 ASSI {  874}
   (( segid "    " and resid 90   and name H   ))
   (( segid "    " and resid 90   and name HG2 ))
      3.200     1.300     1.300 peak   874 spectrum    1 weight  0.10000E+01 volume  0.20684E-02 ppm1      7.920 ppm2      1.027 CV     1
 OR {  874}
   (( segid "    " and resid 90   and name H   ))
   (  segid "    " and resid 97   and name HG2%)
 ASSI {  877}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 90   and name HA  ))
      3.200     1.300     1.300 peak   877 spectrum    1 weight  0.10000E+01 volume  0.17346E-02 ppm1      7.750 ppm2      3.741 CV     1
 OR {  877}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 89   and name HA  ))
 ASSI {  880}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 97   and name HB  ))
      4.900     3.000     1.100 peak   880 spectrum    1 weight  0.10000E+01 volume  0.44784E-03 ppm1      7.762 ppm2      2.211 CV     1
 OR {  880}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 89   and name HB3 ))
 ASSI {  882}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 90   and name HG3 ))
      2.500     2.500     3.500 peak   882 spectrum    1 weight  0.10000E+01 volume  0.16285E-02 ppm1      7.745 ppm2      1.711 CV     1
 OR {  882}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 98   and name HG  ))
 OR {  882}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 130  and name HB3 ))
 ASSI {  883}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 90   and name HB3 ))
      3.700     1.700     1.700 peak   883 spectrum    1 weight  0.10000E+01 volume  0.19594E-02 ppm1      7.752 ppm2      1.487 CV     1
 OR {  883}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 92   and name HG3 ))
 OR {  883}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 92   and name HB2 ))
 ASSI {  884}
   (( segid "    " and resid 91   and name H   ))
   (  segid "    " and resid 97   and name HG2%)
      3.000     1.100     1.100 peak   884 spectrum    1 weight  0.10000E+01 volume  0.30214E-02 ppm1      7.750 ppm2      1.025 CV     1
 OR {  884}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 90   and name HG2 ))
 OR {  884}
   (( segid "    " and resid 91   and name H   ))
   (  segid "    " and resid 101  and name HD1%)
 ASSI {  887}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 92   and name H   ))
      2.300     0.700     0.700 peak   887 spectrum    1 weight  0.10000E+01 volume  0.46295E-02 ppm1      7.747 ppm2      7.881 CV     1
 OR {  887}
   (( segid "    " and resid 91   and name H   ))
   (( segid "    " and resid 90   and name H   ))
 ASSI {  888}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 89   and name HA  ))
      3.300     1.400     1.400 peak   888 spectrum    1 weight  0.10000E+01 volume  0.13250E-02 ppm1      7.846 ppm2      3.735 CV     1
 OR {  888}
   (( segid "    " and resid 92   and name H   ))
   (( segid "    " and resid 90   and name HA  ))
 ASSI {  897}
   (( segid "    " and resid 92   and name H   ))
   (  segid "    " and resid 91   and name HD% )
      4.300     2.300     1.700 peak   897 spectrum    1 weight  0.10000E+01 volume  0.83978E-03 ppm1      7.846 ppm2      7.078 CV     1
 OR {  897}
   (( segid "    " and resid 92   and name H   ))
   (  segid "    " and resid 88   and name HD% )
 ASSI {  901}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 92   and name HD3 ))
      3.000     3.000     3.000 peak   901 spectrum    1 weight  0.10000E+01 volume  0.71750E-03 ppm1      8.386 ppm2      2.997 CV     1
 OR {  901}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI {  907}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 92   and name H   ))
      2.400     0.700     0.700 peak   907 spectrum    1 weight  0.10000E+01 volume  0.55779E-02 ppm1      8.381 ppm2      7.836 CV     1
 OR {  907}
   (( segid "    " and resid 93   and name H   ))
   (( segid "    " and resid 94   and name H   ))
 ASSI {  913}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 92   and name HA  ))
      3.400     1.400     1.400 peak   913 spectrum    1 weight  0.10000E+01 volume  0.84099E-03 ppm1      7.824 ppm2      3.614 CV     1
 OR {  913}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 97   and name HA  ))
 ASSI {  917}
   (( segid "    " and resid 94   and name H   ))
   (  segid "    " and resid 91   and name HD% )
      3.800     1.800     1.800 peak   917 spectrum    1 weight  0.10000E+01 volume  0.10270E-02 ppm1      7.828 ppm2      7.098 CV     1
 OR {  917}
   (( segid "    " and resid 94   and name H   ))
   (( segid "    " and resid 100  and name HD2 ))
 ASSI {  922}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 94   and name HA  ))
      2.800     1.000     1.000 peak   922 spectrum    1 weight  0.10000E+01 volume  0.28834E-02 ppm1      8.711 ppm2      4.543 CV     1
 OR {  922}
   (( segid "    " and resid 95   and name H   ))
   (( segid "    " and resid 95   and name HA  ))
 ASSI {  926}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 95   and name HA  ))
      3.200     1.300     1.300 peak   926 spectrum    1 weight  0.10000E+01 volume  0.28150E-02 ppm1      7.876 ppm2      4.541 CV     1
 OR {  926}
   (( segid "    " and resid 96   and name H   ))
   (( segid "    " and resid 94   and name HA  ))
 ASSI {  936}
   (( segid "    " and resid 97   and name H   ))
   (( segid "    " and resid 99   and name H   ))
      3.500     1.500     1.500 peak   936 spectrum    1 weight  0.10000E+01 volume  0.12566E-02 ppm1      8.639 ppm2      7.871 CV     1
 OR {  936}
   (( segid "    " and resid 97   and name H   ))
   (( segid "    " and resid 96   and name H   ))
 ASSI {  943}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 114  and name HB  ))
      3.500     3.500     2.500 peak   943 spectrum    1 weight  0.10000E+01 volume  0.80166E-03 ppm1      7.852 ppm2      2.232 CV     1
 OR {  943}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 115  and name HB  ))
 OR {  943}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI {  944}
   (( segid "    " and resid 99   and name H   ))
   (  segid "    " and resid 102  and name HE% )
      3.900     1.900     1.900 peak   944 spectrum    1 weight  0.10000E+01 volume  0.84432E-03 ppm1      7.849 ppm2      2.174 CV     1
 OR {  944}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 102  and name HB3 ))
 OR {  944}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 115  and name HB  ))
 ASSI {  946}
   (( segid "    " and resid 99   and name H   ))
   (  segid "    " and resid 97   and name HG1%)
      4.000     2.000     2.000 peak   946 spectrum    1 weight  0.10000E+01 volume  0.17634E-02 ppm1      7.851 ppm2      1.020 CV     1
 OR {  946}
   (( segid "    " and resid 99   and name H   ))
   (  segid "    " and resid 101  and name HD1%)
 OR {  946}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 100  and name HB3 ))
 ASSI {  948}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 111  and name HG2 ))
      4.000     2.000     2.000 peak   948 spectrum    1 weight  0.10000E+01 volume  0.11466E-02 ppm1      7.840 ppm2      1.757 CV     1
 OR {  948}
   (( segid "    " and resid 99   and name H   ))
   (( segid "    " and resid 98   and name HG  ))
 ASSI {  950}
   (( segid "    " and resid 99   and name H   ))
   (  segid "    " and resid 98   and name HD1%)
      3.800     1.800     1.800 peak   950 spectrum    1 weight  0.10000E+01 volume  0.17200E-02 ppm1      7.842 ppm2      0.923 CV     1
 OR {  950}
   (( segid "    " and resid 99   and name H   ))
   (  segid "    " and resid 114  and name HG2%)
 OR {  950}
   (( segid "    " and resid 99   and name H   ))
   (  segid "    " and resid 130  and name HD2%)
 ASSI {  954}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 100  and name HA  ))
      2.700     0.900     0.900 peak   954 spectrum    1 weight  0.10000E+01 volume  0.39986E-02 ppm1      7.749 ppm2      3.944 CV     1
 OR {  954}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 98   and name HA  ))
 ASSI {  955}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 99   and name HA3 ))
      2.800     0.900     0.900 peak   955 spectrum    1 weight  0.10000E+01 volume  0.29219E-02 ppm1      7.748 ppm2      3.631 CV     1
 OR {  955}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 101  and name HA  ))
 ASSI {  956}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 96   and name HB3 ))
      3.900     1.900     1.900 peak   956 spectrum    1 weight  0.10000E+01 volume  0.82989E-03 ppm1      7.747 ppm2      2.590 CV     1
 OR {  956}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 96   and name HB2 ))
 OR {  956}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 104  and name HB2 ))
 ASSI {  958}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 98   and name HB3 ))
      3.900     1.900     1.900 peak   958 spectrum    1 weight  0.10000E+01 volume  0.96853E-03 ppm1      7.751 ppm2      1.837 CV     1
 OR {  958}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 103  and name HB3 ))
 OR {  958}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 103  and name HB2 ))
 ASSI {  959}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 98   and name HB2 ))
      4.300     2.300     1.700 peak   959 spectrum    1 weight  0.10000E+01 volume  0.73243E-03 ppm1      7.746 ppm2      1.429 CV     1
 OR {  959}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 103  and name HG3 ))
 ASSI {  960}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 100  and name HB3 ))
      3.300     1.400     1.400 peak   960 spectrum    1 weight  0.10000E+01 volume  0.47503E-02 ppm1      7.748 ppm2      0.993 CV     1
 OR {  960}
   (( segid "    " and resid 100  and name H   ))
   (  segid "    " and resid 101  and name HD1%)
 ASSI {  962}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 98   and name H   ))
      3.400     1.400     1.400 peak   962 spectrum    1 weight  0.10000E+01 volume  0.14661E-02 ppm1      7.748 ppm2      8.600 CV     1
 OR {  962}
   (( segid "    " and resid 100  and name H   ))
   (( segid "    " and resid 102  and name H   ))
 ASSI {  964}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 101  and name HA  ))
      3.100     1.200     1.200 peak   964 spectrum    1 weight  0.10000E+01 volume  0.13694E-02 ppm1      8.309 ppm2      3.633 CV     1
 OR {  964}
   (( segid "    " and resid 101  and name H   ))
   (( segid "    " and resid 99   and name HA3 ))
 ASSI {  966}
   (( segid "    " and resid 102  and name H   ))
   (  segid "    " and resid 101  and name HG2%)
      3.100     1.200     1.200 peak   966 spectrum    1 weight  0.10000E+01 volume  0.24073E-02 ppm1      8.598 ppm2      1.003 CV     1
 OR {  966}
   (( segid "    " and resid 102  and name H   ))
   (  segid "    " and resid 105  and name HG2%)
 OR {  966}
   (( segid "    " and resid 102  and name H   ))
   (  segid "    " and resid 101  and name HD1%)
 ASSI {  976}
   (( segid "    " and resid 103  and name H   ))
   (  segid "    " and resid 105  and name HG2%)
      3.600     1.700     1.700 peak   976 spectrum    1 weight  0.10000E+01 volume  0.14463E-02 ppm1      7.472 ppm2      1.012 CV     1
 OR {  976}
   (( segid "    " and resid 103  and name H   ))
   (  segid "    " and resid 101  and name HG2%)
 OR {  976}
   (( segid "    " and resid 103  and name H   ))
   (( segid "    " and resid 100  and name HB3 ))
 ASSI {  978}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 87   and name HB3 ))
      4.000     2.000     2.000 peak   978 spectrum    1 weight  0.10000E+01 volume  0.54978E-03 ppm1      7.375 ppm2      1.552 CV     1
 OR {  978}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 105  and name HG12))
 ASSI {  983}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 103  and name HG3 ))
      4.100     2.100     1.900 peak   983 spectrum    1 weight  0.10000E+01 volume  0.68048E-03 ppm1      7.371 ppm2      1.447 CV     1
 OR {  983}
   (( segid "    " and resid 104  and name H   ))
   (( segid "    " and resid 105  and name HG13))
 ASSI {  990}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 102  and name HA  ))
      3.700     1.700     1.700 peak   990 spectrum    1 weight  0.10000E+01 volume  0.10317E-02 ppm1      8.082 ppm2      4.034 CV     1
 OR {  990}
   (( segid "    " and resid 105  and name H   ))
   (( segid "    " and resid 106  and name HA  ))
 ASSI { 1016}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 105  and name H   ))
      3.100     3.100     2.900 peak  1016 spectrum    1 weight  0.10000E+01 volume  0.35558E-03 ppm1      7.635 ppm2      8.080 CV     1
 OR { 1016}
   (( segid "    " and resid 107  and name H   ))
   (( segid "    " and resid 114  and name H   ))
 ASSI { 1023}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 109  and name HB2 ))
      2.900     1.100     1.100 peak  1023 spectrum    1 weight  0.10000E+01 volume  0.47222E-02 ppm1      7.637 ppm2      1.736 CV     1
 OR { 1023}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 108  and name HB3 ))
 OR { 1023}
   (( segid "    " and resid 109  and name H   ))
   (( segid "    " and resid 108  and name HB2 ))
 ASSI { 1031}
   (( segid "    " and resid 110  and name H   ))
   (  segid "    " and resid 105  and name HD1%)
      4.000     2.000     2.000 peak  1031 spectrum    1 weight  0.10000E+01 volume  0.70913E-03 ppm1      8.371 ppm2      1.059 CV     1
 OR { 1031}
   (( segid "    " and resid 110  and name H   ))
   (  segid "    " and resid 84   and name HD1%)
 ASSI { 1032}
   (( segid "    " and resid 110  and name H   ))
   (  segid "    " and resid 114  and name HD1%)
      3.900     1.900     1.900 peak  1032 spectrum    1 weight  0.10000E+01 volume  0.79077E-03 ppm1      8.377 ppm2      0.946 CV     1
 OR { 1032}
   (( segid "    " and resid 110  and name H   ))
   (  segid "    " and resid 74   and name HG2%)
 ASSI { 1038}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 114  and name HG13))
      3.200     1.300     1.300 peak  1038 spectrum    1 weight  0.10000E+01 volume  0.16204E-02 ppm1      8.378 ppm2      1.853 CV     1
 OR { 1038}
   (( segid "    " and resid 110  and name H   ))
   (( segid "    " and resid 111  and name HB3 ))
 ASSI { 1044}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 126  and name HB2 ))
      3.500     1.500     1.500 peak  1044 spectrum    1 weight  0.10000E+01 volume  0.92239E-03 ppm1      9.021 ppm2      2.189 CV     1
 OR { 1044}
   (( segid "    " and resid 111  and name H   ))
   (  segid "    " and resid 102  and name HE% )
 OR { 1044}
   (( segid "    " and resid 127  and name H   ))
   (( segid "    " and resid 126  and name HG3 ))
 ASSI { 1048}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 111  and name HA  ))
      3.000     1.100     1.100 peak  1048 spectrum    1 weight  0.10000E+01 volume  0.17673E-02 ppm1      9.006 ppm2      4.001 CV     1
 OR { 1048}
   (( segid "    " and resid 111  and name H   ))
   (( segid "    " and resid 110  and name HB3 ))
 ASSI { 1053}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 110  and name HB2 ))
      4.300     2.300     1.700 peak  1053 spectrum    1 weight  0.10000E+01 volume  0.55236E-03 ppm1      8.526 ppm2      4.293 CV     1
 OR { 1053}
   (( segid "    " and resid 112  and name H   ))
   (( segid "    " and resid 113  and name HA  ))
 ASSI { 1061}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 113  and name HA  ))
      3.400     1.400     1.400 peak  1061 spectrum    1 weight  0.10000E+01 volume  0.98588E-03 ppm1      7.552 ppm2      4.326 CV     1
 OR { 1061}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 110  and name HB2 ))
 ASSI { 1062}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 110  and name HB3 ))
      3.400     1.500     1.500 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.81500E-03 ppm1      7.555 ppm2      4.003 CV     1
 OR { 1062}
   (( segid "    " and resid 113  and name H   ))
   (( segid "    " and resid 111  and name HA  ))
 ASSI { 1067}
   (( segid "    " and resid 113  and name H   ))
   (  segid "    " and resid 115  and name HG2%)
      4.100     2.100     1.900 peak  1067 spectrum    1 weight  0.10000E+01 volume  0.55375E-03 ppm1      7.559 ppm2      0.970 CV     1
 OR { 1067}
   (( segid "    " and resid 113  and name H   ))
   (  segid "    " and resid 114  and name HD1%)
 OR { 1067}
   (( segid "    " and resid 113  and name H   ))
   (  segid "    " and resid 114  and name HG2%)
 ASSI { 1070}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 112  and name HA  ))
      4.000     2.000     2.000 peak  1070 spectrum    1 weight  0.10000E+01 volume  0.69338E-03 ppm1      8.103 ppm2      4.071 CV     1
 OR { 1070}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI { 1073}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 113  and name HB3 ))
      2.600     0.900     0.900 peak  1073 spectrum    1 weight  0.10000E+01 volume  0.23130E-02 ppm1      8.099 ppm2      2.240 CV     1
 OR { 1073}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 114  and name HB  ))
 OR { 1073}
   (( segid "    " and resid 114  and name H   ))
   (( segid "    " and resid 113  and name HB2 ))
 ASSI { 1077}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 114  and name HB  ))
      2.700     0.900     0.900 peak  1077 spectrum    1 weight  0.10000E+01 volume  0.18082E-02 ppm1      8.565 ppm2      2.238 CV     1
 OR { 1077}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 115  and name HB  ))
 ASSI { 1078}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 114  and name HG13))
      4.200     2.200     1.800 peak  1078 spectrum    1 weight  0.10000E+01 volume  0.65903E-03 ppm1      8.568 ppm2      1.892 CV     1
 OR { 1078}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 111  and name HB2 ))
 OR { 1078}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 111  and name HB3 ))
 OR { 1078}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 127  and name HB3 ))
 OR { 1078}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 127  and name HB2 ))
 ASSI { 1080}
   (( segid "    " and resid 115  and name H   ))
   (  segid "    " and resid 115  and name HG2%)
      2.600     0.800     0.800 peak  1080 spectrum    1 weight  0.10000E+01 volume  0.29275E-02 ppm1      8.560 ppm2      0.959 CV     1
 OR { 1080}
   (( segid "    " and resid 115  and name H   ))
   (  segid "    " and resid 114  and name HG2%)
 OR { 1080}
   (( segid "    " and resid 115  and name H   ))
   (  segid "    " and resid 130  and name HD2%)
 ASSI { 1081}
   (( segid "    " and resid 115  and name H   ))
   (  segid "    " and resid 98   and name HD1%)
      3.400     1.400     1.400 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.22011E-02 ppm1      8.561 ppm2      0.885 CV     1
 OR { 1081}
   (( segid "    " and resid 115  and name H   ))
   (  segid "    " and resid 98   and name HD2%)
 OR { 1081}
   (( segid "    " and resid 115  and name H   ))
   (  segid "    " and resid 130  and name HD2%)
 ASSI { 1082}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 116  and name H   ))
      2.700     0.900     0.900 peak  1082 spectrum    1 weight  0.10000E+01 volume  0.18454E-02 ppm1      8.562 ppm2      8.107 CV     1
 OR { 1082}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 114  and name H   ))
 ASSI { 1083}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 113  and name H   ))
      4.300     2.300     1.700 peak  1083 spectrum    1 weight  0.10000E+01 volume  0.23929E-03 ppm1      8.557 ppm2      7.559 CV     1
 OR { 1083}
   (( segid "    " and resid 115  and name H   ))
   (( segid "    " and resid 117  and name H   ))
 ASSI { 1084}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 116  and name HA  ))
      2.700     0.900     0.900 peak  1084 spectrum    1 weight  0.10000E+01 volume  0.26081E-02 ppm1      8.114 ppm2      4.311 CV     1
 OR { 1084}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 113  and name HA  ))
 ASSI { 1089}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 117  and name HB3 ))
      4.500     2.600     1.500 peak  1089 spectrum    1 weight  0.10000E+01 volume  0.96399E-03 ppm1      8.122 ppm2      1.550 CV     1
 OR { 1089}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 127  and name HG3 ))
 OR { 1089}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 118  and name HB3 ))
 ASSI { 1090}
   (( segid "    " and resid 116  and name H   ))
   (  segid "    " and resid 112  and name HB% )
      4.400     2.400     1.600 peak  1090 spectrum    1 weight  0.10000E+01 volume  0.85229E-03 ppm1      8.117 ppm2      1.456 CV     1
 OR { 1090}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 130  and name HB2 ))
 ASSI { 1093}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 127  and name HG3 ))
      4.600     2.700     1.400 peak  1093 spectrum    1 weight  0.10000E+01 volume  0.78490E-03 ppm1      8.112 ppm2      1.519 CV     1
 OR { 1093}
   (( segid "    " and resid 116  and name H   ))
   (( segid "    " and resid 118  and name HB3 ))
 ASSI { 1097}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 116  and name HA  ))
      3.800     1.800     1.800 peak  1097 spectrum    1 weight  0.10000E+01 volume  0.51994E-03 ppm1      7.542 ppm2      4.314 CV     1
 OR { 1097}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 113  and name HA  ))
 ASSI { 1101}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 117  and name HB3 ))
      3.800     1.800     1.800 peak  1101 spectrum    1 weight  0.10000E+01 volume  0.14193E-02 ppm1      7.541 ppm2      1.556 CV     1
 OR { 1101}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 118  and name HB3 ))
 ASSI { 1102}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 120  and name HB% )
      3.800     1.800     1.800 peak  1102 spectrum    1 weight  0.10000E+01 volume  0.13655E-02 ppm1      7.546 ppm2      1.466 CV     1
 OR { 1102}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 112  and name HB% )
 ASSI { 1104}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 84   and name HD1%)
      4.400     2.400     1.600 peak  1104 spectrum    1 weight  0.10000E+01 volume  0.76275E-03 ppm1      7.550 ppm2      1.069 CV     1
 OR { 1104}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 123  and name HB2 ))
 ASSI { 1105}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 115  and name HG2%)
      4.000     2.000     2.000 peak  1105 spectrum    1 weight  0.10000E+01 volume  0.10437E-02 ppm1      7.549 ppm2      0.958 CV     1
 OR { 1105}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 114  and name HG2%)
 ASSI { 1106}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 130  and name HD2%)
      4.400     2.400     1.600 peak  1106 spectrum    1 weight  0.10000E+01 volume  0.75099E-03 ppm1      7.546 ppm2      0.886 CV     1
 OR { 1106}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 74   and name HG1%)
 ASSI { 1107}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 118  and name HD2%)
      4.500     2.600     1.500 peak  1107 spectrum    1 weight  0.10000E+01 volume  0.64583E-03 ppm1      7.546 ppm2      0.740 CV     1
 OR { 1107}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 121  and name HD1%)
 ASSI { 1109}
   (( segid "    " and resid 117  and name H   ))
   (( segid "    " and resid 117  and name HD3 ))
      3.800     1.800     1.800 peak  1109 spectrum    1 weight  0.10000E+01 volume  0.12286E-02 ppm1      7.546 ppm2      0.540 CV     1
 OR { 1109}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 118  and name HD1%)
 ASSI { 1111}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 73   and name HG2%)
      4.600     2.600     1.400 peak  1111 spectrum    1 weight  0.10000E+01 volume  0.80160E-03 ppm1      7.538 ppm2      0.816 CV     1
 OR { 1111}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 119  and name HD2%)
 OR { 1111}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 73   and name HD1%)
 OR { 1111}
   (( segid "    " and resid 117  and name H   ))
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 1116}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 117  and name HB3 ))
      3.600     1.600     1.600 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.12994E-02 ppm1      8.401 ppm2      1.546 CV     1
 OR { 1116}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 118  and name HB3 ))
 ASSI { 1117}
   (( segid "    " and resid 118  and name H   ))
   (  segid "    " and resid 120  and name HB% )
      4.000     2.000     2.000 peak  1117 spectrum    1 weight  0.10000E+01 volume  0.98228E-03 ppm1      8.401 ppm2      1.452 CV     1
 OR { 1117}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 130  and name HB2 ))
 OR { 1117}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 121  and name HB3 ))
 ASSI { 1118}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 123  and name HB2 ))
      3.700     1.700     1.700 peak  1118 spectrum    1 weight  0.10000E+01 volume  0.22794E-02 ppm1      8.401 ppm2      1.029 CV     1
 OR { 1118}
   (( segid "    " and resid 118  and name H   ))
   (  segid "    " and resid 84   and name HD1%)
 ASSI { 1119}
   (( segid "    " and resid 118  and name H   ))
   (  segid "    " and resid 114  and name HG2%)
      3.200     1.300     1.300 peak  1119 spectrum    1 weight  0.10000E+01 volume  0.27244E-02 ppm1      8.401 ppm2      0.909 CV     1
 OR { 1119}
   (( segid "    " and resid 118  and name H   ))
   (  segid "    " and resid 115  and name HG2%)
 OR { 1119}
   (( segid "    " and resid 118  and name H   ))
   (  segid "    " and resid 130  and name HD2%)
 ASSI { 1120}
   (( segid "    " and resid 118  and name H   ))
   (  segid "    " and resid 118  and name HD2%)
      3.600     1.600     1.600 peak  1120 spectrum    1 weight  0.10000E+01 volume  0.20842E-02 ppm1      8.401 ppm2      0.750 CV     1
 OR { 1120}
   (( segid "    " and resid 118  and name H   ))
   (  segid "    " and resid 121  and name HD1%)
 OR { 1120}
   (( segid "    " and resid 118  and name H   ))
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 1121}
   (( segid "    " and resid 118  and name H   ))
   (  segid "    " and resid 119  and name HD1%)
      3.400     1.500     1.500 peak  1121 spectrum    1 weight  0.10000E+01 volume  0.24375E-02 ppm1      8.403 ppm2      0.607 CV     1
 OR { 1121}
   (( segid "    " and resid 118  and name H   ))
   (( segid "    " and resid 123  and name HB3 ))
 ASSI { 1122}
   (( segid "    " and resid 118  and name H   ))
   (  segid "    " and resid 118  and name HD1%)
      3.400     1.400     1.400 peak  1122 spectrum    1 weight  0.10000E+01 volume  0.21431E-02 ppm1      8.399 ppm2      0.528 CV     1
 OR { 1122}
   (( segid "    " and resid 118  and name H   ))
   (  segid "    " and resid 124  and name HG1%)
 ASSI { 1125}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 116  and name HA  ))
      3.600     1.600     1.600 peak  1125 spectrum    1 weight  0.10000E+01 volume  0.10292E-02 ppm1      7.880 ppm2      4.297 CV     1
 OR { 1125}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 124  and name HA  ))
 ASSI { 1129}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 118  and name HB3 ))
      2.800     1.000     1.000 peak  1129 spectrum    1 weight  0.10000E+01 volume  0.46446E-02 ppm1      7.885 ppm2      1.544 CV     1
 OR { 1129}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 119  and name HB3 ))
 OR { 1129}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 119  and name HG  ))
 ASSI { 1130}
   (( segid "    " and resid 119  and name H   ))
   (  segid "    " and resid 119  and name HD2%)
      3.800     1.800     1.800 peak  1130 spectrum    1 weight  0.10000E+01 volume  0.28702E-02 ppm1      7.883 ppm2      0.795 CV     1
 OR { 1130}
   (( segid "    " and resid 119  and name H   ))
   (  segid "    " and resid 118  and name HD2%)
 OR { 1130}
   (( segid "    " and resid 119  and name H   ))
   (  segid "    " and resid 124  and name HG2%)
 ASSI { 1132}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 117  and name H   ))
      3.800     1.800     1.800 peak  1132 spectrum    1 weight  0.10000E+01 volume  0.75289E-03 ppm1      7.886 ppm2      7.563 CV     1
 OR { 1132}
   (( segid "    " and resid 119  and name H   ))
   (( segid "    " and resid 123  and name H   ))
 ASSI { 1140}
   (( segid "    " and resid 120  and name H   ))
   (  segid "    " and resid 119  and name HD2%)
      4.200     2.200     1.800 peak  1140 spectrum    1 weight  0.10000E+01 volume  0.15700E-02 ppm1      8.153 ppm2      0.782 CV     1
 OR { 1140}
   (( segid "    " and resid 120  and name H   ))
   (  segid "    " and resid 118  and name HD2%)
 OR { 1140}
   (( segid "    " and resid 120  and name H   ))
   (  segid "    " and resid 124  and name HG2%)
 OR { 1140}
   (( segid "    " and resid 120  and name H   ))
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 1141}
   (( segid "    " and resid 120  and name H   ))
   (  segid "    " and resid 119  and name HD1%)
      3.900     1.900     1.900 peak  1141 spectrum    1 weight  0.10000E+01 volume  0.17028E-02 ppm1      8.153 ppm2      0.678 CV     1
 OR { 1141}
   (( segid "    " and resid 120  and name H   ))
   (  segid "    " and resid 121  and name HD1%)
 ASSI { 1142}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 119  and name H   ))
      2.600     0.900     0.900 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.26231E-02 ppm1      8.155 ppm2      7.878 CV     1
 OR { 1142}
   (( segid "    " and resid 120  and name H   ))
   (( segid "    " and resid 122  and name H   ))
 ASSI { 1144}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 121  and name HA  ))
      2.800     1.000     1.000 peak  1144 spectrum    1 weight  0.10000E+01 volume  0.26738E-02 ppm1      8.153 ppm2      4.173 CV     1
 OR { 1144}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 71   and name HB  ))
 ASSI { 1147}
   (( segid "    " and resid 121  and name H   ))
   (  segid "    " and resid 120  and name HB% )
      2.600     0.800     0.800 peak  1147 spectrum    1 weight  0.10000E+01 volume  0.41668E-02 ppm1      8.145 ppm2      1.458 CV     1
 OR { 1147}
   (( segid "    " and resid 121  and name H   ))
   (( segid "    " and resid 121  and name HB3 ))
 ASSI { 1152}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 121  and name HG  ))
      3.600     1.600     1.600 peak  1152 spectrum    1 weight  0.10000E+01 volume  0.17714E-02 ppm1      7.838 ppm2      1.551 CV     1
 OR { 1152}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 119  and name HB3 ))
 OR { 1152}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 119  and name HG  ))
 ASSI { 1154}
   (( segid "    " and resid 122  and name H   ))
   (  segid "    " and resid 123  and name HD2%)
      3.700     1.700     1.700 peak  1154 spectrum    1 weight  0.10000E+01 volume  0.16654E-02 ppm1      7.837 ppm2      0.617 CV     1
 OR { 1154}
   (( segid "    " and resid 122  and name H   ))
   (  segid "    " and resid 119  and name HD1%)
 OR { 1154}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 123  and name HB3 ))
 ASSI { 1157}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 121  and name H   ))
      2.700     0.900     0.900 peak  1157 spectrum    1 weight  0.10000E+01 volume  0.24187E-02 ppm1      7.836 ppm2      8.148 CV     1
 OR { 1157}
   (( segid "    " and resid 122  and name H   ))
   (( segid "    " and resid 120  and name H   ))
 ASSI { 1158}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 119  and name HA  ))
      3.700     1.700     1.700 peak  1158 spectrum    1 weight  0.10000E+01 volume  0.82969E-03 ppm1      7.580 ppm2      4.151 CV     1
 OR { 1158}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 121  and name HA  ))
 ASSI { 1159}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 123  and name HA  ))
      2.800     1.000     1.000 peak  1159 spectrum    1 weight  0.10000E+01 volume  0.21753E-02 ppm1      7.576 ppm2      3.982 CV     1
 OR { 1159}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 122  and name HA2 ))
 ASSI { 1165}
   (( segid "    " and resid 123  and name H   ))
   (  segid "    " and resid 123  and name HD1%)
      3.700     1.700     1.700 peak  1165 spectrum    1 weight  0.10000E+01 volume  0.23308E-02 ppm1      7.576 ppm2      0.796 CV     1
 OR { 1165}
   (( segid "    " and resid 123  and name H   ))
   (  segid "    " and resid 118  and name HD2%)
 ASSI { 1168}
   (( segid "    " and resid 123  and name H   ))
   (  segid "    " and resid 121  and name HD1%)
      3.500     1.500     1.500 peak  1168 spectrum    1 weight  0.10000E+01 volume  0.25426E-02 ppm1      7.573 ppm2      0.700 CV     1
 OR { 1168}
   (( segid "    " and resid 123  and name H   ))
   (  segid "    " and resid 119  and name HD1%)
 ASSI { 1170}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 121  and name H   ))
      3.800     1.800     1.800 peak  1170 spectrum    1 weight  0.10000E+01 volume  0.66903E-03 ppm1      7.573 ppm2      8.145 CV     1
 OR { 1170}
   (( segid "    " and resid 123  and name H   ))
   (( segid "    " and resid 120  and name H   ))
 ASSI { 1174}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 122  and name HA2 ))
      2.900     1.100     1.100 peak  1174 spectrum    1 weight  0.10000E+01 volume  0.19686E-02 ppm1      6.800 ppm2      3.973 CV     1
 OR { 1174}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 123  and name HA  ))
 ASSI { 1175}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 124  and name HB  ))
      3.700     1.700     1.700 peak  1175 spectrum    1 weight  0.10000E+01 volume  0.10672E-02 ppm1      6.796 ppm2      1.897 CV     1
 OR { 1175}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 118  and name HG  ))
 ASSI { 1176}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 118  and name HB3 ))
      3.900     1.900     1.900 peak  1176 spectrum    1 weight  0.10000E+01 volume  0.73512E-03 ppm1      6.799 ppm2      1.549 CV     1
 OR { 1176}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 119  and name HG  ))
 OR { 1176}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 119  and name HB3 ))
 ASSI { 1180}
   (( segid "    " and resid 124  and name H   ))
   (  segid "    " and resid 124  and name HG2%)
      3.400     1.400     1.400 peak  1180 spectrum    1 weight  0.10000E+01 volume  0.24294E-02 ppm1      6.800 ppm2      0.792 CV     1
 OR { 1180}
   (( segid "    " and resid 124  and name H   ))
   (  segid "    " and resid 118  and name HD2%)
 ASSI { 1185}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 122  and name H   ))
      4.100     2.100     1.900 peak  1185 spectrum    1 weight  0.10000E+01 volume  0.82038E-03 ppm1      6.797 ppm2      7.848 CV     1
 OR { 1185}
   (( segid "    " and resid 124  and name H   ))
   (( segid "    " and resid 119  and name H   ))
 ASSI { 1187}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 124  and name HA  ))
      2.200     0.600     0.600 peak  1187 spectrum    1 weight  0.10000E+01 volume  0.77004E-02 ppm1      8.864 ppm2      4.283 CV     1
 OR { 1187}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 125  and name HA  ))
 ASSI { 1188}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 126  and name HG3 ))
      4.600     2.600     1.400 peak  1188 spectrum    1 weight  0.10000E+01 volume  0.98254E-03 ppm1      8.862 ppm2      2.213 CV     1
 OR { 1188}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 129  and name HB3 ))
 OR { 1188}
   (( segid "    " and resid 125  and name H   ))
   (( segid "    " and resid 126  and name HB2 ))
 ASSI { 1197}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 125  and name HA  ))
      3.200     1.300     1.300 peak  1197 spectrum    1 weight  0.10000E+01 volume  0.34252E-02 ppm1      7.632 ppm2      4.294 CV     1
 OR { 1197}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 124  and name HA  ))
 ASSI { 1199}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 126  and name HG3 ))
      3.000     1.100     1.100 peak  1199 spectrum    1 weight  0.10000E+01 volume  0.35241E-02 ppm1      7.632 ppm2      2.218 CV     1
 OR { 1199}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 126  and name HB2 ))
 OR { 1199}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 129  and name HB3 ))
 ASSI { 1200}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 126  and name HB3 ))
      3.100     1.200     1.200 peak  1200 spectrum    1 weight  0.10000E+01 volume  0.29226E-02 ppm1      7.632 ppm2      1.909 CV     1
 OR { 1200}
   (( segid "    " and resid 126  and name H   ))
   (( segid "    " and resid 124  and name HB  ))
 ASSI { 1214}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 128  and name HB3 ))
      2.500     0.800     0.800 peak  1214 spectrum    1 weight  0.10000E+01 volume  0.46531E-02 ppm1      8.614 ppm2      1.875 CV     1
 OR { 1214}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 128  and name HB2 ))
 OR { 1214}
   (( segid "    " and resid 128  and name H   ))
   (( segid "    " and resid 127  and name HB2 ))
 ASSI { 1222}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 126  and name HG3 ))
      2.200     0.600     0.600 peak  1222 spectrum    1 weight  0.10000E+01 volume  0.55993E-02 ppm1      7.791 ppm2      2.224 CV     1
 OR { 1222}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 129  and name HB2 ))
 OR { 1222}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 129  and name HB3 ))
 ASSI { 1223}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 128  and name HB3 ))
      3.000     1.200     1.200 peak  1223 spectrum    1 weight  0.10000E+01 volume  0.21412E-02 ppm1      7.792 ppm2      1.890 CV     1
 OR { 1223}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 128  and name HB2 ))
 OR { 1223}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 124  and name HB  ))
 ASSI { 1224}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 128  and name HG2 ))
      3.200     1.300     1.300 peak  1224 spectrum    1 weight  0.10000E+01 volume  0.21568E-02 ppm1      7.791 ppm2      1.648 CV     1
 OR { 1224}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 128  and name HG3 ))
 OR { 1224}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 130  and name HG  ))
 ASSI { 1225}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 118  and name HB3 ))
      3.600     3.600     2.400 peak  1225 spectrum    1 weight  0.10000E+01 volume  0.78965E-03 ppm1      7.787 ppm2      1.490 CV     1
 OR { 1225}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 133  and name HG2 ))
 OR { 1225}
   (( segid "    " and resid 129  and name H   ))
   (  segid "    " and resid 112  and name HB% )
 OR { 1225}
   (( segid "    " and resid 129  and name H   ))
   (( segid "    " and resid 133  and name HG3 ))
 ASSI { 1230}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 129  and name HB3 ))
      3.500     1.500     1.500 peak  1230 spectrum    1 weight  0.10000E+01 volume  0.21480E-02 ppm1      7.760 ppm2      2.228 CV     1
 OR { 1230}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 115  and name HB  ))
 OR { 1230}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 126  and name HG3 ))
 ASSI { 1231}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 127  and name HB3 ))
      3.400     1.500     1.500 peak  1231 spectrum    1 weight  0.10000E+01 volume  0.22176E-02 ppm1      7.763 ppm2      1.847 CV     1
 OR { 1231}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 124  and name HB  ))
 OR { 1231}
   (( segid "    " and resid 130  and name H   ))
   (( segid "    " and resid 127  and name HB2 ))
 ASSI { 1239}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 128  and name HB3 ))
      4.000     2.000     2.000 peak  1239 spectrum    1 weight  0.10000E+01 volume  0.84930E-03 ppm1      7.427 ppm2      1.899 CV     1
 OR { 1239}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 128  and name HB2 ))
 OR { 1239}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 132  and name HB3 ))
 OR { 1239}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 127  and name HB3 ))
 OR { 1239}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 133  and name HB3 ))
 ASSI { 1246}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 128  and name HB3 ))
      4.200     2.200     1.800 peak  1246 spectrum    1 weight  0.10000E+01 volume  0.65653E-03 ppm1      7.421 ppm2      1.823 CV     1
 OR { 1246}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 128  and name HB2 ))
 OR { 1246}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 132  and name HB3 ))
 OR { 1246}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 133  and name HB2 ))
 OR { 1246}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 127  and name HB3 ))
 OR { 1246}
   (( segid "    " and resid 131  and name H   ))
   (( segid "    " and resid 132  and name HB2 ))
 ASSI { 1252}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 132  and name HA  ))
      2.100     0.600     0.600 peak  1252 spectrum    1 weight  0.10000E+01 volume  0.13606E-01 ppm1      8.487 ppm2      4.378 CV     1
 OR { 1252}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 133  and name HA  ))
 ASSI { 1253}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 133  and name HB2 ))
      2.400     0.700     0.700 peak  1253 spectrum    1 weight  0.10000E+01 volume  0.93045E-02 ppm1      8.487 ppm2      1.835 CV     1
 OR { 1253}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 133  and name HB3 ))
 OR { 1253}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 132  and name HB2 ))
 ASSI { 1254}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 133  and name HG2 ))
      3.200     1.300     1.300 peak  1254 spectrum    1 weight  0.10000E+01 volume  0.38001E-02 ppm1      8.486 ppm2      1.496 CV     1
 OR { 1254}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 133  and name HG3 ))
 OR { 1254}
   (( segid "    " and resid 133  and name H   ))
   (( segid "    " and resid 132  and name HG3 ))
 ASSI { 1256}
   (( segid "    " and resid 134  and name H   ))
   (( segid "    " and resid 133  and name HA  ))
      2.000     0.500     0.500 peak  1256 spectrum    1 weight  0.10000E+01 volume  0.16882E-01 ppm1      8.531 ppm2      4.375 CV     1
 OR { 1256}
   (( segid "    " and resid 134  and name H   ))
   (( segid "    " and resid 134  and name HA  ))
 ASSI { 1258}
   (( segid "    " and resid 134  and name H   ))
   (( segid "    " and resid 134  and name HB2 ))
      2.300     0.700     0.700 peak  1258 spectrum    1 weight  0.10000E+01 volume  0.11193E-01 ppm1      8.531 ppm2      1.822 CV     1
 OR { 1258}
   (( segid "    " and resid 134  and name H   ))
   (( segid "    " and resid 133  and name HB3 ))
 OR { 1258}
   (( segid "    " and resid 134  and name H   ))
   (( segid "    " and resid 134  and name HB3 ))
 ASSI { 1260}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 134  and name HA  ))
      2.300     0.700     0.700 peak  1260 spectrum    1 weight  0.10000E+01 volume  0.74138E-02 ppm1      8.523 ppm2      4.357 CV     1
 OR { 1260}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 135  and name HA  ))
 ASSI { 1261}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 134  and name HD3 ))
      3.100     1.200     1.200 peak  1261 spectrum    1 weight  0.10000E+01 volume  0.37111E-03 ppm1      8.527 ppm2      3.234 CV     1
 OR { 1261}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 134  and name HD2 ))
 OR { 1261}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 128  and name HD2 ))
 OR { 1261}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 128  and name HD3 ))
 ASSI { 1266}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 134  and name HG2 ))
      2.800     2.800     3.200 peak  1266 spectrum    1 weight  0.10000E+01 volume  0.12846E-02 ppm1      8.523 ppm2      1.711 CV     1
 OR { 1266}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 134  and name HG3 ))
 OR { 1266}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 136  and name HD3 ))
 OR { 1266}
   (( segid "    " and resid 135  and name H   ))
   (( segid "    " and resid 136  and name HD2 ))
 ASSI { 1271}
   (( segid "    " and resid 135  and name HE21))
   (( segid "    " and resid 129  and name HB2 ))
      2.600     2.600     3.400 peak  1271 spectrum    1 weight  0.10000E+01 volume  0.57320E-03 ppm1      7.611 ppm2      2.208 CV     1
 OR { 1271}
   (( segid "    " and resid 135  and name HE21))
   (( segid "    " and resid 129  and name HB3 ))
 OR { 1271}
   (( segid "    " and resid 135  and name HE21))
   (( segid "    " and resid 126  and name HG3 ))
 ASSI { 1274}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 135  and name HA  ))
      2.300     0.600     0.600 peak  1274 spectrum    1 weight  0.10000E+01 volume  0.93459E-02 ppm1      8.456 ppm2      4.344 CV     1
 OR { 1274}
   (( segid "    " and resid 136  and name H   ))
   (( segid "    " and resid 136  and name HA  ))
 ASSI { 1280}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 136  and name HA  ))
      2.200     0.600     0.600 peak  1280 spectrum    1 weight  0.10000E+01 volume  0.11862E-01 ppm1      8.423 ppm2      4.303 CV     1
 OR { 1280}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 137  and name HA  ))
 ASSI { 1281}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 136  and name HB2 ))
      2.500     0.800     0.800 peak  1281 spectrum    1 weight  0.10000E+01 volume  0.64747E-02 ppm1      8.422 ppm2      1.775 CV     1
 OR { 1281}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 137  and name HB3 ))
 OR { 1281}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 137  and name HB2 ))
 OR { 1281}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 136  and name HB3 ))
 ASSI { 1282}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 137  and name HG2 ))
      3.200     1.300     1.300 peak  1282 spectrum    1 weight  0.10000E+01 volume  0.20540E-02 ppm1      8.423 ppm2      1.441 CV     1
 OR { 1282}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 137  and name HG3 ))
 OR { 1282}
   (( segid "    " and resid 137  and name H   ))
   (( segid "    " and resid 136  and name HG3 ))
 ASSI { 1287}
   (( segid "    " and resid 139  and name H   ))
   (( segid "    " and resid 137  and name HA  ))
      2.900     2.900     3.100 peak  1287 spectrum    1 weight  0.10000E+01 volume  0.11525E-02 ppm1      8.378 ppm2      4.252 CV     1
 OR { 1287}
   (( segid "    " and resid 139  and name H   ))
   (( segid "    " and resid 141  and name HA  ))
 ASSI { 1296}
   (( segid "    " and resid 141  and name H   ))
   (( segid "    " and resid 141  and name HB3 ))
      3.800     1.800     1.800 peak  1296 spectrum    1 weight  0.10000E+01 volume  0.94903E-03 ppm1      7.980 ppm2      3.889 CV     1
 OR { 1296}
   (( segid "    " and resid 141  and name H   ))
   (( segid "    " and resid 141  and name HB2 ))
 OR { 1296}
   (( segid "    " and resid 141  and name H   ))
   (( segid "    " and resid 140  and name HB2 ))
 OR { 1296}
   (( segid "    " and resid 141  and name H   ))
   (( segid "    " and resid 140  and name HB3 ))
 ASSI { 1298}
   (( segid "    " and resid 141  and name H   ))
   (( segid "    " and resid 124  and name HB  ))
      2.300     2.300     3.700 peak  1298 spectrum    1 weight  0.10000E+01 volume  0.12002E-02 ppm1      7.980 ppm2      1.852 CV     1
 OR { 1298}
   (( segid "    " and resid 141  and name H   ))
   (( segid "    " and resid 128  and name HB3 ))
 OR { 1298}
   (( segid "    " and resid 141  and name H   ))
   (( segid "    " and resid 128  and name HB2 ))
 ASSI { 1304}
   (( segid "    " and resid 24   and name HD22))
   (  segid "    " and resid 23   and name HB% )
      3.500     1.500     1.500 peak  1304 spectrum    1 weight  0.10000E+01 volume  0.14578E-02 ppm1      7.492 ppm2      1.435 CV     1
 OR { 1304}
   (( segid "    " and resid 24   and name HD22))
   (  segid "    " and resid 35   and name HB% )
 ASSI { 1317}
   (( segid "    " and resid 45   and name HE  ))
   (( segid "    " and resid 45   and name HD2 ))
      3.300     1.400     1.400 peak  1317 spectrum    1 weight  0.10000E+01 volume  0.84219E-03 ppm1      7.114 ppm2      2.312 CV     1
 OR { 1317}
   (( segid "    " and resid 45   and name HE  ))
   (( segid "    " and resid 49   and name HG3 ))
 ASSI { 1320}
   (( segid "    " and resid 45   and name HE  ))
   (( segid "    " and resid 45   and name HG2 ))
      3.800     1.800     1.800 peak  1320 spectrum    1 weight  0.10000E+01 volume  0.11442E-02 ppm1      7.113 ppm2      1.527 CV     1
 OR { 1320}
   (( segid "    " and resid 45   and name HE  ))
   (( segid "    " and resid 50   and name HG12))
 ASSI { 1327}
   (( segid "    " and resid 111  and name HE  ))
   (  segid "    " and resid 101  and name HG2%)
      2.600     2.600     3.400 peak  1327 spectrum    1 weight  0.10000E+01 volume  0.58013E-03 ppm1      7.423 ppm2      0.943 CV     1
 OR { 1327}
   (( segid "    " and resid 111  and name HE  ))
   (  segid "    " and resid 114  and name HD1%)
 OR { 1327}
   (( segid "    " and resid 111  and name HE  ))
   (  segid "    " and resid 114  and name HG2%)
 OR { 1327}
   (( segid "    " and resid 111  and name HE  ))
   (  segid "    " and resid 115  and name HG2%)
 ASSI { 1328}
   (( segid "    " and resid 109  and name HE  ))
   (  segid "    " and resid 105  and name HD1%)
      4.000     2.000     2.000 peak  1328 spectrum    1 weight  0.10000E+01 volume  0.53815E-03 ppm1      6.510 ppm2      1.026 CV     1
 OR { 1328}
   (( segid "    " and resid 109  and name HE  ))
   (  segid "    " and resid 101  and name HG2%)
 ASSI { 1331}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 69   and name H   ))
      4.300     2.300     1.700 peak  1331 spectrum    1 weight  0.10000E+01 volume  0.29019E-03 ppm1      8.548 ppm2      8.084 CV     1
 OR { 1331}
   (( segid "    " and resid 70   and name H   ))
   (( segid "    " and resid 71   and name H   ))
 ASSI {    1}
   (( segid "    " and resid 73   and name HB  ))
   (( segid "    " and resid 73   and name HA  ))
      2.600     0.900     0.900 peak     1 spectrum    1 weight  0.10000E+01 volume  0.35019E-02 ppm1      1.775 ppm2      4.141 CV     1
 OR {    1}
   (( segid "    " and resid 73   and name HB  ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI {    9}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 51   and name H   ))
      3.200     1.300     1.300 peak     9 spectrum    1 weight  0.10000E+01 volume  0.21039E-02 ppm1      3.885 ppm2      8.212 CV     1
 OR {    9}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 89   and name H   ))
 OR {    9}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 52   and name H   ))
 ASSI {   16}
   (( segid "    " and resid 114  and name HA  ))
   (  segid "    " and resid 84   and name HD2%)
      4.100     2.100     1.900 peak    16 spectrum    1 weight  0.10000E+01 volume  0.10327E-02 ppm1      3.872 ppm2      0.605 CV     1
 OR {   16}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 117  and name HD3 ))
 ASSI {   17}
   (( segid "    " and resid 141  and name HB3 ))
   (( segid "    " and resid 138  and name HG  ))
      2.400     2.400     3.600 peak    17 spectrum    1 weight  0.10000E+01 volume  0.79852E-03 ppm1      3.879 ppm2      1.643 CV     1
 OR {   17}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 138  and name HG  ))
 OR {   17}
   (( segid "    " and resid 141  and name HB3 ))
   (( segid "    " and resid 138  and name HB2 ))
 OR {   17}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 138  and name HB2 ))
 OR {   17}
   (( segid "    " and resid 141  and name HB3 ))
   (( segid "    " and resid 138  and name HB3 ))
 OR {   17}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 138  and name HB3 ))
 OR {   17}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 130  and name HG  ))
 ASSI {   19}
   (( segid "    " and resid 140  and name HA  ))
   (  segid "    " and resid 139  and name HB% )
      2.500     2.500     3.500 peak    19 spectrum    1 weight  0.10000E+01 volume  0.71738E-03 ppm1      4.488 ppm2      1.438 CV     1
 OR {   19}
   (( segid "    " and resid 140  and name HA  ))
   (  segid "    " and resid 125  and name HB% )
 ASSI {   25}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 140  and name HA  ))
      2.700     0.900     0.900 peak    25 spectrum    1 weight  0.10000E+01 volume  0.37729E-02 ppm1      3.886 ppm2      4.489 CV     1
 OR {   25}
   (( segid "    " and resid 3    and name HB3 ))
   (( segid "    " and resid 3    and name HA  ))
 OR {   25}
   (( segid "    " and resid 140  and name HB3 ))
   (( segid "    " and resid 140  and name HA  ))
 OR {   25}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 3    and name HA  ))
 ASSI {   31}
   (( segid "    " and resid 3    and name HB3 ))
   (( segid "    " and resid 4    and name HG2 ))
      3.800     1.800     1.800 peak    31 spectrum    1 weight  0.10000E+01 volume  0.82381E-03 ppm1      3.933 ppm2      1.648 CV     1
 OR {   31}
   (( segid "    " and resid 3    and name HB3 ))
   (( segid "    " and resid 4    and name HG3 ))
 OR {   31}
   (( segid "    " and resid 3    and name HB3 ))
   (( segid "    " and resid 45   and name HB3 ))
 ASSI {   32}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 4    and name HG3 ))
      3.800     1.800     1.800 peak    32 spectrum    1 weight  0.10000E+01 volume  0.10794E-02 ppm1      3.880 ppm2      1.661 CV     1
 OR {   32}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 4    and name HG2 ))
 OR {   32}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 45   and name HB3 ))
 OR {   32}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI {   33}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HB  ))
      2.300     0.600     0.600 peak    33 spectrum    1 weight  0.10000E+01 volume  0.61198E-02 ppm1      3.956 ppm2      2.211 CV     1
 OR {   33}
   (( segid "    " and resid 110  and name HB3 ))
   (( segid "    " and resid 113  and name HB2 ))
 ASSI {   35}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 53   and name HB2 ))
      2.800     1.000     1.000 peak    35 spectrum    1 weight  0.10000E+01 volume  0.19240E-02 ppm1      3.779 ppm2      2.196 CV     1
 OR {   35}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HB  ))
 OR {   35}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 49   and name HB3 ))
 ASSI {   47}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 139  and name H   ))
      2.600     0.900     0.900 peak    47 spectrum    1 weight  0.10000E+01 volume  0.31064E-02 ppm1      4.357 ppm2      8.363 CV     1
 OR {   47}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name H   ))
 ASSI {   48}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 138  and name H   ))
      2.900     1.100     1.100 peak    48 spectrum    1 weight  0.10000E+01 volume  0.27415E-02 ppm1      1.658 ppm2      8.366 CV     1
 OR {   48}
   (( segid "    " and resid 138  and name HB3 ))
   (( segid "    " and resid 138  and name H   ))
 OR {   48}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 139  and name H   ))
 ASSI {   50}
   (( segid "    " and resid 138  and name HG  ))
   (( segid "    " and resid 139  and name H   ))
      2.500     0.800     0.800 peak    50 spectrum    1 weight  0.10000E+01 volume  0.34599E-02 ppm1      1.659 ppm2      8.363 CV     1
 OR {   50}
   (( segid "    " and resid 86   and name HG3 ))
   (( segid "    " and resid 86   and name H   ))
 OR {   50}
   (( segid "    " and resid 5    and name HG3 ))
   (( segid "    " and resid 6    and name H   ))
 OR {   50}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 6    and name H   ))
 ASSI {   51}
   (  segid "    " and resid 75   and name HD1%)
   (( segid "    " and resid 75   and name H   ))
      3.500     1.600     1.600 peak    51 spectrum    1 weight  0.10000E+01 volume  0.23714E-02 ppm1      0.928 ppm2      8.389 CV     1
 OR {   51}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 86   and name H   ))
 OR {   51}
   (  segid "    " and resid 138  and name HD2%)
   (( segid "    " and resid 139  and name H   ))
 OR {   51}
   (  segid "    " and resid 138  and name HD2%)
   (( segid "    " and resid 138  and name H   ))
 ASSI {   53}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 139  and name H   ))
      3.000     1.200     1.200 peak    53 spectrum    1 weight  0.10000E+01 volume  0.24852E-02 ppm1      0.888 ppm2      8.380 CV     1
 OR {   53}
   (  segid "    " and resid 75   and name HD2%)
   (( segid "    " and resid 75   and name H   ))
 ASSI {   54}
   (( segid "    " and resid 130  and name HG  ))
   (( segid "    " and resid 130  and name H   ))
      2.900     1.100     1.100 peak    54 spectrum    1 weight  0.10000E+01 volume  0.22792E-02 ppm1      1.641 ppm2      7.770 CV     1
 OR {   54}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 129  and name H   ))
 OR {   54}
   (( segid "    " and resid 128  and name HG3 ))
   (( segid "    " and resid 129  and name H   ))
 ASSI {   55}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 37   and name H   ))
      2.000     0.500     0.500 peak    55 spectrum    1 weight  0.10000E+01 volume  0.42147E-02 ppm1      1.667 ppm2      8.582 CV     1
 OR {   55}
   (( segid "    " and resid 134  and name HG2 ))
   (( segid "    " and resid 134  and name H   ))
 OR {   55}
   (( segid "    " and resid 134  and name HG3 ))
   (( segid "    " and resid 134  and name H   ))
 ASSI {   56}
   (  segid "    " and resid 33   and name HG1%)
   (( segid "    " and resid 37   and name H   ))
      3.500     1.600     1.600 peak    56 spectrum    1 weight  0.10000E+01 volume  0.25928E-02 ppm1      0.932 ppm2      8.586 CV     1
 OR {   56}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 115  and name H   ))
 ASSI {   57}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 128  and name H   ))
      2.100     2.100     3.900 peak    57 spectrum    1 weight  0.10000E+01 volume  0.21874E-02 ppm1      0.887 ppm2      8.657 CV     1
 OR {   57}
   (  segid "    " and resid 75   and name HD2%)
   (( segid "    " and resid 76   and name H   ))
 OR {   57}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 97   and name H   ))
 ASSI {   59}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 115  and name H   ))
      2.900     1.100     1.100 peak    59 spectrum    1 weight  0.10000E+01 volume  0.42970E-02 ppm1      0.892 ppm2      8.565 CV     1
 OR {   59}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 98   and name H   ))
 ASSI {   61}
   (  segid "    " and resid 33   and name HG1%)
   (( segid "    " and resid 34   and name H   ))
      2.100     0.600     0.600 peak    61 spectrum    1 weight  0.10000E+01 volume  0.79447E-02 ppm1      0.940 ppm2      7.982 CV     1
 OR {   61}
   (  segid "    " and resid 33   and name HG1%)
   (( segid "    " and resid 33   and name H   ))
 ASSI {   63}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 130  and name H   ))
      3.500     1.600     1.600 peak    63 spectrum    1 weight  0.10000E+01 volume  0.36930E-02 ppm1      0.930 ppm2      7.761 CV     1
 OR {   63}
   (  segid "    " and resid 33   and name HG1%)
   (( segid "    " and resid 67   and name H   ))
 ASSI {   64}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 85   and name H   ))
      3.100     1.200     1.200 peak    64 spectrum    1 weight  0.10000E+01 volume  0.60911E-02 ppm1      0.942 ppm2      8.135 CV     1
 OR {   64}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 82   and name H   ))
 OR {   64}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 83   and name H   ))
 ASSI {   66}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 131  and name H   ))
      2.900     2.900     3.100 peak    66 spectrum    1 weight  0.10000E+01 volume  0.18790E-02 ppm1      0.934 ppm2      7.406 CV     1
 OR {   66}
   (  segid "    " and resid 33   and name HG1%)
   (( segid "    " and resid 39   and name HD2 ))
 OR {   66}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 76   and name HE3 ))
 ASSI {   68}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 85   and name HE22))
      2.500     0.800     0.800 peak    68 spectrum    1 weight  0.10000E+01 volume  0.66572E-02 ppm1      0.933 ppm2      7.227 CV     1
 OR {   68}
   (  segid "    " and resid 130  and name HD2%)
   (  segid "    " and resid 88   and name HE% )
 ASSI {   72}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 114  and name H   ))
      4.100     2.100     1.900 peak    72 spectrum    1 weight  0.10000E+01 volume  0.12394E-02 ppm1      0.894 ppm2      8.103 CV     1
 OR {   72}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 116  and name H   ))
 ASSI {   74}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 113  and name H   ))
      4.700     2.800     1.300 peak    74 spectrum    1 weight  0.10000E+01 volume  0.44124E-03 ppm1      0.895 ppm2      7.530 CV     1
 OR {   74}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 117  and name H   ))
 ASSI {   75}
   (  segid "    " and resid 98   and name HD1%)
   (  segid "    " and resid 131  and name HD% )
      4.000     2.000     2.000 peak    75 spectrum    1 weight  0.10000E+01 volume  0.13637E-02 ppm1      0.893 ppm2      7.117 CV     1
 OR {   75}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 76   and name HZ2 ))
 OR {   75}
   (  segid "    " and resid 98   and name HD1%)
   (  segid "    " and resid 91   and name HD% )
 OR {   75}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 88   and name HZ  ))
 ASSI {   78}
   (  segid "    " and resid 22   and name HD1%)
   (  segid "    " and resid 21   and name HD% )
      4.200     2.200     1.800 peak    78 spectrum    1 weight  0.10000E+01 volume  0.27206E-02 ppm1      0.947 ppm2      6.891 CV     1
 OR {   78}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 9    and name HZ2 ))
 ASSI {   79}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 83   and name H   ))
      3.300     1.300     1.300 peak    79 spectrum    1 weight  0.10000E+01 volume  0.17291E-02 ppm1      0.945 ppm2      8.103 CV     1
 OR {   79}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 85   and name H   ))
 ASSI {   81}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 39   and name H   ))
      2.500     2.500     3.500 peak    81 spectrum    1 weight  0.10000E+01 volume  0.85131E-03 ppm1      0.945 ppm2      7.551 CV     1
 OR {   81}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 38   and name H   ))
 OR {   81}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 123  and name H   ))
 ASSI {   82}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 39   and name H   ))
      3.400     1.400     1.400 peak    82 spectrum    1 weight  0.10000E+01 volume  0.84571E-03 ppm1      0.939 ppm2      7.502 CV     1
 OR {   82}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 41   and name HD21))
 OR {   82}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 80   and name HE21))
 ASSI {   85}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HA  ))
      2.300     0.700     0.700 peak    85 spectrum    1 weight  0.10000E+01 volume  0.11131E-01 ppm1      1.654 ppm2      4.331 CV     1
 OR {   85}
   (( segid "    " and resid 5    and name HG3 ))
   (( segid "    " and resid 5    and name HA  ))
 OR {   85}
   (( segid "    " and resid 130  and name HG  ))
   (( segid "    " and resid 130  and name HA  ))
 OR {   85}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 5    and name HA  ))
 OR {   85}
   (( segid "    " and resid 138  and name HG  ))
   (( segid "    " and resid 138  and name HA  ))
 OR {   85}
   (( segid "    " and resid 4    and name HG3 ))
   (( segid "    " and resid 4    and name HA  ))
 OR {   85}
   (( segid "    " and resid 134  and name HG3 ))
   (( segid "    " and resid 134  and name HA  ))
 ASSI {   86}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HA  ))
      2.300     0.700     0.700 peak    86 spectrum    1 weight  0.10000E+01 volume  0.10122E-01 ppm1      1.636 ppm2      4.315 CV     1
 OR {   86}
   (( segid "    " and resid 5    and name HG3 ))
   (( segid "    " and resid 5    and name HA  ))
 OR {   86}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 5    and name HA  ))
 OR {   86}
   (( segid "    " and resid 138  and name HG  ))
   (( segid "    " and resid 138  and name HA  ))
 OR {   86}
   (( segid "    " and resid 4    and name HG3 ))
   (( segid "    " and resid 4    and name HA  ))
 ASSI {   87}
   (  segid "    " and resid 75   and name HD1%)
   (( segid "    " and resid 75   and name HA  ))
      3.100     1.200     1.200 peak    87 spectrum    1 weight  0.10000E+01 volume  0.40920E-02 ppm1      0.937 ppm2      4.454 CV     1
 OR {   87}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 40   and name HA  ))
 ASSI {   93}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 98   and name HA  ))
      2.400     0.700     0.700 peak    93 spectrum    1 weight  0.10000E+01 volume  0.56302E-02 ppm1      0.892 ppm2      3.998 CV     1
 OR {   93}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 111  and name HA  ))
 ASSI {   94}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 130  and name HA  ))
      4.100     2.100     1.900 peak    94 spectrum    1 weight  0.10000E+01 volume  0.75959E-03 ppm1      0.892 ppm2      4.296 CV     1
 OR {   94}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 113  and name HA  ))
 OR {   94}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 116  and name HA  ))
 OR {   94}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 110  and name HB2 ))
 OR {   94}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 87   and name HA  ))
 ASSI {   95}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 82   and name HA  ))
      3.100     1.200     1.200 peak    95 spectrum    1 weight  0.10000E+01 volume  0.50080E-02 ppm1      0.979 ppm2      4.221 CV     1
 OR {   95}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 42   and name HB  ))
 ASSI {   98}
   (  segid "    " and resid 75   and name HD2%)
   (( segid "    " and resid 74   and name HA  ))
      2.100     2.100     3.900 peak    98 spectrum    1 weight  0.10000E+01 volume  0.18781E-02 ppm1      0.888 ppm2      4.099 CV     1
 OR {   98}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 119  and name HA  ))
 OR {   98}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 112  and name HA  ))
 ASSI {  100}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 101  and name HA  ))
      4.300     2.300     1.700 peak   100 spectrum    1 weight  0.10000E+01 volume  0.11270E-02 ppm1      0.895 ppm2      3.657 CV     1
 OR {  100}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 97   and name HA  ))
 ASSI {  102}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HA  ))
      2.600     0.900     0.900 peak   102 spectrum    1 weight  0.10000E+01 volume  0.30640E-02 ppm1      1.556 ppm2      3.950 CV     1
 OR {  102}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 34   and name HA  ))
 ASSI {  103}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HD2 ))
      1.900     0.500     0.500 peak   103 spectrum    1 weight  0.10000E+01 volume  0.22700E-01 ppm1      1.700 ppm2      3.227 CV     1
 OR {  103}
   (( segid "    " and resid 134  and name HG2 ))
   (( segid "    " and resid 134  and name HD3 ))
 OR {  103}
   (( segid "    " and resid 134  and name HG3 ))
   (( segid "    " and resid 134  and name HD2 ))
 OR {  103}
   (( segid "    " and resid 4    and name HG3 ))
   (( segid "    " and resid 4    and name HD3 ))
 OR {  103}
   (( segid "    " and resid 134  and name HG2 ))
   (( segid "    " and resid 134  and name HD2 ))
 OR {  103}
   (( segid "    " and resid 134  and name HG3 ))
   (( segid "    " and resid 134  and name HD3 ))
 OR {  103}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HD3 ))
 OR {  103}
   (( segid "    " and resid 4    and name HG3 ))
   (( segid "    " and resid 4    and name HD2 ))
 ASSI {  104}
   (( segid "    " and resid 5    and name HG3 ))
   (( segid "    " and resid 5    and name HD2 ))
      1.800     0.400     0.400 peak   104 spectrum    1 weight  0.10000E+01 volume  0.37324E-01 ppm1      1.657 ppm2      3.220 CV     1
 OR {  104}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HD2 ))
 OR {  104}
   (( segid "    " and resid 134  and name HG2 ))
   (( segid "    " and resid 134  and name HD3 ))
 OR {  104}
   (( segid "    " and resid 134  and name HG3 ))
   (( segid "    " and resid 134  and name HD2 ))
 OR {  104}
   (( segid "    " and resid 4    and name HG3 ))
   (( segid "    " and resid 4    and name HD3 ))
 OR {  104}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 5    and name HD3 ))
 OR {  104}
   (( segid "    " and resid 134  and name HG3 ))
   (( segid "    " and resid 134  and name HD3 ))
 OR {  104}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 5    and name HD2 ))
 OR {  104}
   (( segid "    " and resid 5    and name HG3 ))
   (( segid "    " and resid 5    and name HD3 ))
 OR {  104}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HD3 ))
 OR {  104}
   (( segid "    " and resid 4    and name HG3 ))
   (( segid "    " and resid 4    and name HD2 ))
 ASSI {  105}
   (( segid "    " and resid 5    and name HG3 ))
   (( segid "    " and resid 5    and name HD2 ))
      1.800     0.400     0.400 peak   105 spectrum    1 weight  0.10000E+01 volume  0.40752E-01 ppm1      1.638 ppm2      3.205 CV     1
 OR {  105}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HD2 ))
 OR {  105}
   (( segid "    " and resid 128  and name HG3 ))
   (( segid "    " and resid 128  and name HD3 ))
 OR {  105}
   (( segid "    " and resid 4    and name HG3 ))
   (( segid "    " and resid 4    and name HD3 ))
 OR {  105}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HD2 ))
 OR {  105}
   (( segid "    " and resid 128  and name HG3 ))
   (( segid "    " and resid 128  and name HD2 ))
 OR {  105}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 5    and name HD3 ))
 OR {  105}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 5    and name HD2 ))
 OR {  105}
   (( segid "    " and resid 5    and name HG3 ))
   (( segid "    " and resid 5    and name HD3 ))
 OR {  105}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HD3 ))
 ASSI {  106}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 115  and name HA  ))
      3.400     1.500     1.500 peak   106 spectrum    1 weight  0.10000E+01 volume  0.19632E-02 ppm1      0.893 ppm2      3.338 CV     1
 OR {  106}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 111  and name HD2 ))
 ASSI {  107}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 111  and name HD2 ))
      3.200     1.300     1.300 peak   107 spectrum    1 weight  0.10000E+01 volume  0.27839E-02 ppm1      0.892 ppm2      3.247 CV     1
 OR {  107}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 111  and name HD3 ))
 OR {  107}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 88   and name HB3 ))
 ASSI {  110}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 18   and name HD2 ))
      2.600     0.900     0.900 peak   110 spectrum    1 weight  0.10000E+01 volume  0.43686E-02 ppm1      0.947 ppm2      3.310 CV     1
 OR {  110}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 18   and name HD3 ))
 OR {  110}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 16   and name HB3 ))
 ASSI {  114}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 127  and name HD2 ))
      2.300     2.300     3.700 peak   114 spectrum    1 weight  0.10000E+01 volume  0.11102E-02 ppm1      0.889 ppm2      3.226 CV     1
 OR {  114}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 127  and name HD3 ))
 OR {  114}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 128  and name HD2 ))
 OR {  114}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 128  and name HD3 ))
 OR {  114}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 88   and name HB3 ))
 ASSI {  115}
   (( segid "    " and resid 130  and name HG  ))
   (( segid "    " and resid 129  and name HG3 ))
      2.600     0.900     0.900 peak   115 spectrum    1 weight  0.10000E+01 volume  0.38437E-02 ppm1      1.653 ppm2      2.393 CV     1
 OR {  115}
   (( segid "    " and resid 130  and name HG  ))
   (( segid "    " and resid 129  and name HG2 ))
 OR {  115}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 34   and name HG2 ))
 ASSI {  117}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 50   and name HB  ))
      2.600     0.900     0.900 peak   117 spectrum    1 weight  0.10000E+01 volume  0.64745E-02 ppm1      1.648 ppm2      2.211 CV     1
 OR {  117}
   (( segid "    " and resid 130  and name HG  ))
   (( segid "    " and resid 115  and name HB  ))
 OR {  117}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 126  and name HG3 ))
 OR {  117}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 126  and name HB2 ))
 OR {  117}
   (( segid "    " and resid 128  and name HG3 ))
   (( segid "    " and resid 126  and name HB2 ))
 OR {  117}
   (( segid "    " and resid 128  and name HG3 ))
   (( segid "    " and resid 126  and name HG3 ))
 OR {  117}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 34   and name HG3 ))
 OR {  117}
   (( segid "    " and resid 130  and name HG  ))
   (( segid "    " and resid 129  and name HB2 ))
 ASSI {  118}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 126  and name HG3 ))
      2.900     1.100     1.100 peak   118 spectrum    1 weight  0.10000E+01 volume  0.31950E-02 ppm1      1.591 ppm2      2.216 CV     1
 OR {  118}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 126  and name HB2 ))
 OR {  118}
   (( segid "    " and resid 128  and name HG3 ))
   (( segid "    " and resid 126  and name HB2 ))
 OR {  118}
   (( segid "    " and resid 128  and name HG3 ))
   (( segid "    " and resid 126  and name HG3 ))
 OR {  118}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 129  and name HB3 ))
 OR {  118}
   (( segid "    " and resid 128  and name HG3 ))
   (( segid "    " and resid 129  and name HB3 ))
 ASSI {  119}
   (( segid "    " and resid 4    and name HG3 ))
   (( segid "    " and resid 4    and name HB2 ))
      1.500     0.300     0.700 peak   119 spectrum    1 weight  0.10000E+01 volume  0.10309E+00 ppm1      1.639 ppm2      1.824 CV     1
 OR {  119}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HB3 ))
 OR {  119}
   (( segid "    " and resid 128  and name HG3 ))
   (( segid "    " and resid 128  and name HB2 ))
 OR {  119}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 5    and name HB3 ))
 OR {  119}
   (( segid "    " and resid 5    and name HG3 ))
   (( segid "    " and resid 5    and name HB3 ))
 OR {  119}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HB2 ))
 OR {  119}
   (( segid "    " and resid 128  and name HG3 ))
   (( segid "    " and resid 128  and name HB3 ))
 ASSI {  122}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 83   and name HG3 ))
      3.000     1.100     1.100 peak   122 spectrum    1 weight  0.10000E+01 volume  0.56624E-02 ppm1      0.942 ppm2      2.417 CV     1
 OR {  122}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 13   and name HG3 ))
 OR {  122}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 83   and name HB2 ))
 OR {  122}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 13   and name HG2 ))
 ASSI {  123}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 85   and name HB3 ))
      2.200     0.600     0.600 peak   123 spectrum    1 weight  0.10000E+01 volume  0.79572E-02 ppm1      0.939 ppm2      2.242 CV     1
 OR {  123}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 115  and name HB  ))
 OR {  123}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 85   and name HB2 ))
 ASSI {  125}
   (  segid "    " and resid 75   and name HD2%)
   (( segid "    " and resid 75   and name HG  ))
      2.000     0.500     0.500 peak   125 spectrum    1 weight  0.10000E+01 volume  0.31141E-01 ppm1      0.888 ppm2      1.589 CV     1
 OR {  125}
   (  segid "    " and resid 75   and name HD2%)
   (( segid "    " and resid 75   and name HB2 ))
 OR {  125}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 138  and name HB2 ))
 ASSI {  126}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 130  and name HG  ))
      1.900     0.400     0.400 peak   126 spectrum    1 weight  0.10000E+01 volume  0.25879E-01 ppm1      0.937 ppm2      1.675 CV     1
 OR {  126}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 138  and name HG  ))
 OR {  126}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 82   and name HB3 ))
 OR {  126}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 130  and name HB3 ))
 OR {  126}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 138  and name HB2 ))
 ASSI {  127}
   (  segid "    " and resid 130  and name HD2%)
   (( segid "    " and resid 130  and name HG  ))
      1.900     0.500     0.500 peak   127 spectrum    1 weight  0.10000E+01 volume  0.23902E-01 ppm1      0.889 ppm2      1.653 CV     1
 OR {  127}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 138  and name HG  ))
 OR {  127}
   (  segid "    " and resid 75   and name HD2%)
   (( segid "    " and resid 75   and name HG  ))
 OR {  127}
   (  segid "    " and resid 75   and name HD2%)
   (( segid "    " and resid 75   and name HB3 ))
 OR {  127}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 138  and name HB2 ))
 ASSI {  135}
   (  segid "    " and resid 75   and name HD1%)
   (( segid "    " and resid 75   and name HG  ))
      1.900     0.400     0.400 peak   135 spectrum    1 weight  0.10000E+01 volume  0.33096E-01 ppm1      0.929 ppm2      1.587 CV     1
 OR {  135}
   (  segid "    " and resid 138  and name HD2%)
   (( segid "    " and resid 138  and name HB3 ))
 OR {  135}
   (  segid "    " and resid 75   and name HD1%)
   (( segid "    " and resid 75   and name HB2 ))
 ASSI {  143}
   (( segid "    " and resid 37   and name HB2 ))
   (  segid "    " and resid 37   and name HD1%)
      2.100     0.500     0.500 peak   143 spectrum    1 weight  0.10000E+01 volume  0.11706E-01 ppm1      1.552 ppm2      0.834 CV     1
 OR {  143}
   (( segid "    " and resid 119  and name HB3 ))
   (  segid "    " and resid 119  and name HD2%)
 OR {  143}
   (( segid "    " and resid 37   and name HB2 ))
   (  segid "    " and resid 37   and name HD2%)
 ASSI {  144}
   (( segid "    " and resid 130  and name HG  ))
   (  segid "    " and resid 130  and name HD2%)
      1.900     0.500     0.500 peak   144 spectrum    1 weight  0.10000E+01 volume  0.18668E-01 ppm1      1.622 ppm2      0.927 CV     1
 OR {  144}
   (( segid "    " and resid 130  and name HG  ))
   (  segid "    " and resid 130  and name HD1%)
 OR {  144}
   (( segid "    " and resid 138  and name HG  ))
   (  segid "    " and resid 138  and name HD1%)
 OR {  144}
   (( segid "    " and resid 75   and name HG  ))
   (  segid "    " and resid 75   and name HD2%)
 OR {  144}
   (( segid "    " and resid 138  and name HG  ))
   (  segid "    " and resid 138  and name HD2%)
 OR {  144}
   (( segid "    " and resid 75   and name HG  ))
   (  segid "    " and resid 75   and name HD1%)
 ASSI {  146}
   (( segid "    " and resid 25   and name HE2 ))
   (  segid "    " and resid 21   and name HD% )
      2.800     2.800     3.200 peak   146 spectrum    1 weight  0.10000E+01 volume  0.11358E-02 ppm1      3.009 ppm2      6.866 CV     1
 OR {  146}
   (( segid "    " and resid 25   and name HE3 ))
   (  segid "    " and resid 21   and name HD% )
 OR {  146}
   (( segid "    " and resid 25   and name HE2 ))
   (  segid "    " and resid 21   and name HE% )
 OR {  146}
   (( segid "    " and resid 48   and name HE3 ))
   (( segid "    " and resid 56   and name HE22))
 OR {  146}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 56   and name HE22))
 ASSI {  147}
   (( segid "    " and resid 25   and name HE2 ))
   (  segid "    " and resid 21   and name HE% )
      3.000     3.000     3.000 peak   147 spectrum    1 weight  0.10000E+01 volume  0.11359E-02 ppm1      2.969 ppm2      6.848 CV     1
 OR {  147}
   (( segid "    " and resid 48   and name HE3 ))
   (( segid "    " and resid 56   and name HE22))
 OR {  147}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 56   and name HE22))
 ASSI {  148}
   (( segid "    " and resid 132  and name HE2 ))
   (( segid "    " and resid 132  and name H   ))
      2.600     2.600     3.400 peak   148 spectrum    1 weight  0.10000E+01 volume  0.55603E-03 ppm1      3.032 ppm2      7.855 CV     1
 OR {  148}
   (( segid "    " and resid 132  and name HE3 ))
   (( segid "    " and resid 132  and name H   ))
 OR {  148}
   (( segid "    " and resid 132  and name HE2 ))
   (( segid "    " and resid 96   and name H   ))
 OR {  148}
   (( segid "    " and resid 132  and name HE3 ))
   (( segid "    " and resid 96   and name H   ))
 OR {  148}
   (( segid "    " and resid 25   and name HE3 ))
   (( segid "    " and resid 23   and name H   ))
 ASSI {  149}
   (( segid "    " and resid 48   and name HE3 ))
   (( segid "    " and resid 52   and name HE1 ))
      3.300     1.400     1.400 peak   149 spectrum    1 weight  0.10000E+01 volume  0.81205E-03 ppm1      2.969 ppm2      7.826 CV     1
 OR {  149}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 52   and name HE1 ))
 OR {  149}
   (( segid "    " and resid 64   and name HE3 ))
   (( segid "    " and resid 67   and name H   ))
 OR {  149}
   (( segid "    " and resid 64   and name HE2 ))
   (( segid "    " and resid 67   and name H   ))
 ASSI {  158}
   (( segid "    " and resid 25   and name HE3 ))
   (  segid "    " and resid 22   and name HD2%)
      2.500     0.800     0.800 peak   158 spectrum    1 weight  0.10000E+01 volume  0.86443E-02 ppm1      3.011 ppm2      0.945 CV     1
 OR {  158}
   (( segid "    " and resid 136  and name HE3 ))
   (  segid "    " and resid 138  and name HD2%)
 OR {  158}
   (( segid "    " and resid 136  and name HE2 ))
   (  segid "    " and resid 138  and name HD2%)
 OR {  158}
   (( segid "    " and resid 64   and name HE2 ))
   (  segid "    " and resid 63   and name HG1%)
 OR {  158}
   (( segid "    " and resid 25   and name HE2 ))
   (  segid "    " and resid 22   and name HD2%)
 OR {  158}
   (( segid "    " and resid 64   and name HE3 ))
   (  segid "    " and resid 63   and name HG1%)
 ASSI {  160}
   (( segid "    " and resid 25   and name HE3 ))
   (( segid "    " and resid 25   and name HD3 ))
      1.800     0.400     0.400 peak   160 spectrum    1 weight  0.10000E+01 volume  0.24272E-01 ppm1      2.971 ppm2      1.354 CV     1
 OR {  160}
   (( segid "    " and resid 25   and name HE2 ))
   (( segid "    " and resid 25   and name HD3 ))
 OR {  160}
   (( segid "    " and resid 25   and name HE3 ))
   (( segid "    " and resid 25   and name HD2 ))
 OR {  160}
   (( segid "    " and resid 48   and name HE3 ))
   (( segid "    " and resid 48   and name HG2 ))
 OR {  160}
   (( segid "    " and resid 25   and name HE2 ))
   (( segid "    " and resid 25   and name HD2 ))
 ASSI {  161}
   (( segid "    " and resid 64   and name HE2 ))
   (( segid "    " and resid 64   and name HG2 ))
      1.900     0.500     0.500 peak   161 spectrum    1 weight  0.10000E+01 volume  0.39601E-01 ppm1      3.023 ppm2      1.479 CV     1
 OR {  161}
   (( segid "    " and resid 132  and name HE3 ))
   (( segid "    " and resid 132  and name HG2 ))
 OR {  161}
   (( segid "    " and resid 133  and name HE3 ))
   (( segid "    " and resid 133  and name HG3 ))
 OR {  161}
   (( segid "    " and resid 137  and name HE3 ))
   (( segid "    " and resid 137  and name HG2 ))
 OR {  161}
   (( segid "    " and resid 136  and name HE2 ))
   (( segid "    " and resid 136  and name HG3 ))
 OR {  161}
   (( segid "    " and resid 137  and name HE2 ))
   (( segid "    " and resid 137  and name HG2 ))
 OR {  161}
   (( segid "    " and resid 132  and name HE2 ))
   (( segid "    " and resid 132  and name HG2 ))
 OR {  161}
   (( segid "    " and resid 136  and name HE2 ))
   (( segid "    " and resid 136  and name HG2 ))
 OR {  161}
   (( segid "    " and resid 133  and name HE3 ))
   (( segid "    " and resid 133  and name HG2 ))
 OR {  161}
   (( segid "    " and resid 136  and name HE3 ))
   (( segid "    " and resid 136  and name HG3 ))
 OR {  161}
   (( segid "    " and resid 64   and name HE3 ))
   (( segid "    " and resid 64   and name HG2 ))
 OR {  161}
   (( segid "    " and resid 136  and name HE3 ))
   (( segid "    " and resid 136  and name HG2 ))
 OR {  161}
   (( segid "    " and resid 137  and name HE3 ))
   (( segid "    " and resid 137  and name HG3 ))
 OR {  161}
   (( segid "    " and resid 132  and name HE2 ))
   (( segid "    " and resid 132  and name HG3 ))
 OR {  161}
   (( segid "    " and resid 137  and name HE2 ))
   (( segid "    " and resid 137  and name HG3 ))
 OR {  161}
   (( segid "    " and resid 132  and name HE3 ))
   (( segid "    " and resid 132  and name HG3 ))
 ASSI {  162}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 48   and name HD3 ))
      1.600     0.300     0.600 peak   162 spectrum    1 weight  0.10000E+01 volume  0.83079E-01 ppm1      3.012 ppm2      1.703 CV     1
 OR {  162}
   (( segid "    " and resid 48   and name HE3 ))
   (( segid "    " and resid 48   and name HD2 ))
 OR {  162}
   (( segid "    " and resid 133  and name HE2 ))
   (( segid "    " and resid 133  and name HD2 ))
 OR {  162}
   (( segid "    " and resid 137  and name HE2 ))
   (( segid "    " and resid 137  and name HD2 ))
 OR {  162}
   (( segid "    " and resid 136  and name HE3 ))
   (( segid "    " and resid 136  and name HD3 ))
 OR {  162}
   (( segid "    " and resid 132  and name HE2 ))
   (( segid "    " and resid 132  and name HD3 ))
 OR {  162}
   (( segid "    " and resid 137  and name HE2 ))
   (( segid "    " and resid 137  and name HD3 ))
 OR {  162}
   (( segid "    " and resid 136  and name HE3 ))
   (( segid "    " and resid 136  and name HD2 ))
 OR {  162}
   (( segid "    " and resid 137  and name HE3 ))
   (( segid "    " and resid 137  and name HD2 ))
 OR {  162}
   (( segid "    " and resid 132  and name HE3 ))
   (( segid "    " and resid 132  and name HD2 ))
 OR {  162}
   (( segid "    " and resid 136  and name HE2 ))
   (( segid "    " and resid 136  and name HD3 ))
 OR {  162}
   (( segid "    " and resid 132  and name HE2 ))
   (( segid "    " and resid 132  and name HD2 ))
 OR {  162}
   (( segid "    " and resid 132  and name HE3 ))
   (( segid "    " and resid 132  and name HD3 ))
 OR {  162}
   (( segid "    " and resid 133  and name HE2 ))
   (( segid "    " and resid 133  and name HD3 ))
 OR {  162}
   (( segid "    " and resid 133  and name HE3 ))
   (( segid "    " and resid 133  and name HD2 ))
 OR {  162}
   (( segid "    " and resid 133  and name HE3 ))
   (( segid "    " and resid 133  and name HD3 ))
 OR {  162}
   (( segid "    " and resid 136  and name HE2 ))
   (( segid "    " and resid 136  and name HD2 ))
 OR {  162}
   (( segid "    " and resid 137  and name HE3 ))
   (( segid "    " and resid 137  and name HD3 ))
 OR {  162}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 48   and name HD2 ))
 OR {  162}
   (( segid "    " and resid 48   and name HE3 ))
   (( segid "    " and resid 48   and name HD3 ))
 ASSI {  163}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 48   and name HD3 ))
      1.700     0.400     0.500 peak   163 spectrum    1 weight  0.10000E+01 volume  0.51692E-01 ppm1      2.978 ppm2      1.674 CV     1
 OR {  163}
   (( segid "    " and resid 48   and name HE3 ))
   (( segid "    " and resid 48   and name HD2 ))
 OR {  163}
   (( segid "    " and resid 64   and name HE3 ))
   (( segid "    " and resid 64   and name HD2 ))
 OR {  163}
   (( segid "    " and resid 137  and name HE2 ))
   (( segid "    " and resid 137  and name HD2 ))
 OR {  163}
   (( segid "    " and resid 136  and name HE3 ))
   (( segid "    " and resid 136  and name HD3 ))
 OR {  163}
   (( segid "    " and resid 137  and name HE2 ))
   (( segid "    " and resid 137  and name HD3 ))
 OR {  163}
   (( segid "    " and resid 136  and name HE3 ))
   (( segid "    " and resid 136  and name HD2 ))
 OR {  163}
   (( segid "    " and resid 137  and name HE3 ))
   (( segid "    " and resid 137  and name HD2 ))
 OR {  163}
   (( segid "    " and resid 136  and name HE2 ))
   (( segid "    " and resid 136  and name HD3 ))
 OR {  163}
   (( segid "    " and resid 136  and name HE2 ))
   (( segid "    " and resid 136  and name HD2 ))
 OR {  163}
   (( segid "    " and resid 137  and name HE3 ))
   (( segid "    " and resid 137  and name HD3 ))
 OR {  163}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 48   and name HD2 ))
 OR {  163}
   (( segid "    " and resid 48   and name HE3 ))
   (( segid "    " and resid 48   and name HD3 ))
 ASSI {  164}
   (( segid "    " and resid 133  and name HE2 ))
   (( segid "    " and resid 133  and name HB2 ))
      2.600     0.800     0.800 peak   164 spectrum    1 weight  0.10000E+01 volume  0.10544E-01 ppm1      3.035 ppm2      1.855 CV     1
 OR {  164}
   (( segid "    " and resid 132  and name HE3 ))
   (( segid "    " and resid 132  and name HB2 ))
 OR {  164}
   (( segid "    " and resid 133  and name HE3 ))
   (( segid "    " and resid 133  and name HB2 ))
 OR {  164}
   (( segid "    " and resid 132  and name HE2 ))
   (( segid "    " and resid 132  and name HB3 ))
 OR {  164}
   (( segid "    " and resid 133  and name HE3 ))
   (( segid "    " and resid 133  and name HB3 ))
 OR {  164}
   (( segid "    " and resid 133  and name HE2 ))
   (( segid "    " and resid 133  and name HB3 ))
 OR {  164}
   (( segid "    " and resid 132  and name HE3 ))
   (( segid "    " and resid 132  and name HB3 ))
 ASSI {  165}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 48   and name HB3 ))
      2.700     0.900     0.900 peak   165 spectrum    1 weight  0.10000E+01 volume  0.58515E-02 ppm1      2.977 ppm2      1.851 CV     1
 OR {  165}
   (( segid "    " and resid 48   and name HE3 ))
   (( segid "    " and resid 48   and name HB3 ))
 OR {  165}
   (( segid "    " and resid 133  and name HE2 ))
   (( segid "    " and resid 133  and name HB2 ))
 OR {  165}
   (( segid "    " and resid 132  and name HE3 ))
   (( segid "    " and resid 132  and name HB2 ))
 OR {  165}
   (( segid "    " and resid 132  and name HE2 ))
   (( segid "    " and resid 132  and name HB2 ))
 OR {  165}
   (( segid "    " and resid 133  and name HE3 ))
   (( segid "    " and resid 133  and name HB2 ))
 OR {  165}
   (( segid "    " and resid 132  and name HE2 ))
   (( segid "    " and resid 132  and name HB3 ))
 OR {  165}
   (( segid "    " and resid 133  and name HE3 ))
   (( segid "    " and resid 133  and name HB3 ))
 OR {  165}
   (( segid "    " and resid 133  and name HE2 ))
   (( segid "    " and resid 133  and name HB3 ))
 OR {  165}
   (( segid "    " and resid 132  and name HE3 ))
   (( segid "    " and resid 132  and name HB3 ))
 ASSI {  166}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 133  and name HE2 ))
      1.600     0.300     0.600 peak   166 spectrum    1 weight  0.10000E+01 volume  0.67500E-01 ppm1      1.698 ppm2      3.007 CV     1
 OR {  166}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HE2 ))
 OR {  166}
   (( segid "    " and resid 136  and name HD3 ))
   (( segid "    " and resid 136  and name HE3 ))
 OR {  166}
   (( segid "    " and resid 132  and name HD3 ))
   (( segid "    " and resid 132  and name HE2 ))
 OR {  166}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 137  and name HE2 ))
 OR {  166}
   (( segid "    " and resid 136  and name HD2 ))
   (( segid "    " and resid 136  and name HE3 ))
 OR {  166}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HE3 ))
 OR {  166}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 132  and name HE3 ))
 OR {  166}
   (( segid "    " and resid 136  and name HD3 ))
   (( segid "    " and resid 136  and name HE2 ))
 OR {  166}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 132  and name HE2 ))
 OR {  166}
   (( segid "    " and resid 132  and name HD3 ))
   (( segid "    " and resid 132  and name HE3 ))
 OR {  166}
   (( segid "    " and resid 133  and name HD3 ))
   (( segid "    " and resid 133  and name HE2 ))
 OR {  166}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 133  and name HE3 ))
 OR {  166}
   (( segid "    " and resid 133  and name HD3 ))
   (( segid "    " and resid 133  and name HE3 ))
 OR {  166}
   (( segid "    " and resid 136  and name HD2 ))
   (( segid "    " and resid 136  and name HE2 ))
 OR {  166}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 137  and name HE3 ))
 ASSI {  167}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 133  and name HE2 ))
      1.800     0.400     0.400 peak   167 spectrum    1 weight  0.10000E+01 volume  0.39577E-01 ppm1      1.734 ppm2      3.043 CV     1
 OR {  167}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HE2 ))
 OR {  167}
   (( segid "    " and resid 132  and name HD3 ))
   (( segid "    " and resid 132  and name HE2 ))
 OR {  167}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 137  and name HE2 ))
 OR {  167}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HE3 ))
 OR {  167}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 132  and name HE3 ))
 OR {  167}
   (( segid "    " and resid 136  and name HD3 ))
   (( segid "    " and resid 136  and name HE2 ))
 OR {  167}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 132  and name HE2 ))
 OR {  167}
   (( segid "    " and resid 132  and name HD3 ))
   (( segid "    " and resid 132  and name HE3 ))
 OR {  167}
   (( segid "    " and resid 133  and name HD3 ))
   (( segid "    " and resid 133  and name HE2 ))
 OR {  167}
   (( segid "    " and resid 133  and name HD3 ))
   (( segid "    " and resid 133  and name HE3 ))
 OR {  167}
   (( segid "    " and resid 136  and name HD2 ))
   (( segid "    " and resid 136  and name HE2 ))
 OR {  167}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 137  and name HE3 ))
 ASSI {  169}
   (( segid "    " and resid 137  and name HD2 ))
   (( segid "    " and resid 137  and name HA  ))
      3.000     1.200     1.200 peak   169 spectrum    1 weight  0.10000E+01 volume  0.34976E-02 ppm1      1.701 ppm2      4.303 CV     1
 OR {  169}
   (( segid "    " and resid 64   and name HD3 ))
   (( segid "    " and resid 68   and name HA  ))
 OR {  169}
   (( segid "    " and resid 137  and name HD3 ))
   (( segid "    " and resid 137  and name HA  ))
 OR {  169}
   (( segid "    " and resid 136  and name HD3 ))
   (( segid "    " and resid 136  and name HA  ))
 OR {  169}
   (( segid "    " and resid 136  and name HD2 ))
   (( segid "    " and resid 136  and name HA  ))
 ASSI {  170}
   (( segid "    " and resid 132  and name HD3 ))
   (( segid "    " and resid 132  and name HA  ))
      3.000     1.100     1.100 peak   170 spectrum    1 weight  0.10000E+01 volume  0.44723E-02 ppm1      1.735 ppm2      4.374 CV     1
 OR {  170}
   (( segid "    " and resid 133  and name HD3 ))
   (( segid "    " and resid 133  and name HA  ))
 OR {  170}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 132  and name HA  ))
 OR {  170}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 133  and name HA  ))
 ASSI {  171}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HA  ))
      2.900     1.000     1.000 peak   171 spectrum    1 weight  0.10000E+01 volume  0.42171E-02 ppm1      1.418 ppm2      4.305 CV     1
 OR {  171}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 137  and name HA  ))
 OR {  171}
   (( segid "    " and resid 136  and name HG3 ))
   (( segid "    " and resid 136  and name HA  ))
 OR {  171}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 136  and name HA  ))
 ASSI {  172}
   (( segid "    " and resid 103  and name HG3 ))
   (( segid "    " and resid 103  and name HA  ))
      2.400     0.700     0.700 peak   172 spectrum    1 weight  0.10000E+01 volume  0.73749E-02 ppm1      1.458 ppm2      4.125 CV     1
 OR {  172}
   (( segid "    " and resid 103  and name HG2 ))
   (( segid "    " and resid 103  and name HA  ))
 OR {  172}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI {  174}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 62   and name HB2 ))
      3.200     1.300     1.300 peak   174 spectrum    1 weight  0.10000E+01 volume  0.22921E-02 ppm1      1.432 ppm2      3.960 CV     1
 OR {  174}
   (( segid "    " and resid 64   and name HG3 ))
   (( segid "    " and resid 62   and name HB2 ))
 OR {  174}
   (( segid "    " and resid 103  and name HG3 ))
   (( segid "    " and resid 100  and name HA  ))
 OR {  174}
   (( segid "    " and resid 103  and name HG2 ))
   (( segid "    " and resid 100  and name HA  ))
 ASSI {  175}
   (( segid "    " and resid 103  and name HG3 ))
   (( segid "    " and resid 100  and name HA  ))
      3.400     1.500     1.500 peak   175 spectrum    1 weight  0.10000E+01 volume  0.22071E-02 ppm1      1.461 ppm2      3.945 CV     1
 OR {  175}
   (( segid "    " and resid 103  and name HG2 ))
   (( segid "    " and resid 100  and name HA  ))
 OR {  175}
   (( segid "    " and resid 64   and name HG3 ))
   (( segid "    " and resid 63   and name HA  ))
 OR {  175}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI {  176}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 133  and name HA  ))
      2.500     0.800     0.800 peak   176 spectrum    1 weight  0.10000E+01 volume  0.68586E-02 ppm1      1.465 ppm2      4.373 CV     1
 OR {  176}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 133  and name HA  ))
 OR {  176}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 132  and name HA  ))
 OR {  176}
   (( segid "    " and resid 132  and name HG2 ))
   (( segid "    " and resid 132  and name HA  ))
 OR {  176}
   (( segid "    " and resid 64   and name HG3 ))
   (( segid "    " and resid 68   and name HA  ))
 OR {  176}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 68   and name HA  ))
 ASSI {  179}
   (( segid "    " and resid 64   and name HG3 ))
   (( segid "    " and resid 64   and name HE3 ))
      2.100     0.500     0.500 peak   179 spectrum    1 weight  0.10000E+01 volume  0.23544E-01 ppm1      1.461 ppm2      3.020 CV     1
 OR {  179}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 64   and name HE2 ))
 OR {  179}
   (( segid "    " and resid 132  and name HG2 ))
   (( segid "    " and resid 132  and name HE3 ))
 OR {  179}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 133  and name HE3 ))
 OR {  179}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HE3 ))
 OR {  179}
   (( segid "    " and resid 136  and name HG3 ))
   (( segid "    " and resid 136  and name HE2 ))
 OR {  179}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HE2 ))
 OR {  179}
   (( segid "    " and resid 64   and name HG3 ))
   (( segid "    " and resid 64   and name HE2 ))
 OR {  179}
   (( segid "    " and resid 132  and name HG2 ))
   (( segid "    " and resid 132  and name HE2 ))
 OR {  179}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 136  and name HE2 ))
 OR {  179}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 133  and name HE3 ))
 OR {  179}
   (( segid "    " and resid 136  and name HG3 ))
   (( segid "    " and resid 136  and name HE3 ))
 OR {  179}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 64   and name HE3 ))
 OR {  179}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 136  and name HE3 ))
 OR {  179}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 137  and name HE3 ))
 OR {  179}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 137  and name HE2 ))
 ASSI {  180}
   (( segid "    " and resid 103  and name HG2 ))
   (( segid "    " and resid 103  and name HB2 ))
      1.700     0.400     0.500 peak   180 spectrum    1 weight  0.10000E+01 volume  0.54345E-01 ppm1      1.462 ppm2      1.813 CV     1
 OR {  180}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 133  and name HB3 ))
 OR {  180}
   (( segid "    " and resid 69   and name HG3 ))
   (( segid "    " and resid 69   and name HB2 ))
 OR {  180}
   (( segid "    " and resid 69   and name HG2 ))
   (( segid "    " and resid 69   and name HB3 ))
 OR {  180}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 132  and name HB3 ))
 OR {  180}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HB2 ))
 OR {  180}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 137  and name HB3 ))
 OR {  180}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 133  and name HB2 ))
 OR {  180}
   (( segid "    " and resid 136  and name HG3 ))
   (( segid "    " and resid 136  and name HB3 ))
 OR {  180}
   (( segid "    " and resid 132  and name HG2 ))
   (( segid "    " and resid 132  and name HB2 ))
 OR {  180}
   (( segid "    " and resid 103  and name HG3 ))
   (( segid "    " and resid 103  and name HB3 ))
 OR {  180}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 132  and name HB2 ))
 OR {  180}
   (( segid "    " and resid 132  and name HG2 ))
   (( segid "    " and resid 132  and name HB3 ))
 OR {  180}
   (( segid "    " and resid 103  and name HG2 ))
   (( segid "    " and resid 103  and name HB3 ))
 OR {  180}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HB3 ))
 OR {  180}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 137  and name HB2 ))
 OR {  180}
   (( segid "    " and resid 136  and name HG3 ))
   (( segid "    " and resid 136  and name HB2 ))
 OR {  180}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 133  and name HB2 ))
 OR {  180}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 133  and name HB3 ))
 OR {  180}
   (( segid "    " and resid 69   and name HG2 ))
   (( segid "    " and resid 69   and name HB2 ))
 OR {  180}
   (( segid "    " and resid 69   and name HG3 ))
   (( segid "    " and resid 69   and name HB3 ))
 ASSI {  181}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 137  and name HD3 ))
      1.600     0.300     0.600 peak   181 spectrum    1 weight  0.10000E+01 volume  0.88529E-01 ppm1      1.460 ppm2      1.714 CV     1
 OR {  181}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 132  and name HD2 ))
 OR {  181}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 136  and name HD2 ))
 OR {  181}
   (( segid "    " and resid 64   and name HG3 ))
   (( segid "    " and resid 64   and name HD2 ))
 OR {  181}
   (( segid "    " and resid 136  and name HG3 ))
   (( segid "    " and resid 136  and name HD3 ))
 OR {  181}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 133  and name HD2 ))
 OR {  181}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 133  and name HD3 ))
 OR {  181}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HD2 ))
 OR {  181}
   (( segid "    " and resid 64   and name HG3 ))
   (( segid "    " and resid 64   and name HB3 ))
 OR {  181}
   (( segid "    " and resid 132  and name HG2 ))
   (( segid "    " and resid 132  and name HD3 ))
 OR {  181}
   (( segid "    " and resid 132  and name HG2 ))
   (( segid "    " and resid 132  and name HD2 ))
 OR {  181}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 132  and name HD3 ))
 OR {  181}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 133  and name HD3 ))
 OR {  181}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 133  and name HD2 ))
 OR {  181}
   (( segid "    " and resid 137  and name HG2 ))
   (( segid "    " and resid 137  and name HD3 ))
 OR {  181}
   (( segid "    " and resid 137  and name HG3 ))
   (( segid "    " and resid 137  and name HD2 ))
 OR {  181}
   (( segid "    " and resid 136  and name HG3 ))
   (( segid "    " and resid 136  and name HD2 ))
 OR {  181}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 136  and name HD3 ))
 ASSI {  182}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 103  and name HG2 ))
      1.800     0.400     0.400 peak   182 spectrum    1 weight  0.10000E+01 volume  0.40541E-01 ppm1      1.816 ppm2      1.461 CV     1
 OR {  182}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 133  and name HG3 ))
 OR {  182}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 69   and name HG3 ))
 OR {  182}
   (( segid "    " and resid 69   and name HB3 ))
   (( segid "    " and resid 69   and name HG2 ))
 OR {  182}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 132  and name HG3 ))
 OR {  182}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HG2 ))
 OR {  182}
   (( segid "    " and resid 137  and name HB3 ))
   (( segid "    " and resid 137  and name HG3 ))
 OR {  182}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 133  and name HG2 ))
 OR {  182}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 132  and name HG2 ))
 OR {  182}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 103  and name HG3 ))
 OR {  182}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 132  and name HG3 ))
 OR {  182}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 132  and name HG2 ))
 OR {  182}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 103  and name HG2 ))
 OR {  182}
   (( segid "    " and resid 137  and name HB3 ))
   (( segid "    " and resid 137  and name HG2 ))
 OR {  182}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HG3 ))
 OR {  182}
   (( segid "    " and resid 136  and name HB2 ))
   (( segid "    " and resid 136  and name HG3 ))
 OR {  182}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 133  and name HG3 ))
 OR {  182}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 133  and name HG2 ))
 OR {  182}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 69   and name HG2 ))
 OR {  182}
   (( segid "    " and resid 69   and name HB3 ))
   (( segid "    " and resid 69   and name HG3 ))
 ASSI {  183}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 103  and name HG2 ))
      1.900     0.500     0.500 peak   183 spectrum    1 weight  0.10000E+01 volume  0.25399E-01 ppm1      1.775 ppm2      1.450 CV     1
 OR {  183}
   (( segid "    " and resid 136  and name HB2 ))
   (( segid "    " and resid 136  and name HG2 ))
 OR {  183}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HG2 ))
 OR {  183}
   (( segid "    " and resid 137  and name HB3 ))
   (( segid "    " and resid 137  and name HG3 ))
 OR {  183}
   (( segid "    " and resid 136  and name HB3 ))
   (( segid "    " and resid 136  and name HG3 ))
 OR {  183}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 103  and name HG3 ))
 OR {  183}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 103  and name HG2 ))
 OR {  183}
   (( segid "    " and resid 137  and name HB3 ))
   (( segid "    " and resid 137  and name HG2 ))
 OR {  183}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HG3 ))
 OR {  183}
   (( segid "    " and resid 136  and name HB2 ))
   (( segid "    " and resid 136  and name HG3 ))
 OR {  183}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 133  and name HG3 ))
 ASSI {  185}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 133  and name HE2 ))
      3.200     1.300     1.300 peak   185 spectrum    1 weight  0.10000E+01 volume  0.42858E-02 ppm1      1.816 ppm2      3.027 CV     1
 OR {  185}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 132  and name HE3 ))
 OR {  185}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 132  and name HE2 ))
 OR {  185}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 133  and name HE3 ))
 OR {  185}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 132  and name HE2 ))
 OR {  185}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 133  and name HE3 ))
 OR {  185}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 133  and name HE2 ))
 OR {  185}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HE3 ))
 OR {  185}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 132  and name HE3 ))
 OR {  185}
   (( segid "    " and resid 137  and name HB3 ))
   (( segid "    " and resid 137  and name HE3 ))
 OR {  185}
   (( segid "    " and resid 137  and name HB3 ))
   (( segid "    " and resid 137  and name HE2 ))
 OR {  185}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HE2 ))
 OR {  185}
   (( segid "    " and resid 136  and name HB3 ))
   (( segid "    " and resid 136  and name HE2 ))
 OR {  185}
   (( segid "    " and resid 136  and name HB3 ))
   (( segid "    " and resid 136  and name HE3 ))
 ASSI {  186}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 131  and name HB3 ))
      3.300     1.300     1.300 peak   186 spectrum    1 weight  0.10000E+01 volume  0.16385E-02 ppm1      1.817 ppm2      3.233 CV     1
 OR {  186}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 131  and name HB3 ))
 OR {  186}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 134  and name HD3 ))
 OR {  186}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 134  and name HD2 ))
 OR {  186}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 134  and name HD3 ))
 OR {  186}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 131  and name HB3 ))
 OR {  186}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 131  and name HB3 ))
 ASSI {  188}
   (( segid "    " and resid 136  and name HB2 ))
   (( segid "    " and resid 136  and name HA  ))
      2.200     0.600     0.600 peak   188 spectrum    1 weight  0.10000E+01 volume  0.14055E-01 ppm1      1.820 ppm2      4.312 CV     1
 OR {  188}
   (( segid "    " and resid 136  and name HB3 ))
   (( segid "    " and resid 136  and name HA  ))
 OR {  188}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HA  ))
 OR {  188}
   (( segid "    " and resid 137  and name HB3 ))
   (( segid "    " and resid 137  and name HA  ))
 ASSI {  193}
   (( segid "    " and resid 103  and name HB3 ))
   (( segid "    " and resid 100  and name H   ))
      2.100     2.100     3.900 peak   193 spectrum    1 weight  0.10000E+01 volume  0.18245E-02 ppm1      1.812 ppm2      7.757 CV     1
 OR {  193}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 67   and name H   ))
 OR {  193}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 100  and name H   ))
 OR {  193}
   (( segid "    " and resid 69   and name HB3 ))
   (( segid "    " and resid 67   and name H   ))
 OR {  193}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 130  and name H   ))
 OR {  193}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 130  and name H   ))
 OR {  193}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 129  and name H   ))
 OR {  193}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 130  and name H   ))
 OR {  193}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 100  and name H   ))
 ASSI {  194}
   (( segid "    " and resid 136  and name HB2 ))
   (( segid "    " and resid 137  and name H   ))
      3.000     1.100     1.100 peak   194 spectrum    1 weight  0.10000E+01 volume  0.18883E-02 ppm1      1.763 ppm2      8.429 CV     1
 OR {  194}
   (( segid "    " and resid 136  and name HB3 ))
   (( segid "    " and resid 136  and name H   ))
 OR {  194}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name H   ))
 OR {  194}
   (( segid "    " and resid 136  and name HB2 ))
   (( segid "    " and resid 136  and name H   ))
 OR {  194}
   (( segid "    " and resid 136  and name HB3 ))
   (( segid "    " and resid 137  and name H   ))
 ASSI {  195}
   (( segid "    " and resid 136  and name HB3 ))
   (( segid "    " and resid 136  and name H   ))
      2.700     0.900     0.900 peak   195 spectrum    1 weight  0.10000E+01 volume  0.44150E-02 ppm1      1.815 ppm2      8.480 CV     1
 OR {  195}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 133  and name H   ))
 OR {  195}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 133  and name H   ))
 OR {  195}
   (( segid "    " and resid 136  and name HB2 ))
   (( segid "    " and resid 136  and name H   ))
 ASSI {  197}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name H   ))
      3.300     1.300     1.300 peak   197 spectrum    1 weight  0.10000E+01 volume  0.13727E-02 ppm1      4.309 ppm2      8.258 CV     1
 OR {  197}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 3    and name H   ))
 ASSI {  198}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 69   and name H   ))
      2.500     0.800     0.800 peak   198 spectrum    1 weight  0.10000E+01 volume  0.38856E-02 ppm1      4.313 ppm2      8.145 CV     1
 OR {  198}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 5    and name H   ))
 ASSI {  199}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HD2 ))
      2.700     0.900     0.900 peak   199 spectrum    1 weight  0.10000E+01 volume  0.58717E-02 ppm1      4.314 ppm2      3.204 CV     1
 OR {  199}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HD3 ))
 OR {  199}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HD3 ))
 OR {  199}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HD2 ))
 ASSI {  200}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 64   and name HE3 ))
      4.200     2.200     1.800 peak   200 spectrum    1 weight  0.10000E+01 volume  0.86896E-03 ppm1      4.302 ppm2      3.015 CV     1
 OR {  200}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 64   and name HE2 ))
 OR {  200}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HE3 ))
 OR {  200}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HE2 ))
 OR {  200}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HE2 ))
 OR {  200}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HE3 ))
 ASSI {  201}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HB2 ))
      1.700     0.400     0.500 peak   201 spectrum    1 weight  0.10000E+01 volume  0.51382E-01 ppm1      4.306 ppm2      1.807 CV     1
 OR {  201}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HB3 ))
 OR {  201}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HB2 ))
 OR {  201}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HB3 ))
 OR {  201}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HB2 ))
 OR {  201}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HB2 ))
 ASSI {  202}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HG2 ))
      2.200     0.600     0.600 peak   202 spectrum    1 weight  0.10000E+01 volume  0.23666E-01 ppm1      4.312 ppm2      1.650 CV     1
 OR {  202}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HG3 ))
 OR {  202}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HD3 ))
 OR {  202}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HD3 ))
 OR {  202}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HD2 ))
 OR {  202}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 138  and name HB3 ))
 ASSI {  203}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HG2 ))
      2.400     0.700     0.700 peak   203 spectrum    1 weight  0.10000E+01 volume  0.13340E-01 ppm1      4.299 ppm2      1.439 CV     1
 OR {  203}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HG3 ))
 OR {  203}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HG3 ))
 OR {  203}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HG2 ))
 OR {  203}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 64   and name HG2 ))
 ASSI {  205}
   (( segid "    " and resid 18   and name HB3 ))
   (( segid "    " and resid 18   and name H   ))
      2.700     0.900     0.900 peak   205 spectrum    1 weight  0.10000E+01 volume  0.24555E-02 ppm1      2.084 ppm2      8.292 CV     1
 OR {  205}
   (( segid "    " and resid 14   and name HB3 ))
   (( segid "    " and resid 15   and name H   ))
 ASSI {  209}
   (( segid "    " and resid 67   and name HG3 ))
   (( segid "    " and resid 67   and name HE21))
      2.500     0.800     0.800 peak   209 spectrum    1 weight  0.10000E+01 volume  0.36074E-02 ppm1      2.391 ppm2      7.594 CV     1
 OR {  209}
   (( segid "    " and resid 67   and name HG2 ))
   (( segid "    " and resid 67   and name HE21))
 OR {  209}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 135  and name HE21))
 OR {  209}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 135  and name HE21))
 ASSI {  210}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 135  and name H   ))
      2.000     0.500     0.500 peak   210 spectrum    1 weight  0.10000E+01 volume  0.15330E-01 ppm1      4.367 ppm2      8.511 CV     1
 OR {  210}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 134  and name H   ))
 OR {  210}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name H   ))
 ASSI {  211}
   (( segid "    " and resid 67   and name HG3 ))
   (( segid "    " and resid 67   and name HE22))
      3.700     1.700     1.700 peak   211 spectrum    1 weight  0.10000E+01 volume  0.18912E-02 ppm1      2.395 ppm2      6.939 CV     1
 OR {  211}
   (( segid "    " and resid 67   and name HG2 ))
   (( segid "    " and resid 67   and name HE22))
 OR {  211}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 135  and name HE22))
 ASSI {  214}
   (( segid "    " and resid 67   and name HG3 ))
   (( segid "    " and resid 67   and name HA  ))
      2.700     0.900     0.900 peak   214 spectrum    1 weight  0.10000E+01 volume  0.56407E-02 ppm1      2.390 ppm2      4.350 CV     1
 OR {  214}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 135  and name HA  ))
 OR {  214}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 135  and name HA  ))
 OR {  214}
   (( segid "    " and resid 67   and name HG2 ))
   (( segid "    " and resid 67   and name HA  ))
 OR {  214}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 134  and name HA  ))
 ASSI {  215}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HD2 ))
      2.700     0.900     0.900 peak   215 spectrum    1 weight  0.10000E+01 volume  0.62495E-02 ppm1      4.354 ppm2      3.230 CV     1
 OR {  215}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HD3 ))
 OR {  215}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HD3 ))
 OR {  215}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HD2 ))
 OR {  215}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HD3 ))
 OR {  215}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HD2 ))
 ASSI {  218}
   (( segid "    " and resid 14   and name HB3 ))
   (( segid "    " and resid 14   and name HB2 ))
      1.700     0.300     0.500 peak   218 spectrum    1 weight  0.10000E+01 volume  0.22045E-01 ppm1      2.094 ppm2      2.394 CV     1
 OR {  218}
   (( segid "    " and resid 135  and name HB3 ))
   (( segid "    " and resid 135  and name HG2 ))
 OR {  218}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 67   and name HG3 ))
 OR {  218}
   (( segid "    " and resid 135  and name HB3 ))
   (( segid "    " and resid 135  and name HG3 ))
 ASSI {  222}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 135  and name HB3 ))
      1.900     0.400     0.400 peak   222 spectrum    1 weight  0.10000E+01 volume  0.25212E-01 ppm1      2.391 ppm2      2.100 CV     1
 OR {  222}
   (( segid "    " and resid 67   and name HG3 ))
   (( segid "    " and resid 67   and name HB2 ))
 OR {  222}
   (( segid "    " and resid 135  and name HG3 ))
   (( segid "    " and resid 135  and name HB3 ))
 ASSI {  224}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HB3 ))
      1.800     0.400     0.400 peak   224 spectrum    1 weight  0.10000E+01 volume  0.46337E-01 ppm1      4.364 ppm2      1.850 CV     1
 OR {  224}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HB3 ))
 OR {  224}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 133  and name HB2 ))
 OR {  224}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HB2 ))
 OR {  224}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 133  and name HB3 ))
 OR {  224}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HB2 ))
 ASSI {  225}
   (( segid "    " and resid 135  and name HB3 ))
   (( segid "    " and resid 136  and name HG3 ))
      3.400     1.500     1.500 peak   225 spectrum    1 weight  0.10000E+01 volume  0.20738E-02 ppm1      2.096 ppm2      1.480 CV     1
 OR {  225}
   (( segid "    " and resid 135  and name HB3 ))
   (( segid "    " and resid 136  and name HG2 ))
 OR {  225}
   (( segid "    " and resid 14   and name HB3 ))
   (( segid "    " and resid 17   and name HG  ))
 ASSI {  226}
   (( segid "    " and resid 18   and name HB3 ))
   (  segid "    " and resid 59   and name HD2%)
      3.500     1.500     1.500 peak   226 spectrum    1 weight  0.10000E+01 volume  0.27717E-02 ppm1      2.096 ppm2      0.949 CV     1
 OR {  226}
   (( segid "    " and resid 18   and name HB3 ))
   (  segid "    " and resid 22   and name HD2%)
 OR {  226}
   (( segid "    " and resid 18   and name HB3 ))
   (  segid "    " and resid 22   and name HD1%)
 ASSI {  228}
   (( segid "    " and resid 67   and name HG2 ))
   (  segid "    " and resid 63   and name HG2%)
      3.400     1.500     1.500 peak   228 spectrum    1 weight  0.10000E+01 volume  0.18776E-02 ppm1      2.402 ppm2      0.947 CV     1
 OR {  228}
   (( segid "    " and resid 67   and name HG3 ))
   (  segid "    " and resid 63   and name HG2%)
 OR {  228}
   (( segid "    " and resid 67   and name HG3 ))
   (  segid "    " and resid 33   and name HG1%)
 ASSI {  229}
   (( segid "    " and resid 111  and name HB3 ))
   (( segid "    " and resid 112  and name H   ))
      3.000     1.100     1.100 peak   229 spectrum    1 weight  0.10000E+01 volume  0.32096E-02 ppm1      1.880 ppm2      8.522 CV     1
 OR {  229}
   (( segid "    " and resid 134  and name HB2 ))
   (( segid "    " and resid 134  and name H   ))
 OR {  229}
   (( segid "    " and resid 134  and name HB3 ))
   (( segid "    " and resid 134  and name H   ))
 OR {  229}
   (( segid "    " and resid 134  and name HB3 ))
   (( segid "    " and resid 135  and name H   ))
 ASSI {  230}
   (( segid "    " and resid 134  and name HB2 ))
   (( segid "    " and resid 134  and name H   ))
      3.100     1.200     1.200 peak   230 spectrum    1 weight  0.10000E+01 volume  0.25580E-02 ppm1      1.815 ppm2      8.522 CV     1
 OR {  230}
   (( segid "    " and resid 134  and name HB3 ))
   (( segid "    " and resid 134  and name H   ))
 OR {  230}
   (( segid "    " and resid 134  and name HB3 ))
   (( segid "    " and resid 135  and name H   ))
 OR {  230}
   (( segid "    " and resid 134  and name HB2 ))
   (( segid "    " and resid 135  and name H   ))
 ASSI {  234}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name H   ))
      4.200     2.300     1.800 peak   234 spectrum    1 weight  0.10000E+01 volume  0.97880E-03 ppm1      3.255 ppm2      8.360 CV     1
 OR {  234}
   (( segid "    " and resid 86   and name HD3 ))
   (( segid "    " and resid 86   and name H   ))
 OR {  234}
   (( segid "    " and resid 18   and name HD2 ))
   (( segid "    " and resid 18   and name H   ))
 OR {  234}
   (( segid "    " and resid 47   and name HD3 ))
   (( segid "    " and resid 48   and name H   ))
 ASSI {  235}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name H   ))
      4.000     2.000     2.000 peak   235 spectrum    1 weight  0.10000E+01 volume  0.96806E-03 ppm1      3.212 ppm2      8.363 CV     1
 OR {  235}
   (( segid "    " and resid 86   and name HD3 ))
   (( segid "    " and resid 86   and name H   ))
 OR {  235}
   (( segid "    " and resid 47   and name HD3 ))
   (( segid "    " and resid 48   and name H   ))
 ASSI {  236}
   (( segid "    " and resid 134  and name HB2 ))
   (( segid "    " and resid 134  and name HG2 ))
      1.600     0.300     0.600 peak   236 spectrum    1 weight  0.10000E+01 volume  0.82373E-01 ppm1      1.880 ppm2      1.673 CV     1
 OR {  236}
   (( segid "    " and resid 134  and name HB3 ))
   (( segid "    " and resid 134  and name HG3 ))
 OR {  236}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 68   and name HG2 ))
 OR {  236}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 5    and name HG2 ))
 OR {  236}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HG2 ))
 OR {  236}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 68   and name HG3 ))
 OR {  236}
   (( segid "    " and resid 134  and name HB2 ))
   (( segid "    " and resid 134  and name HG3 ))
 OR {  236}
   (( segid "    " and resid 134  and name HB3 ))
   (( segid "    " and resid 134  and name HG2 ))
 OR {  236}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HG3 ))
 OR {  236}
   (( segid "    " and resid 4    and name HB3 ))
   (( segid "    " and resid 4    and name HG3 ))
 OR {  236}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 5    and name HG3 ))
 ASSI {  238}
   (( segid "    " and resid 134  and name HB2 ))
   (( segid "    " and resid 135  and name HG2 ))
      3.600     1.600     1.600 peak   238 spectrum    1 weight  0.10000E+01 volume  0.22060E-02 ppm1      1.877 ppm2      2.394 CV     1
 OR {  238}
   (( segid "    " and resid 134  and name HB2 ))
   (( segid "    " and resid 135  and name HG3 ))
 OR {  238}
   (( segid "    " and resid 134  and name HB3 ))
   (( segid "    " and resid 135  and name HG2 ))
 OR {  238}
   (( segid "    " and resid 134  and name HB3 ))
   (( segid "    " and resid 135  and name HG3 ))
 OR {  238}
   (( segid "    " and resid 127  and name HB3 ))
   (( segid "    " and resid 129  and name HG2 ))
 OR {  238}
   (( segid "    " and resid 127  and name HB3 ))
   (( segid "    " and resid 129  and name HG3 ))
 OR {  238}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 129  and name HG3 ))
 ASSI {  241}
   (( segid "    " and resid 86   and name HD3 ))
   (( segid "    " and resid 86   and name HG2 ))
      1.800     0.400     0.400 peak   241 spectrum    1 weight  0.10000E+01 volume  0.37317E-01 ppm1      3.215 ppm2      1.844 CV     1
 OR {  241}
   (( segid "    " and resid 127  and name HD2 ))
   (( segid "    " and resid 127  and name HB3 ))
 OR {  241}
   (( segid "    " and resid 86   and name HD2 ))
   (( segid "    " and resid 86   and name HG2 ))
 OR {  241}
   (( segid "    " and resid 111  and name HD3 ))
   (( segid "    " and resid 111  and name HB3 ))
 OR {  241}
   (( segid "    " and resid 4    and name HD2 ))
   (( segid "    " and resid 4    and name HB3 ))
 OR {  241}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 128  and name HB2 ))
 OR {  241}
   (( segid "    " and resid 4    and name HD3 ))
   (( segid "    " and resid 4    and name HB3 ))
 OR {  241}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 128  and name HB3 ))
 OR {  241}
   (( segid "    " and resid 5    and name HD3 ))
   (( segid "    " and resid 5    and name HB3 ))
 OR {  241}
   (( segid "    " and resid 4    and name HD3 ))
   (( segid "    " and resid 4    and name HB2 ))
 OR {  241}
   (( segid "    " and resid 128  and name HD3 ))
   (( segid "    " and resid 128  and name HB2 ))
 OR {  241}
   (( segid "    " and resid 128  and name HD3 ))
   (( segid "    " and resid 128  and name HB3 ))
 OR {  241}
   (( segid "    " and resid 127  and name HD2 ))
   (( segid "    " and resid 127  and name HB2 ))
 OR {  241}
   (( segid "    " and resid 47   and name HD3 ))
   (( segid "    " and resid 47   and name HB2 ))
 OR {  241}
   (( segid "    " and resid 5    and name HD2 ))
   (( segid "    " and resid 5    and name HB3 ))
 OR {  241}
   (( segid "    " and resid 134  and name HD3 ))
   (( segid "    " and resid 134  and name HB2 ))
 OR {  241}
   (( segid "    " and resid 4    and name HD2 ))
   (( segid "    " and resid 4    and name HB2 ))
 OR {  241}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 47   and name HB2 ))
 OR {  241}
   (( segid "    " and resid 134  and name HD3 ))
   (( segid "    " and resid 134  and name HB3 ))
 OR {  241}
   (( segid "    " and resid 134  and name HD2 ))
   (( segid "    " and resid 134  and name HB2 ))
 OR {  241}
   (( segid "    " and resid 111  and name HD3 ))
   (( segid "    " and resid 98   and name HB3 ))
 ASSI {  242}
   (( segid "    " and resid 5    and name HD2 ))
   (( segid "    " and resid 5    and name HG3 ))
      1.600     0.300     0.600 peak   242 spectrum    1 weight  0.10000E+01 volume  0.68388E-01 ppm1      3.216 ppm2      1.661 CV     1
 OR {  242}
   (( segid "    " and resid 4    and name HD2 ))
   (( segid "    " and resid 4    and name HG2 ))
 OR {  242}
   (( segid "    " and resid 128  and name HD3 ))
   (( segid "    " and resid 128  and name HG3 ))
 OR {  242}
   (( segid "    " and resid 134  and name HD3 ))
   (( segid "    " and resid 134  and name HG2 ))
 OR {  242}
   (( segid "    " and resid 134  and name HD2 ))
   (( segid "    " and resid 134  and name HG3 ))
 OR {  242}
   (( segid "    " and resid 4    and name HD3 ))
   (( segid "    " and resid 4    and name HG3 ))
 OR {  242}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 128  and name HG2 ))
 OR {  242}
   (( segid "    " and resid 128  and name HD3 ))
   (( segid "    " and resid 128  and name HG2 ))
 OR {  242}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 128  and name HG3 ))
 OR {  242}
   (( segid "    " and resid 5    and name HD3 ))
   (( segid "    " and resid 5    and name HG2 ))
 OR {  242}
   (( segid "    " and resid 134  and name HD3 ))
   (( segid "    " and resid 134  and name HG3 ))
 OR {  242}
   (( segid "    " and resid 5    and name HD2 ))
   (( segid "    " and resid 5    and name HG2 ))
 OR {  242}
   (( segid "    " and resid 5    and name HD3 ))
   (( segid "    " and resid 5    and name HG3 ))
 OR {  242}
   (( segid "    " and resid 4    and name HD3 ))
   (( segid "    " and resid 4    and name HG2 ))
 OR {  242}
   (( segid "    " and resid 4    and name HD2 ))
   (( segid "    " and resid 4    and name HG3 ))
 ASSI {  243}
   (( segid "    " and resid 111  and name HD3 ))
   (  segid "    " and resid 115  and name HG1%)
      3.600     1.600     1.600 peak   243 spectrum    1 weight  0.10000E+01 volume  0.18771E-02 ppm1      3.225 ppm2      1.133 CV     1
 OR {  243}
   (( segid "    " and resid 127  and name HD2 ))
   (  segid "    " and resid 115  and name HG1%)
 OR {  243}
   (( segid "    " and resid 127  and name HD3 ))
   (  segid "    " and resid 115  and name HG1%)
 ASSI {  244}
   (( segid "    " and resid 86   and name HD3 ))
   (  segid "    " and resid 82   and name HD1%)
      2.600     0.800     0.800 peak   244 spectrum    1 weight  0.10000E+01 volume  0.86449E-02 ppm1      3.275 ppm2      0.945 CV     1
 OR {  244}
   (( segid "    " and resid 127  and name HD3 ))
   (  segid "    " and resid 115  and name HG2%)
 OR {  244}
   (( segid "    " and resid 18   and name HD2 ))
   (  segid "    " and resid 22   and name HD1%)
 OR {  244}
   (( segid "    " and resid 18   and name HD2 ))
   (  segid "    " and resid 22   and name HD2%)
 ASSI {  245}
   (( segid "    " and resid 47   and name HD3 ))
   (  segid "    " and resid 37   and name HD2%)
      2.800     1.000     1.000 peak   245 spectrum    1 weight  0.10000E+01 volume  0.44959E-02 ppm1      3.274 ppm2      0.829 CV     1
 OR {  245}
   (( segid "    " and resid 47   and name HD2 ))
   (  segid "    " and resid 37   and name HD2%)
 OR {  245}
   (( segid "    " and resid 127  and name HD3 ))
   (  segid "    " and resid 119  and name HD2%)
 OR {  245}
   (( segid "    " and resid 18   and name HD2 ))
   (  segid "    " and resid 59   and name HD1%)
 OR {  245}
   (( segid "    " and resid 111  and name HD3 ))
   (  segid "    " and resid 98   and name HD2%)
 ASSI {  246}
   (( segid "    " and resid 47   and name HD3 ))
   (  segid "    " and resid 37   and name HD2%)
      2.900     1.000     1.000 peak   246 spectrum    1 weight  0.10000E+01 volume  0.43938E-02 ppm1      3.235 ppm2      0.829 CV     1
 OR {  246}
   (( segid "    " and resid 47   and name HD2 ))
   (  segid "    " and resid 37   and name HD2%)
 OR {  246}
   (( segid "    " and resid 127  and name HD3 ))
   (  segid "    " and resid 119  and name HD2%)
 OR {  246}
   (( segid "    " and resid 18   and name HD2 ))
   (  segid "    " and resid 59   and name HD1%)
 OR {  246}
   (( segid "    " and resid 127  and name HD2 ))
   (  segid "    " and resid 119  and name HD2%)
 ASSI {  247}
   (( segid "    " and resid 127  and name HB3 ))
   (( segid "    " and resid 127  and name HD2 ))
      2.100     0.600     0.600 peak   247 spectrum    1 weight  0.10000E+01 volume  0.16652E-01 ppm1      1.878 ppm2      3.224 CV     1
 OR {  247}
   (( segid "    " and resid 111  and name HB3 ))
   (( segid "    " and resid 111  and name HD3 ))
 OR {  247}
   (( segid "    " and resid 4    and name HB3 ))
   (( segid "    " and resid 4    and name HD2 ))
 OR {  247}
   (( segid "    " and resid 4    and name HB3 ))
   (( segid "    " and resid 4    and name HD3 ))
 OR {  247}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 5    and name HD3 ))
 OR {  247}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HD2 ))
 OR {  247}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HD3 ))
 OR {  247}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 127  and name HD2 ))
 OR {  247}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 5    and name HD2 ))
 OR {  247}
   (( segid "    " and resid 134  and name HB2 ))
   (( segid "    " and resid 134  and name HD3 ))
 OR {  247}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 68   and name HD3 ))
 OR {  247}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 68   and name HD2 ))
 OR {  247}
   (( segid "    " and resid 134  and name HB3 ))
   (( segid "    " and resid 134  and name HD3 ))
 ASSI {  248}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 5    and name HD3 ))
      2.300     0.700     0.700 peak   248 spectrum    1 weight  0.10000E+01 volume  0.15102E-01 ppm1      1.816 ppm2      3.220 CV     1
 OR {  248}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HD2 ))
 OR {  248}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 4    and name HD3 ))
 OR {  248}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HD3 ))
 OR {  248}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 5    and name HD2 ))
 OR {  248}
   (( segid "    " and resid 134  and name HB2 ))
   (( segid "    " and resid 134  and name HD3 ))
 OR {  248}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 68   and name HD3 ))
 OR {  248}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 4    and name HD2 ))
 OR {  248}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 68   and name HD2 ))
 OR {  248}
   (( segid "    " and resid 134  and name HB3 ))
   (( segid "    " and resid 134  and name HD3 ))
 ASSI {  252}
   (( segid "    " and resid 134  and name HB3 ))
   (( segid "    " and resid 134  and name HA  ))
      2.100     0.600     0.600 peak   252 spectrum    1 weight  0.10000E+01 volume  0.13768E-01 ppm1      1.878 ppm2      4.345 CV     1
 OR {  252}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 68   and name HA  ))
 OR {  252}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HA  ))
 OR {  252}
   (( segid "    " and resid 134  and name HB2 ))
   (( segid "    " and resid 134  and name HA  ))
 OR {  252}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 5    and name HA  ))
 ASSI {  254}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 34   and name HA  ))
      2.600     0.800     0.800 peak   254 spectrum    1 weight  0.10000E+01 volume  0.45928E-02 ppm1      1.672 ppm2      3.948 CV     1
 OR {  254}
   (( segid "    " and resid 98   and name HG  ))
   (( segid "    " and resid 98   and name HA  ))
 OR {  254}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 37   and name HA  ))
 ASSI {  257}
   (( segid "    " and resid 25   and name HE2 ))
   (( segid "    " and resid 25   and name HG2 ))
      2.400     0.700     0.700 peak   257 spectrum    1 weight  0.10000E+01 volume  0.53975E-02 ppm1      2.969 ppm2      1.211 CV     1
 OR {  257}
   (( segid "    " and resid 48   and name HE2 ))
   (  segid "    " and resid 46   and name HG2%)
 OR {  257}
   (( segid "    " and resid 25   and name HE3 ))
   (( segid "    " and resid 25   and name HG2 ))
 ASSI {  259}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name H   ))
      3.200     1.300     1.300 peak   259 spectrum    1 weight  0.10000E+01 volume  0.15714E-02 ppm1      1.863 ppm2      8.350 CV     1
 OR {  259}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 68   and name H   ))
 OR {  259}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 6    and name H   ))
 ASSI {  260}
   (( segid "    " and resid 47   and name HB3 ))
   (( segid "    " and resid 48   and name H   ))
      2.700     0.900     0.900 peak   260 spectrum    1 weight  0.10000E+01 volume  0.28267E-02 ppm1      1.817 ppm2      8.325 CV     1
 OR {  260}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 48   and name H   ))
 OR {  260}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 18   and name H   ))
 ASSI {  261}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 127  and name H   ))
      2.800     1.000     1.000 peak   261 spectrum    1 weight  0.10000E+01 volume  0.17604E-02 ppm1      1.866 ppm2      9.014 CV     1
 OR {  261}
   (( segid "    " and resid 47   and name HB3 ))
   (( segid "    " and resid 47   and name H   ))
 OR {  261}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 47   and name H   ))
 OR {  261}
   (( segid "    " and resid 127  and name HB3 ))
   (( segid "    " and resid 127  and name H   ))
 ASSI {  263}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 5    and name H   ))
      3.300     1.400     1.400 peak   263 spectrum    1 weight  0.10000E+01 volume  0.15950E-02 ppm1      1.841 ppm2      8.142 CV     1
 OR {  263}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 69   and name H   ))
 OR {  263}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 69   and name H   ))
 ASSI {  264}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 36   and name H   ))
      4.000     2.000     2.000 peak   264 spectrum    1 weight  0.10000E+01 volume  0.12268E-02 ppm1      1.635 ppm2      8.141 CV     1
 OR {  264}
   (( segid "    " and resid 5    and name HG3 ))
   (( segid "    " and resid 5    and name H   ))
 OR {  264}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 5    and name H   ))
 OR {  264}
   (( segid "    " and resid 4    and name HG3 ))
   (( segid "    " and resid 5    and name H   ))
 ASSI {  265}
   (( segid "    " and resid 134  and name HG2 ))
   (( segid "    " and resid 134  and name H   ))
      2.800     1.000     1.000 peak   265 spectrum    1 weight  0.10000E+01 volume  0.32653E-02 ppm1      1.718 ppm2      8.565 CV     1
 OR {  265}
   (( segid "    " and resid 134  and name HG3 ))
   (( segid "    " and resid 134  and name H   ))
 OR {  265}
   (( segid "    " and resid 98   and name HG  ))
   (( segid "    " and resid 98   and name H   ))
 ASSI {  267}
   (( segid "    " and resid 134  and name HD2 ))
   (( segid "    " and resid 134  and name HA  ))
      2.900     1.000     1.000 peak   267 spectrum    1 weight  0.10000E+01 volume  0.48449E-02 ppm1      3.225 ppm2      4.347 CV     1
 OR {  267}
   (( segid "    " and resid 134  and name HD3 ))
   (( segid "    " and resid 134  and name HA  ))
 OR {  267}
   (( segid "    " and resid 4    and name HD3 ))
   (( segid "    " and resid 4    and name HA  ))
 OR {  267}
   (( segid "    " and resid 4    and name HD2 ))
   (( segid "    " and resid 4    and name HA  ))
 OR {  267}
   (( segid "    " and resid 5    and name HD3 ))
   (( segid "    " and resid 5    and name HA  ))
 OR {  267}
   (( segid "    " and resid 5    and name HD2 ))
   (( segid "    " and resid 5    and name HA  ))
 OR {  267}
   (( segid "    " and resid 134  and name HD3 ))
   (( segid "    " and resid 133  and name HA  ))
 ASSI {  268}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 133  and name H   ))
      2.800     1.000     1.000 peak   268 spectrum    1 weight  0.10000E+01 volume  0.40950E-02 ppm1      1.872 ppm2      8.493 CV     1
 OR {  268}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 133  and name H   ))
 OR {  268}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 134  and name H   ))
 OR {  268}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 134  and name H   ))
 OR {  268}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 133  and name H   ))
 ASSI {  269}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 134  and name H   ))
      3.300     1.300     1.300 peak   269 spectrum    1 weight  0.10000E+01 volume  0.18602E-02 ppm1      1.523 ppm2      8.491 CV     1
 OR {  269}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 134  and name H   ))
 OR {  269}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 133  and name H   ))
 OR {  269}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 133  and name H   ))
 OR {  269}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 133  and name H   ))
 ASSI {  270}
   (( segid "    " and resid 136  and name HG3 ))
   (( segid "    " and resid 136  and name H   ))
      3.000     1.100     1.100 peak   270 spectrum    1 weight  0.10000E+01 volume  0.22313E-02 ppm1      1.471 ppm2      8.487 CV     1
 OR {  270}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 134  and name H   ))
 OR {  270}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 134  and name H   ))
 OR {  270}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 136  and name H   ))
 OR {  270}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 133  and name H   ))
 ASSI {  271}
   (( segid "    " and resid 136  and name HD3 ))
   (( segid "    " and resid 136  and name H   ))
      3.700     1.700     1.700 peak   271 spectrum    1 weight  0.10000E+01 volume  0.14522E-02 ppm1      1.736 ppm2      8.492 CV     1
 OR {  271}
   (( segid "    " and resid 136  and name HD2 ))
   (( segid "    " and resid 136  and name H   ))
 OR {  271}
   (( segid "    " and resid 133  and name HD3 ))
   (( segid "    " and resid 133  and name H   ))
 OR {  271}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 133  and name H   ))
 ASSI {  272}
   (( segid "    " and resid 64   and name HE3 ))
   (( segid "    " and resid 70   and name H   ))
      4.000     2.000     2.000 peak   272 spectrum    1 weight  0.10000E+01 volume  0.36814E-03 ppm1      3.013 ppm2      8.548 CV     1
 OR {  272}
   (( segid "    " and resid 64   and name HE2 ))
   (( segid "    " and resid 70   and name H   ))
 OR {  272}
   (( segid "    " and resid 25   and name HE3 ))
   (( segid "    " and resid 26   and name H   ))
 ASSI {  273}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 90   and name H   ))
      2.700     0.900     0.900 peak   273 spectrum    1 weight  0.10000E+01 volume  0.18335E-02 ppm1      1.737 ppm2      7.870 CV     1
 OR {  273}
   (( segid "    " and resid 132  and name HD3 ))
   (( segid "    " and resid 132  and name H   ))
 ASSI {  274}
   (( segid "    " and resid 92   and name HG3 ))
   (( segid "    " and resid 92   and name H   ))
      3.300     1.400     1.400 peak   274 spectrum    1 weight  0.10000E+01 volume  0.28257E-02 ppm1      1.512 ppm2      7.852 CV     1
 OR {  274}
   (( segid "    " and resid 132  and name HG2 ))
   (( segid "    " and resid 132  and name H   ))
 OR {  274}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 132  and name H   ))
 ASSI {  275}
   (( segid "    " and resid 92   and name HG3 ))
   (( segid "    " and resid 93   and name H   ))
      3.300     1.300     1.300 peak   275 spectrum    1 weight  0.10000E+01 volume  0.16895E-02 ppm1      1.512 ppm2      8.333 CV     1
 OR {  275}
   (( segid "    " and resid 48   and name HG3 ))
   (( segid "    " and resid 48   and name H   ))
 ASSI {  281}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 90   and name HB3 ))
      1.500     0.300     0.700 peak   281 spectrum    1 weight  0.10000E+01 volume  0.74452E-01 ppm1      1.731 ppm2      1.503 CV     1
 OR {  281}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 48   and name HG3 ))
 OR {  281}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 132  and name HG3 ))
 OR {  281}
   (( segid "    " and resid 133  and name HD3 ))
   (( segid "    " and resid 133  and name HG2 ))
 OR {  281}
   (( segid "    " and resid 132  and name HD3 ))
   (( segid "    " and resid 132  and name HG2 ))
 OR {  281}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 132  and name HG2 ))
 OR {  281}
   (( segid "    " and resid 132  and name HD3 ))
   (( segid "    " and resid 132  and name HG3 ))
 OR {  281}
   (( segid "    " and resid 133  and name HD3 ))
   (( segid "    " and resid 133  and name HG3 ))
 OR {  281}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 133  and name HG2 ))
 ASSI {  282}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 48   and name HG3 ))
      1.600     0.300     0.600 peak   282 spectrum    1 weight  0.10000E+01 volume  0.70502E-01 ppm1      1.700 ppm2      1.498 CV     1
 OR {  282}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 132  and name HG3 ))
 OR {  282}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 133  and name HG3 ))
 OR {  282}
   (( segid "    " and resid 133  and name HD3 ))
   (( segid "    " and resid 133  and name HG2 ))
 OR {  282}
   (( segid "    " and resid 132  and name HD3 ))
   (( segid "    " and resid 132  and name HG2 ))
 OR {  282}
   (( segid "    " and resid 48   and name HD3 ))
   (( segid "    " and resid 48   and name HG3 ))
 OR {  282}
   (( segid "    " and resid 132  and name HD2 ))
   (( segid "    " and resid 132  and name HG2 ))
 OR {  282}
   (( segid "    " and resid 132  and name HD3 ))
   (( segid "    " and resid 132  and name HG3 ))
 OR {  282}
   (( segid "    " and resid 133  and name HD3 ))
   (( segid "    " and resid 133  and name HG3 ))
 OR {  282}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 133  and name HG2 ))
 ASSI {  283}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 133  and name HG2 ))
      2.100     0.500     0.500 peak   283 spectrum    1 weight  0.10000E+01 volume  0.18014E-01 ppm1      4.380 ppm2      1.485 CV     1
 OR {  283}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HG2 ))
 OR {  283}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 133  and name HG3 ))
 OR {  283}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HG3 ))
 OR {  283}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 132  and name HG3 ))
 OR {  283}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 132  and name HG2 ))
 ASSI {  284}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 132  and name HE2 ))
      3.700     1.700     1.700 peak   284 spectrum    1 weight  0.10000E+01 volume  0.24730E-02 ppm1      4.374 ppm2      3.037 CV     1
 OR {  284}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 133  and name HE3 ))
 OR {  284}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 132  and name HE3 ))
 OR {  284}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 133  and name HE2 ))
 ASSI {  297}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HB3 ))
      2.700     0.900     0.900 peak   297 spectrum    1 weight  0.10000E+01 volume  0.29448E-02 ppm1      4.730 ppm2      3.324 CV     1
 OR {  297}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 131  and name HB3 ))
 ASSI {  300}
   (( segid "    " and resid 131  and name HB3 ))
   (( segid "    " and resid 133  and name HB2 ))
      3.400     1.500     1.500 peak   300 spectrum    1 weight  0.10000E+01 volume  0.11429E-02 ppm1      3.276 ppm2      1.833 CV     1
 OR {  300}
   (( segid "    " and resid 131  and name HB3 ))
   (( segid "    " and resid 133  and name HB3 ))
 OR {  300}
   (( segid "    " and resid 131  and name HB3 ))
   (( segid "    " and resid 132  and name HB2 ))
 OR {  300}
   (( segid "    " and resid 131  and name HB3 ))
   (( segid "    " and resid 132  and name HB3 ))
 OR {  300}
   (( segid "    " and resid 131  and name HB3 ))
   (( segid "    " and resid 128  and name HB2 ))
 ASSI {  301}
   (( segid "    " and resid 131  and name HB3 ))
   (( segid "    " and resid 133  and name HD2 ))
      3.400     1.400     1.400 peak   301 spectrum    1 weight  0.10000E+01 volume  0.11134E-02 ppm1      3.280 ppm2      1.696 CV     1
 OR {  301}
   (( segid "    " and resid 131  and name HB3 ))
   (( segid "    " and resid 133  and name HD3 ))
 OR {  301}
   (( segid "    " and resid 131  and name HB3 ))
   (( segid "    " and resid 130  and name HB3 ))
 ASSI {  302}
   (( segid "    " and resid 41   and name HB2 ))
   (  segid "    " and resid 40   and name HD2%)
      3.800     1.800     1.800 peak   302 spectrum    1 weight  0.10000E+01 volume  0.13590E-02 ppm1      2.841 ppm2      0.966 CV     1
 OR {  302}
   (( segid "    " and resid 14   and name HG2 ))
   (  segid "    " and resid 40   and name HD1%)
 OR {  302}
   (( segid "    " and resid 41   and name HB3 ))
   (  segid "    " and resid 40   and name HD2%)
 OR {  302}
   (( segid "    " and resid 131  and name HB2 ))
   (  segid "    " and resid 115  and name HG2%)
 OR {  302}
   (( segid "    " and resid 41   and name HB2 ))
   (  segid "    " and resid 40   and name HD1%)
 OR {  302}
   (( segid "    " and resid 41   and name HB3 ))
   (  segid "    " and resid 40   and name HD1%)
 OR {  302}
   (( segid "    " and resid 14   and name HG2 ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI {  304}
   (( segid "    " and resid 14   and name HG2 ))
   (  segid "    " and resid 57   and name HE% )
      3.300     1.300     1.300 peak   304 spectrum    1 weight  0.10000E+01 volume  0.19116E-02 ppm1      2.841 ppm2      1.976 CV     1
 OR {  304}
   (( segid "    " and resid 14   and name HG2 ))
   (( segid "    " and resid 57   and name HG2 ))
 OR {  304}
   (( segid "    " and resid 14   and name HG2 ))
   (( segid "    " and resid 12   and name HB3 ))
 ASSI {  306}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 67   and name HG2 ))
      2.700     0.900     0.900 peak   306 spectrum    1 weight  0.10000E+01 volume  0.23715E-02 ppm1      2.851 ppm2      2.402 CV     1
 OR {  306}
   (( segid "    " and resid 14   and name HG2 ))
   (( segid "    " and resid 14   and name HB2 ))
 OR {  306}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 67   and name HG3 ))
 ASSI {  314}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 127  and name HG3 ))
      2.100     2.100     3.900 peak   314 spectrum    1 weight  0.10000E+01 volume  0.18798E-02 ppm1      6.742 ppm2      1.566 CV     1
 OR {  314}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 133  and name HG2 ))
 ASSI {  315}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 130  and name HB2 ))
      3.000     1.100     1.100 peak   315 spectrum    1 weight  0.10000E+01 volume  0.18179E-02 ppm1      6.741 ppm2      1.446 CV     1
 OR {  315}
   (  segid "    " and resid 131  and name HE% )
   (  segid "    " and resid 112  and name HB% )
 ASSI {  325}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 130  and name H   ))
      2.500     2.500     3.500 peak   325 spectrum    1 weight  0.10000E+01 volume  0.74065E-03 ppm1      6.741 ppm2      7.761 CV     1
 OR {  325}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 129  and name H   ))
 ASSI {  335}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 130  and name H   ))
      2.900     1.100     1.100 peak   335 spectrum    1 weight  0.10000E+01 volume  0.13208E-02 ppm1      1.410 ppm2      7.763 CV     1
 OR {  335}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 129  and name H   ))
 ASSI {  338}
   (( segid "    " and resid 130  and name HB3 ))
   (( segid "    " and resid 115  and name HB  ))
      3.700     1.800     1.800 peak   338 spectrum    1 weight  0.10000E+01 volume  0.12572E-02 ppm1      1.686 ppm2      2.238 CV     1
 OR {  338}
   (( segid "    " and resid 82   and name HB3 ))
   (( segid "    " and resid 85   and name HB3 ))
 ASSI {  339}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 130  and name HB3 ))
      2.000     0.500     0.500 peak   339 spectrum    1 weight  0.10000E+01 volume  0.43686E-02 ppm1      1.432 ppm2      1.720 CV     1
 OR {  339}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 98   and name HG  ))
 ASSI {  340}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 130  and name HB3 ))
      2.100     0.500     0.500 peak   340 spectrum    1 weight  0.10000E+01 volume  0.34779E-02 ppm1      1.398 ppm2      1.692 CV     1
 OR {  340}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 98   and name HG  ))
 OR {  340}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 130  and name HG  ))
 ASSI {  345}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 116  and name H   ))
      2.400     2.400     3.600 peak   345 spectrum    1 weight  0.10000E+01 volume  0.81646E-03 ppm1      0.975 ppm2      8.112 CV     1
 OR {  345}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 120  and name H   ))
 ASSI {  346}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 115  and name H   ))
      4.000     2.000     2.000 peak   346 spectrum    1 weight  0.10000E+01 volume  0.97495E-03 ppm1      0.969 ppm2      8.569 CV     1
 OR {  346}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 128  and name H   ))
 ASSI {  349}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 112  and name HA  ))
      3.800     1.800     1.800 peak   349 spectrum    1 weight  0.10000E+01 volume  0.10690E-02 ppm1      0.971 ppm2      4.038 CV     1
 OR {  349}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 128  and name HA  ))
 ASSI {  353}
   (  segid "    " and resid 59   and name HD2%)
   (( segid "    " and resid 59   and name HA  ))
      1.900     0.500     0.500 peak   353 spectrum    1 weight  0.10000E+01 volume  0.16268E-01 ppm1      0.939 ppm2      4.214 CV     1
 OR {  353}
   (  segid "    " and resid 82   and name HD2%)
   (( segid "    " and resid 82   and name HA  ))
 ASSI {  363}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 115  and name HB  ))
      2.500     0.800     0.800 peak   363 spectrum    1 weight  0.10000E+01 volume  0.28768E-02 ppm1      0.976 ppm2      2.221 CV     1
 OR {  363}
   (  segid "    " and resid 130  and name HD1%)
   (( segid "    " and resid 129  and name HB2 ))
 ASSI {  364}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 67   and name H   ))
      2.600     0.800     0.800 peak   364 spectrum    1 weight  0.10000E+01 volume  0.37116E-02 ppm1      4.143 ppm2      7.775 CV     1
 OR {  364}
   (( segid "    " and resid 129  and name HA  ))
   (( segid "    " and resid 129  and name H   ))
 ASSI {  365}
   (( segid "    " and resid 129  and name HB3 ))
   (( segid "    " and resid 129  and name H   ))
      2.800     1.000     1.000 peak   365 spectrum    1 weight  0.10000E+01 volume  0.21409E-02 ppm1      2.242 ppm2      7.779 CV     1
 OR {  365}
   (( segid "    " and resid 129  and name HB3 ))
   (( segid "    " and resid 130  and name H   ))
 ASSI {  366}
   (( segid "    " and resid 129  and name HG3 ))
   (( segid "    " and resid 130  and name H   ))
      2.400     0.700     0.700 peak   366 spectrum    1 weight  0.10000E+01 volume  0.39175E-02 ppm1      2.394 ppm2      7.782 CV     1
 OR {  366}
   (( segid "    " and resid 129  and name HG2 ))
   (( segid "    " and resid 129  and name H   ))
 OR {  366}
   (( segid "    " and resid 129  and name HG3 ))
   (( segid "    " and resid 129  and name H   ))
 OR {  366}
   (( segid "    " and resid 129  and name HG2 ))
   (( segid "    " and resid 130  and name H   ))
 ASSI {  367}
   (( segid "    " and resid 129  and name HB2 ))
   (( segid "    " and resid 129  and name H   ))
      3.400     1.500     1.500 peak   367 spectrum    1 weight  0.10000E+01 volume  0.26290E-02 ppm1      2.174 ppm2      7.776 CV     1
 OR {  367}
   (( segid "    " and resid 129  and name HB2 ))
   (( segid "    " and resid 130  and name H   ))
 ASSI {  368}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name H   ))
      2.800     1.000     1.000 peak   368 spectrum    1 weight  0.10000E+01 volume  0.32563E-02 ppm1      4.149 ppm2      7.465 CV     1
 OR {  368}
   (( segid "    " and resid 129  and name HA  ))
   (( segid "    " and resid 131  and name H   ))
 ASSI {  372}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 28   and name HA  ))
      2.300     0.700     0.700 peak   372 spectrum    1 weight  0.10000E+01 volume  0.82527E-02 ppm1      1.994 ppm2      4.147 CV     1
 OR {  372}
   (( segid "    " and resid 86   and name HB3 ))
   (( segid "    " and resid 86   and name HA  ))
 OR {  372}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HA  ))
 OR {  372}
   (( segid "    " and resid 28   and name HB3 ))
   (( segid "    " and resid 28   and name HA  ))
 ASSI {  375}
   (( segid "    " and resid 83   and name HB3 ))
   (( segid "    " and resid 82   and name HB3 ))
      3.800     1.800     1.800 peak   375 spectrum    1 weight  0.10000E+01 volume  0.20158E-02 ppm1      2.234 ppm2      1.711 CV     1
 OR {  375}
   (( segid "    " and resid 129  and name HB3 ))
   (( segid "    " and resid 130  and name HB3 ))
 OR {  375}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 111  and name HG2 ))
 OR {  375}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 98   and name HG  ))
 OR {  375}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 98   and name HG  ))
 OR {  375}
   (( segid "    " and resid 129  and name HB3 ))
   (( segid "    " and resid 127  and name HG2 ))
 ASSI {  376}
   (( segid "    " and resid 113  and name HB2 ))
   (  segid "    " and resid 112  and name HB% )
      3.500     1.500     1.500 peak   376 spectrum    1 weight  0.10000E+01 volume  0.14949E-02 ppm1      2.230 ppm2      1.472 CV     1
 OR {  376}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 109  and name HB3 ))
 OR {  376}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 109  and name HG3 ))
 OR {  376}
   (( segid "    " and resid 113  and name HB3 ))
   (  segid "    " and resid 112  and name HB% )
 OR {  376}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 109  and name HB3 ))
 OR {  376}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 109  and name HG3 ))
 ASSI {  378}
   (( segid "    " and resid 129  and name HG2 ))
   (  segid "    " and resid 125  and name HB% )
      3.100     1.200     1.200 peak   378 spectrum    1 weight  0.10000E+01 volume  0.19347E-02 ppm1      2.400 ppm2      1.481 CV     1
 OR {  378}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 40   and name HB3 ))
 OR {  378}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 17   and name HG  ))
 OR {  378}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 40   and name HB3 ))
 OR {  378}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 45   and name HG2 ))
 OR {  378}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 45   and name HG2 ))
 OR {  378}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 17   and name HG  ))
 ASSI {  379}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 43   and name HB  ))
      3.100     1.200     1.200 peak   379 spectrum    1 weight  0.10000E+01 volume  0.46151E-02 ppm1      2.396 ppm2      1.943 CV     1
 OR {  379}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 43   and name HB  ))
 OR {  379}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 40   and name HG  ))
 OR {  379}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 12   and name HB3 ))
 OR {  379}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 12   and name HB3 ))
 OR {  379}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 40   and name HG  ))
 ASSI {  380}
   (( segid "    " and resid 129  and name HG3 ))
   (( segid "    " and resid 129  and name HB3 ))
      2.000     0.500     0.500 peak   380 spectrum    1 weight  0.10000E+01 volume  0.19353E-01 ppm1      2.396 ppm2      2.253 CV     1
 OR {  380}
   (( segid "    " and resid 129  and name HG2 ))
   (( segid "    " and resid 126  and name HG3 ))
 OR {  380}
   (( segid "    " and resid 129  and name HG2 ))
   (( segid "    " and resid 129  and name HB3 ))
 OR {  380}
   (( segid "    " and resid 129  and name HG2 ))
   (( segid "    " and resid 126  and name HG2 ))
 OR {  380}
   (( segid "    " and resid 129  and name HG3 ))
   (( segid "    " and resid 126  and name HG3 ))
 ASSI {  382}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 117  and name HD3 ))
      4.600     2.600     1.400 peak   382 spectrum    1 weight  0.10000E+01 volume  0.83371E-03 ppm1      2.234 ppm2      0.516 CV     1
 OR {  382}
   (( segid "    " and resid 129  and name HB3 ))
   (  segid "    " and resid 124  and name HG1%)
 OR {  382}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 117  and name HD3 ))
 ASSI {  383}
   (( segid "    " and resid 113  and name HB3 ))
   (( segid "    " and resid 117  and name HD3 ))
      4.700     2.700     1.300 peak   383 spectrum    1 weight  0.10000E+01 volume  0.70681E-03 ppm1      2.176 ppm2      0.517 CV     1
 OR {  383}
   (( segid "    " and resid 129  and name HB2 ))
   (  segid "    " and resid 124  and name HG1%)
 OR {  383}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 117  and name HD3 ))
 ASSI {  391}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name H   ))
      2.700     0.900     0.900 peak   391 spectrum    1 weight  0.10000E+01 volume  0.27851E-02 ppm1      4.046 ppm2      8.599 CV     1
 OR {  391}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 128  and name H   ))
 ASSI {  392}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 129  and name H   ))
      3.000     1.100     1.100 peak   392 spectrum    1 weight  0.10000E+01 volume  0.18444E-02 ppm1      4.046 ppm2      7.773 CV     1
 OR {  392}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 130  and name H   ))
 ASSI {  396}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 129  and name H   ))
      4.000     2.000     2.000 peak   396 spectrum    1 weight  0.10000E+01 volume  0.83552E-03 ppm1      3.201 ppm2      7.785 CV     1
 OR {  396}
   (( segid "    " and resid 128  and name HD3 ))
   (( segid "    " and resid 129  and name H   ))
 OR {  396}
   (( segid "    " and resid 127  and name HD2 ))
   (( segid "    " and resid 130  and name H   ))
 OR {  396}
   (( segid "    " and resid 127  and name HD2 ))
   (( segid "    " and resid 129  and name H   ))
 ASSI {  397}
   (( segid "    " and resid 128  and name HD3 ))
   (( segid "    " and resid 128  and name H   ))
      3.900     1.900     1.900 peak   397 spectrum    1 weight  0.10000E+01 volume  0.13112E-02 ppm1      3.198 ppm2      8.606 CV     1
 OR {  397}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 128  and name H   ))
 OR {  397}
   (( segid "    " and resid 127  and name HD2 ))
   (( segid "    " and resid 115  and name H   ))
 OR {  397}
   (( segid "    " and resid 111  and name HD3 ))
   (( segid "    " and resid 98   and name H   ))
 ASSI {  398}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 127  and name H   ))
      3.100     1.200     1.200 peak   398 spectrum    1 weight  0.10000E+01 volume  0.95504E-03 ppm1      3.738 ppm2      9.008 CV     1
 OR {  398}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name H   ))
 ASSI {  399}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 130  and name H   ))
      3.300     1.400     1.400 peak   399 spectrum    1 weight  0.10000E+01 volume  0.13586E-02 ppm1      3.746 ppm2      7.758 CV     1
 OR {  399}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 129  and name H   ))
 ASSI {  400}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 50   and name H   ))
      3.200     1.300     1.300 peak   400 spectrum    1 weight  0.10000E+01 volume  0.13390E-02 ppm1      3.733 ppm2      8.206 CV     1
 OR {  400}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 51   and name H   ))
 ASSI {  401}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 128  and name H   ))
      3.800     1.800     1.800 peak   401 spectrum    1 weight  0.10000E+01 volume  0.58209E-03 ppm1      3.753 ppm2      8.602 CV     1
 OR {  401}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 22   and name H   ))
 ASSI {  402}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name H   ))
      3.100     1.200     1.200 peak   402 spectrum    1 weight  0.10000E+01 volume  0.92251E-03 ppm1      3.740 ppm2      8.320 CV     1
 OR {  402}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 48   and name H   ))
 ASSI {  403}
   (( segid "    " and resid 47   and name HG3 ))
   (( segid "    " and resid 47   and name H   ))
      4.100     2.100     1.900 peak   403 spectrum    1 weight  0.10000E+01 volume  0.67363E-03 ppm1      1.745 ppm2      9.012 CV     1
 OR {  403}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 127  and name H   ))
 OR {  403}
   (( segid "    " and resid 111  and name HG2 ))
   (( segid "    " and resid 111  and name H   ))
 ASSI {  406}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 9    and name HH2 ))
      3.900     1.900     1.900 peak   406 spectrum    1 weight  0.10000E+01 volume  0.60068E-03 ppm1      1.555 ppm2      6.732 CV     1
 OR {  406}
   (( segid "    " and resid 50   and name HG12))
   (( segid "    " and resid 9    and name HH2 ))
 OR {  406}
   (( segid "    " and resid 127  and name HG3 ))
   (  segid "    " and resid 131  and name HE% )
 ASSI {  417}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 126  and name HB2 ))
      2.400     0.700     0.700 peak   417 spectrum    1 weight  0.10000E+01 volume  0.64533E-02 ppm1      4.569 ppm2      2.205 CV     1
 OR {  417}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HG3 ))
 ASSI {  439}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 125  and name H   ))
      4.000     2.000     2.000 peak   439 spectrum    1 weight  0.10000E+01 volume  0.10178E-02 ppm1      2.304 ppm2      8.854 CV     1
 OR {  439}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 29   and name H   ))
 ASSI {  440}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 28   and name H   ))
      3.500     1.500     1.500 peak   440 spectrum    1 weight  0.10000E+01 volume  0.34491E-02 ppm1      2.309 ppm2      8.623 CV     1
 OR {  440}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 128  and name H   ))
 ASSI {  442}
   (( segid "    " and resid 34   and name HG3 ))
   (( segid "    " and resid 31   and name H   ))
      4.700     2.700     1.300 peak   442 spectrum    1 weight  0.10000E+01 volume  0.63608E-03 ppm1      2.208 ppm2      8.855 CV     1
 OR {  442}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 125  and name H   ))
 ASSI {  443}
   (( segid "    " and resid 28   and name HG3 ))
   (( segid "    " and resid 28   and name H   ))
      2.900     1.100     1.100 peak   443 spectrum    1 weight  0.10000E+01 volume  0.32617E-02 ppm1      2.254 ppm2      8.622 CV     1
 OR {  443}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 128  and name H   ))
 OR {  443}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 28   and name H   ))
 ASSI {  446}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 124  and name HA  ))
      4.100     2.100     1.900 peak   446 spectrum    1 weight  0.10000E+01 volume  0.84038E-03 ppm1      2.299 ppm2      4.293 CV     1
 OR {  446}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 130  and name HA  ))
 ASSI {  447}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 124  and name HA  ))
      4.700     2.700     1.300 peak   447 spectrum    1 weight  0.10000E+01 volume  0.65003E-03 ppm1      2.207 ppm2      4.302 CV     1
 OR {  447}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 130  and name HA  ))
 ASSI {  448}
   (( segid "    " and resid 50   and name HB  ))
   (( segid "    " and resid 50   and name HA  ))
      3.100     1.200     1.200 peak   448 spectrum    1 weight  0.10000E+01 volume  0.13104E-02 ppm1      2.184 ppm2      3.758 CV     1
 OR {  448}
   (( segid "    " and resid 50   and name HB  ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI {  451}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 27   and name HA  ))
      3.800     1.800     1.800 peak   451 spectrum    1 weight  0.10000E+01 volume  0.14172E-02 ppm1      2.310 ppm2      3.893 CV     1
 OR {  451}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 141  and name HB2 ))
 ASSI {  452}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 127  and name HA  ))
      4.500     2.500     1.500 peak   452 spectrum    1 weight  0.10000E+01 volume  0.87687E-03 ppm1      2.307 ppm2      3.751 CV     1
 OR {  452}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 29   and name HA3 ))
 ASSI {  458}
   (( segid "    " and resid 126  and name HG2 ))
   (  segid "    " and resid 130  and name HD2%)
      3.300     1.400     1.400 peak   458 spectrum    1 weight  0.10000E+01 volume  0.33525E-02 ppm1      2.309 ppm2      0.909 CV     1
 OR {  458}
   (( segid "    " and resid 28   and name HG2 ))
   (  segid "    " and resid 27   and name HG2%)
 ASSI {  460}
   (( segid "    " and resid 126  and name HG3 ))
   (  segid "    " and resid 125  and name HB% )
      2.300     2.300     3.700 peak   460 spectrum    1 weight  0.10000E+01 volume  0.47836E-02 ppm1      2.205 ppm2      1.471 CV     1
 OR {  460}
   (( segid "    " and resid 34   and name HG3 ))
   (( segid "    " and resid 51   and name HG12))
 OR {  460}
   (( segid "    " and resid 34   and name HG3 ))
   (( segid "    " and resid 40   and name HB3 ))
 ASSI {  461}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 128  and name HG2 ))
      3.600     1.600     1.600 peak   461 spectrum    1 weight  0.10000E+01 volume  0.31085E-02 ppm1      2.298 ppm2      1.612 CV     1
 OR {  461}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 128  and name HG3 ))
 OR {  461}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 130  and name HG  ))
 ASSI {  462}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 128  and name HG2 ))
      3.000     1.100     1.100 peak   462 spectrum    1 weight  0.10000E+01 volume  0.34659E-02 ppm1      2.202 ppm2      1.624 CV     1
 OR {  462}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 128  and name HG3 ))
 OR {  462}
   (( segid "    " and resid 34   and name HG3 ))
   (( segid "    " and resid 37   and name HG  ))
 OR {  462}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 130  and name HG  ))
 ASSI {  463}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 28   and name HB2 ))
      2.000     0.500     0.500 peak   463 spectrum    1 weight  0.10000E+01 volume  0.23131E-01 ppm1      2.307 ppm2      1.982 CV     1
 OR {  463}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 126  and name HB3 ))
 OR {  463}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 28   and name HB3 ))
 ASSI {  464}
   (( segid "    " and resid 125  and name HA  ))
   (  segid "    " and resid 124  and name HG2%)
      3.800     1.800     1.800 peak   464 spectrum    1 weight  0.10000E+01 volume  0.11089E-02 ppm1      4.306 ppm2      0.802 CV     1
 OR {  464}
   (( segid "    " and resid 125  and name HA  ))
   (  segid "    " and resid 119  and name HD2%)
 ASSI {  467}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 124  and name HB  ))
      4.800     2.900     1.200 peak   467 spectrum    1 weight  0.10000E+01 volume  0.59774E-03 ppm1      4.296 ppm2      1.900 CV     1
 OR {  467}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 127  and name HB2 ))
 ASSI {  475}
   (  segid "    " and resid 125  and name HB% )
   (( segid "    " and resid 126  and name HG3 ))
      3.300     1.300     1.300 peak   475 spectrum    1 weight  0.10000E+01 volume  0.63710E-02 ppm1      1.465 ppm2      2.211 CV     1
 OR {  475}
   (  segid "    " and resid 125  and name HB% )
   (( segid "    " and resid 126  and name HB2 ))
 OR {  475}
   (  segid "    " and resid 125  and name HB% )
   (( segid "    " and resid 129  and name HB3 ))
 ASSI {  476}
   (  segid "    " and resid 125  and name HB% )
   (( segid "    " and resid 124  and name HB  ))
      3.800     1.800     1.800 peak   476 spectrum    1 weight  0.10000E+01 volume  0.39014E-02 ppm1      1.467 ppm2      1.901 CV     1
 OR {  476}
   (  segid "    " and resid 125  and name HB% )
   (( segid "    " and resid 128  and name HB3 ))
 ASSI {  488}
   (( segid "    " and resid 124  and name HA  ))
   (  segid "    " and resid 125  and name HB% )
      3.600     1.600     1.600 peak   488 spectrum    1 weight  0.10000E+01 volume  0.25609E-02 ppm1      4.268 ppm2      1.468 CV     1
 OR {  488}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 48   and name HG3 ))
 ASSI {  496}
   (( segid "    " and resid 124  and name HB  ))
   (( segid "    " and resid 129  and name HB3 ))
      3.800     1.800     1.800 peak   496 spectrum    1 weight  0.10000E+01 volume  0.25034E-02 ppm1      1.894 ppm2      2.209 CV     1
 OR {  496}
   (( segid "    " and resid 124  and name HB  ))
   (( segid "    " and resid 129  and name HB2 ))
 OR {  496}
   (( segid "    " and resid 124  and name HB  ))
   (( segid "    " and resid 115  and name HB  ))
 OR {  496}
   (( segid "    " and resid 124  and name HB  ))
   (( segid "    " and resid 126  and name HG3 ))
 ASSI {  502}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 126  and name HG3 ))
      2.900     1.100     1.100 peak   502 spectrum    1 weight  0.10000E+01 volume  0.91083E-02 ppm1      0.806 ppm2      2.225 CV     1
 OR {  502}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 129  and name HB3 ))
 OR {  502}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 115  and name HB  ))
 ASSI {  505}
   (  segid "    " and resid 124  and name HG2%)
   (  segid "    " and resid 125  and name HB% )
      2.900     1.100     1.100 peak   505 spectrum    1 weight  0.10000E+01 volume  0.86185E-02 ppm1      0.805 ppm2      1.468 CV     1
 OR {  505}
   (  segid "    " and resid 123  and name HD1%)
   (( segid "    " and resid 121  and name HB3 ))
 ASSI {  506}
   (  segid "    " and resid 123  and name HD1%)
   (( segid "    " and resid 88   and name HB3 ))
      3.000     1.100     1.100 peak   506 spectrum    1 weight  0.10000E+01 volume  0.14388E-02 ppm1      0.802 ppm2      3.216 CV     1
 OR {  506}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 52   and name HB2 ))
 ASSI {  507}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 124  and name HA  ))
      2.500     0.800     0.800 peak   507 spectrum    1 weight  0.10000E+01 volume  0.75813E-02 ppm1      0.807 ppm2      4.274 CV     1
 OR {  507}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 125  and name HA  ))
 ASSI {  508}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 119  and name HA  ))
      3.100     1.200     1.200 peak   508 spectrum    1 weight  0.10000E+01 volume  0.38077E-02 ppm1      0.807 ppm2      4.154 CV     1
 OR {  508}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 129  and name HA  ))
 ASSI {  509}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 127  and name HA  ))
      3.000     1.200     1.200 peak   509 spectrum    1 weight  0.10000E+01 volume  0.29930E-02 ppm1      0.804 ppm2      3.749 CV     1
 OR {  509}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 62   and name HB3 ))
 ASSI {  511}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 115  and name HB  ))
      3.400     1.400     1.400 peak   511 spectrum    1 weight  0.10000E+01 volume  0.36821E-02 ppm1      0.514 ppm2      2.216 CV     1
 OR {  511}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 126  and name HG3 ))
 OR {  511}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 129  and name HB3 ))
 ASSI {  512}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 124  and name HB  ))
      2.000     0.500     0.500 peak   512 spectrum    1 weight  0.10000E+01 volume  0.11894E-01 ppm1      0.514 ppm2      1.894 CV     1
 OR {  512}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 118  and name HG  ))
 ASSI {  513}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 119  and name HB2 ))
      3.400     1.500     1.500 peak   513 spectrum    1 weight  0.10000E+01 volume  0.37848E-02 ppm1      0.514 ppm2      1.737 CV     1
 OR {  513}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 127  and name HG2 ))
 ASSI {  514}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 118  and name HB3 ))
      2.000     0.500     0.500 peak   514 spectrum    1 weight  0.10000E+01 volume  0.72638E-02 ppm1      0.514 ppm2      1.552 CV     1
 OR {  514}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 119  and name HG  ))
 ASSI {  516}
   (  segid "    " and resid 124  and name HG1%)
   (  segid "    " and resid 124  and name HG2%)
      1.800     0.400     0.400 peak   516 spectrum    1 weight  0.10000E+01 volume  0.31453E-01 ppm1      0.514 ppm2      0.805 CV     1
 OR {  516}
   (  segid "    " and resid 124  and name HG1%)
   (  segid "    " and resid 119  and name HD2%)
 ASSI {  517}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 124  and name HA  ))
      3.000     1.100     1.100 peak   517 spectrum    1 weight  0.10000E+01 volume  0.44615E-02 ppm1      0.514 ppm2      4.275 CV     1
 OR {  517}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 116  and name HA  ))
 ASSI {  522}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 115  and name H   ))
      5.300     3.500     0.700 peak   522 spectrum    1 weight  0.10000E+01 volume  0.37999E-03 ppm1      0.515 ppm2      8.583 CV     1
 OR {  522}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 128  and name H   ))
 ASSI {  526}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 123  and name H   ))
      3.200     1.300     1.300 peak   526 spectrum    1 weight  0.10000E+01 volume  0.31421E-02 ppm1      0.514 ppm2      7.607 CV     1
 OR {  526}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 126  and name H   ))
 ASSI {  529}
   (  segid "    " and resid 123  and name HD1%)
   (( segid "    " and resid 86   and name H   ))
      2.600     2.600     3.400 peak   529 spectrum    1 weight  0.10000E+01 volume  0.87539E-03 ppm1      0.805 ppm2      8.392 CV     1
 OR {  529}
   (  segid "    " and resid 123  and name HD1%)
   (( segid "    " and resid 118  and name H   ))
 OR {  529}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 68   and name H   ))
 ASSI {  530}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 130  and name H   ))
      3.400     1.500     1.500 peak   530 spectrum    1 weight  0.10000E+01 volume  0.34374E-02 ppm1      0.807 ppm2      7.776 CV     1
 OR {  530}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 129  and name H   ))
 ASSI {  534}
   (( segid "    " and resid 124  and name HB  ))
   (( segid "    " and resid 130  and name H   ))
      5.000     3.100     1.000 peak   534 spectrum    1 weight  0.10000E+01 volume  0.57984E-03 ppm1      1.894 ppm2      7.783 CV     1
 OR {  534}
   (( segid "    " and resid 124  and name HB  ))
   (( segid "    " and resid 129  and name H   ))
 ASSI {  554}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 118  and name HA  ))
      3.200     1.300     1.300 peak   554 spectrum    1 weight  0.10000E+01 volume  0.29598E-02 ppm1      0.628 ppm2      3.660 CV     1
 OR {  554}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 101  and name HA  ))
 ASSI {  555}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 115  and name HA  ))
      4.800     2.900     1.200 peak   555 spectrum    1 weight  0.10000E+01 volume  0.41721E-03 ppm1      0.636 ppm2      3.335 CV     1
 OR {  555}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 91   and name HB2 ))
 ASSI {  557}
   (  segid "    " and resid 123  and name HD2%)
   (( segid "    " and resid 88   and name HB2 ))
      2.300     2.300     3.700 peak   557 spectrum    1 weight  0.10000E+01 volume  0.12277E-02 ppm1      0.631 ppm2      2.949 CV     1
 OR {  557}
   (  segid "    " and resid 123  and name HD2%)
   (( segid "    " and resid 92   and name HD2 ))
 ASSI {  558}
   (  segid "    " and resid 123  and name HD2%)
   (( segid "    " and resid 89   and name HG3 ))
      3.100     1.200     1.200 peak   558 spectrum    1 weight  0.10000E+01 volume  0.29459E-02 ppm1      0.631 ppm2      2.491 CV     1
 OR {  558}
   (  segid "    " and resid 123  and name HD2%)
   (( segid "    " and resid 85   and name HG2 ))
 ASSI {  561}
   (  segid "    " and resid 123  and name HD1%)
   (( segid "    " and resid 123  and name HA  ))
      2.400     0.700     0.700 peak   561 spectrum    1 weight  0.10000E+01 volume  0.17977E-01 ppm1      0.791 ppm2      3.966 CV     1
 OR {  561}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 55   and name HA  ))
 ASSI {  564}
   (  segid "    " and resid 123  and name HD1%)
   (( segid "    " and resid 89   and name HG3 ))
      3.200     1.300     1.300 peak   564 spectrum    1 weight  0.10000E+01 volume  0.37268E-02 ppm1      0.797 ppm2      2.494 CV     1
 OR {  564}
   (  segid "    " and resid 123  and name HD1%)
   (( segid "    " and resid 85   and name HG2 ))
 ASSI {  567}
   (( segid "    " and resid 123  and name HG  ))
   (  segid "    " and resid 123  and name HD2%)
      2.600     0.800     0.800 peak   567 spectrum    1 weight  0.10000E+01 volume  0.39046E-02 ppm1      1.348 ppm2      0.628 CV     1
 OR {  567}
   (( segid "    " and resid 123  and name HG  ))
   (( segid "    " and resid 123  and name HB3 ))
 OR {  567}
   (( segid "    " and resid 73   and name HG13))
   (  segid "    " and resid 121  and name HD2%)
 ASSI {  568}
   (( segid "    " and resid 123  and name HG  ))
   (( segid "    " and resid 123  and name HA  ))
      3.500     1.500     1.500 peak   568 spectrum    1 weight  0.10000E+01 volume  0.95654E-03 ppm1      1.350 ppm2      3.965 CV     1
 OR {  568}
   (( segid "    " and resid 73   and name HG13))
   (( segid "    " and resid 81   and name HA  ))
 ASSI {  570}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 113  and name HB3 ))
      4.100     2.100     1.900 peak   570 spectrum    1 weight  0.10000E+01 volume  0.72475E-03 ppm1      1.362 ppm2      2.210 CV     1
 OR {  570}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 113  and name HB2 ))
 OR {  570}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 114  and name HB  ))
 OR {  570}
   (( segid "    " and resid 123  and name HG  ))
   (( segid "    " and resid 85   and name HB3 ))
 ASSI {  571}
   (( segid "    " and resid 123  and name HB2 ))
   (  segid "    " and resid 123  and name HD1%)
      3.100     1.200     1.200 peak   571 spectrum    1 weight  0.10000E+01 volume  0.14879E-02 ppm1      1.056 ppm2      0.795 CV     1
 OR {  571}
   (( segid "    " and resid 123  and name HB2 ))
   (  segid "    " and resid 118  and name HD2%)
 ASSI {  573}
   (( segid "    " and resid 123  and name HB2 ))
   (  segid "    " and resid 118  and name HD1%)
      3.300     1.400     1.400 peak   573 spectrum    1 weight  0.10000E+01 volume  0.89545E-03 ppm1      1.065 ppm2      0.525 CV     1
 OR {  573}
   (( segid "    " and resid 123  and name HB2 ))
   (  segid "    " and resid 124  and name HG1%)
 ASSI {  575}
   (( segid "    " and resid 123  and name HB3 ))
   (  segid "    " and resid 123  and name HD1%)
      3.200     1.300     1.300 peak   575 spectrum    1 weight  0.10000E+01 volume  0.85044E-03 ppm1      0.609 ppm2      0.797 CV     1
 OR {  575}
   (( segid "    " and resid 123  and name HB3 ))
   (  segid "    " and resid 118  and name HD2%)
 ASSI {  582}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 63   and name H   ))
      3.300     1.400     1.400 peak   582 spectrum    1 weight  0.10000E+01 volume  0.15656E-02 ppm1      0.782 ppm2      8.655 CV     1
 OR {  582}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 61   and name H   ))
 ASSI {  583}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 54   and name H   ))
      3.700     1.700     1.700 peak   583 spectrum    1 weight  0.10000E+01 volume  0.17211E-02 ppm1      0.782 ppm2      8.289 CV     1
 OR {  583}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 64   and name H   ))
 ASSI {  585}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 62   and name H   ))
      3.400     1.400     1.400 peak   585 spectrum    1 weight  0.10000E+01 volume  0.28021E-02 ppm1      0.786 ppm2      7.857 CV     1
 OR {  585}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 57   and name H   ))
 ASSI {  587}
   (  segid "    " and resid 123  and name HD1%)
   (  segid "    " and resid 88   and name HD% )
      2.300     0.700     0.700 peak   587 spectrum    1 weight  0.10000E+01 volume  0.60670E-02 ppm1      0.788 ppm2      7.074 CV     1
 OR {  587}
   (  segid "    " and resid 55   and name HG2%)
   (  segid "    " and resid 66   and name HE% )
 OR {  587}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 60   and name H   ))
 ASSI {  590}
   (  segid "    " and resid 123  and name HD2%)
   (( segid "    " and resid 85   and name HE21))
      2.200     2.200     3.800 peak   590 spectrum    1 weight  0.10000E+01 volume  0.13591E-02 ppm1      0.629 ppm2      6.808 CV     1
 OR {  590}
   (  segid "    " and resid 123  and name HD2%)
   (( segid "    " and resid 124  and name H   ))
 ASSI {  597}
   (( segid "    " and resid 122  and name HA3 ))
   (( segid "    " and resid 121  and name H   ))
      5.600     3.900     0.400 peak   597 spectrum    1 weight  0.10000E+01 volume  0.31828E-03 ppm1      3.782 ppm2      8.139 CV     1
 OR {  597}
   (( segid "    " and resid 122  and name HA3 ))
   (( segid "    " and resid 120  and name H   ))
 ASSI {  600}
   (( segid "    " and resid 122  and name HA3 ))
   (  segid "    " and resid 121  and name HD1%)
      5.300     3.500     0.700 peak   600 spectrum    1 weight  0.10000E+01 volume  0.43450E-03 ppm1      3.785 ppm2      0.683 CV     1
 OR {  600}
   (( segid "    " and resid 122  and name HA3 ))
   (  segid "    " and resid 119  and name HD1%)
 ASSI {  601}
   (( segid "    " and resid 122  and name HA2 ))
   (  segid "    " and resid 119  and name HD1%)
      5.100     3.300     0.900 peak   601 spectrum    1 weight  0.10000E+01 volume  0.30401E-03 ppm1      3.997 ppm2      0.639 CV     1
 OR {  601}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 123  and name HB3 ))
 OR {  601}
   (( segid "    " and resid 70   and name HA2 ))
   (  segid "    " and resid 121  and name HD2%)
 OR {  601}
   (( segid "    " and resid 122  and name HA2 ))
   (  segid "    " and resid 123  and name HD2%)
 ASSI {  607}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 121  and name H   ))
      3.000     1.100     1.100 peak   607 spectrum    1 weight  0.10000E+01 volume  0.20148E-02 ppm1      4.153 ppm2      8.136 CV     1
 OR {  607}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 36   and name H   ))
 OR {  607}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 71   and name H   ))
 ASSI {  611}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 122  and name HA3 ))
      5.000     3.200     1.000 peak   611 spectrum    1 weight  0.10000E+01 volume  0.35709E-03 ppm1      4.158 ppm2      3.801 CV     1
 OR {  611}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 18   and name HA  ))
 OR {  611}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 18   and name HA  ))
 ASSI {  615}
   (( segid "    " and resid 121  and name HB3 ))
   (  segid "    " and resid 121  and name HD2%)
      3.000     1.100     1.100 peak   615 spectrum    1 weight  0.10000E+01 volume  0.13990E-02 ppm1      1.458 ppm2      0.614 CV     1
 OR {  615}
   (( segid "    " and resid 121  and name HB3 ))
   (  segid "    " and resid 123  and name HD2%)
 ASSI {  618}
   (( segid "    " and resid 121  and name HG  ))
   (( segid "    " and resid 121  and name H   ))
      2.900     1.000     1.000 peak   618 spectrum    1 weight  0.10000E+01 volume  0.11364E-02 ppm1      1.529 ppm2      8.111 CV     1
 OR {  618}
   (( segid "    " and resid 45   and name HG2 ))
   (( segid "    " and resid 45   and name H   ))
 ASSI {  619}
   (( segid "    " and resid 75   and name HG  ))
   (( segid "    " and resid 75   and name H   ))
      2.700     0.900     0.900 peak   619 spectrum    1 weight  0.10000E+01 volume  0.22653E-02 ppm1      1.584 ppm2      8.388 CV     1
 OR {  619}
   (( segid "    " and resid 5    and name HG3 ))
   (( segid "    " and resid 6    and name H   ))
 ASSI {  623}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 122  and name H   ))
      4.000     2.100     2.000 peak   623 spectrum    1 weight  0.10000E+01 volume  0.12115E-02 ppm1      0.726 ppm2      7.837 CV     1
 OR {  623}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 119  and name H   ))
 ASSI {  624}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 121  and name H   ))
      3.000     1.100     1.100 peak   624 spectrum    1 weight  0.10000E+01 volume  0.39190E-02 ppm1      0.726 ppm2      8.139 CV     1
 OR {  624}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 120  and name H   ))
 ASSI {  627}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 87   and name H   ))
      2.800     2.800     3.200 peak   627 spectrum    1 weight  0.10000E+01 volume  0.48596E-03 ppm1      0.733 ppm2      8.643 CV     1
 OR {  627}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 81   and name H   ))
 OR {  627}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 128  and name H   ))
 ASSI {  628}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 39   and name H   ))
      3.300     1.400     1.400 peak   628 spectrum    1 weight  0.10000E+01 volume  0.26763E-02 ppm1      0.600 ppm2      7.542 CV     1
 OR {  628}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 117  and name H   ))
 ASSI {  629}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 39   and name HD2 ))
      4.100     2.100     1.900 peak   629 spectrum    1 weight  0.10000E+01 volume  0.11071E-02 ppm1      0.600 ppm2      7.407 CV     1
 OR {  629}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 76   and name HE3 ))
 ASSI {  631}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 76   and name HH2 ))
      3.100     1.200     1.200 peak   631 spectrum    1 weight  0.10000E+01 volume  0.17098E-02 ppm1      0.603 ppm2      6.881 CV     1
 OR {  631}
   (  segid "    " and resid 121  and name HD2%)
   (( segid "    " and resid 85   and name HE21))
 ASSI {  634}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 86   and name H   ))
      3.400     1.400     1.400 peak   634 spectrum    1 weight  0.10000E+01 volume  0.17461E-02 ppm1      0.602 ppm2      8.392 CV     1
 OR {  634}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 74   and name H   ))
 OR {  634}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 118  and name H   ))
 ASSI {  635}
   (  segid "    " and resid 121  and name HD2%)
   (( segid "    " and resid 121  and name H   ))
      2.700     0.900     0.900 peak   635 spectrum    1 weight  0.10000E+01 volume  0.50969E-02 ppm1      0.597 ppm2      8.132 CV     1
 OR {  635}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 85   and name H   ))
 OR {  635}
   (  segid "    " and resid 121  and name HD2%)
   (( segid "    " and resid 73   and name H   ))
 OR {  635}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 24   and name HD21))
 ASSI {  636}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 40   and name H   ))
      3.300     1.300     1.300 peak   636 spectrum    1 weight  0.10000E+01 volume  0.19767E-02 ppm1      0.598 ppm2      7.864 CV     1
 OR {  636}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 23   and name H   ))
 ASSI {  637}
   (  segid "    " and resid 121  and name HD2%)
   (( segid "    " and resid 73   and name HG12))
      2.000     0.500     0.500 peak   637 spectrum    1 weight  0.10000E+01 volume  0.14888E-01 ppm1      0.603 ppm2      1.082 CV     1
 OR {  637}
   (  segid "    " and resid 84   and name HD2%)
   (  segid "    " and resid 84   and name HD1%)
 ASSI {  638}
   (  segid "    " and resid 84   and name HD2%)
   (  segid "    " and resid 114  and name HG2%)
      2.000     0.500     0.500 peak   638 spectrum    1 weight  0.10000E+01 volume  0.20913E-01 ppm1      0.600 ppm2      0.975 CV     1
 OR {  638}
   (  segid "    " and resid 84   and name HD2%)
   (  segid "    " and resid 101  and name HD1%)
 OR {  638}
   (  segid "    " and resid 84   and name HD2%)
   (  segid "    " and resid 114  and name HD1%)
 OR {  638}
   (  segid "    " and resid 20   and name HD2%)
   (  segid "    " and resid 36   and name HG2%)
 ASSI {  640}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 84   and name HG  ))
      2.100     0.600     0.600 peak   640 spectrum    1 weight  0.10000E+01 volume  0.11815E-01 ppm1      0.599 ppm2      1.460 CV     1
 OR {  640}
   (  segid "    " and resid 121  and name HD2%)
   (( segid "    " and resid 121  and name HB3 ))
 OR {  640}
   (  segid "    " and resid 121  and name HD2%)
   (  segid "    " and resid 120  and name HB% )
 ASSI {  641}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 84   and name HB3 ))
      2.600     0.800     0.800 peak   641 spectrum    1 weight  0.10000E+01 volume  0.69440E-02 ppm1      0.600 ppm2      2.043 CV     1
 OR {  641}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 20   and name HB3 ))
 ASSI {  642}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 114  and name HG13))
      2.800     1.000     1.000 peak   642 spectrum    1 weight  0.10000E+01 volume  0.68033E-02 ppm1      0.600 ppm2      1.891 CV     1
 OR {  642}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 40   and name HB2 ))
 OR {  642}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 40   and name HG  ))
 ASSI {  643}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 89   and name HG3 ))
      2.900     2.900     3.100 peak   643 spectrum    1 weight  0.10000E+01 volume  0.27646E-02 ppm1      0.597 ppm2      2.481 CV     1
 OR {  643}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 24   and name HB2 ))
 OR {  643}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 85   and name HG2 ))
 ASSI {  644}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 87   and name HB2 ))
      3.100     1.200     1.200 peak   644 spectrum    1 weight  0.10000E+01 volume  0.43230E-02 ppm1      0.600 ppm2      2.258 CV     1
 OR {  644}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 19   and name HB3 ))
 OR {  644}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 114  and name HB  ))
 OR {  644}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 36   and name HG12))
 ASSI {  646}
   (  segid "    " and resid 121  and name HD2%)
   (( segid "    " and resid 71   and name HB  ))
      2.800     0.900     0.900 peak   646 spectrum    1 weight  0.10000E+01 volume  0.31828E-02 ppm1      0.597 ppm2      4.145 CV     1
 OR {  646}
   (  segid "    " and resid 121  and name HD2%)
   (( segid "    " and resid 121  and name HA  ))
 OR {  646}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 84   and name HA  ))
 ASSI {  648}
   (  segid "    " and resid 121  and name HD2%)
   (( segid "    " and resid 118  and name HA  ))
      3.300     1.400     1.400 peak   648 spectrum    1 weight  0.10000E+01 volume  0.45584E-02 ppm1      0.599 ppm2      3.659 CV     1
 OR {  648}
   (  segid "    " and resid 20   and name HD2%)
   (( segid "    " and resid 36   and name HA  ))
 ASSI {  651}
   (  segid "    " and resid 121  and name HD1%)
   (  segid "    " and resid 123  and name HD2%)
      2.000     0.500     0.500 peak   651 spectrum    1 weight  0.10000E+01 volume  0.23225E-01 ppm1      0.726 ppm2      0.606 CV     1
 OR {  651}
   (  segid "    " and resid 121  and name HD1%)
   (  segid "    " and resid 121  and name HD2%)
 ASSI {  654}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 85   and name HG2 ))
      4.400     2.500     1.600 peak   654 spectrum    1 weight  0.10000E+01 volume  0.13912E-02 ppm1      0.726 ppm2      2.486 CV     1
 OR {  654}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 89   and name HG3 ))
 ASSI {  658}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 71   and name HB  ))
      2.700     0.900     0.900 peak   658 spectrum    1 weight  0.10000E+01 volume  0.78982E-02 ppm1      0.726 ppm2      4.153 CV     1
 OR {  658}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 121  and name HA  ))
 ASSI {  668}
   (( segid "    " and resid 120  and name HA  ))
   (  segid "    " and resid 119  and name HD2%)
      3.900     1.900     1.900 peak   668 spectrum    1 weight  0.10000E+01 volume  0.18264E-02 ppm1      4.057 ppm2      0.799 CV     1
 OR {  668}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 98   and name HD2%)
 OR {  668}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 118  and name HD2%)
 OR {  668}
   (( segid "    " and resid 120  and name HA  ))
   (  segid "    " and resid 73   and name HG2%)
 OR {  668}
   (( segid "    " and resid 120  and name HA  ))
   (  segid "    " and resid 73   and name HD1%)
 OR {  668}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 119  and name HD2%)
 OR {  668}
   (( segid "    " and resid 120  and name HA  ))
   (  segid "    " and resid 123  and name HD1%)
 ASSI {  669}
   (( segid "    " and resid 120  and name HA  ))
   (  segid "    " and resid 119  and name HD1%)
      4.300     2.300     1.700 peak   669 spectrum    1 weight  0.10000E+01 volume  0.13211E-02 ppm1      4.061 ppm2      0.646 CV     1
 OR {  669}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 119  and name HD1%)
 ASSI {  670}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 115  and name HB  ))
      3.800     1.800     1.800 peak   670 spectrum    1 weight  0.10000E+01 volume  0.18603E-02 ppm1      4.065 ppm2      2.234 CV     1
 OR {  670}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 113  and name HB2 ))
 OR {  670}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 113  and name HB3 ))
 ASSI {  671}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 111  and name HB3 ))
      3.500     1.500     1.500 peak   671 spectrum    1 weight  0.10000E+01 volume  0.16435E-02 ppm1      4.060 ppm2      1.862 CV     1
 OR {  671}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 127  and name HB3 ))
 OR {  671}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 127  and name HB2 ))
 ASSI {  672}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 115  and name HA  ))
      4.600     2.600     1.400 peak   672 spectrum    1 weight  0.10000E+01 volume  0.41366E-03 ppm1      4.067 ppm2      3.344 CV     1
 OR {  672}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 113  and name HD2 ))
 ASSI {  676}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 113  and name HB2 ))
      3.200     1.300     1.300 peak   676 spectrum    1 weight  0.10000E+01 volume  0.39496E-02 ppm1      1.445 ppm2      2.233 CV     1
 OR {  676}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 113  and name HB3 ))
 OR {  676}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 115  and name HB  ))
 ASSI {  677}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 111  and name HB3 ))
      3.000     1.200     1.200 peak   677 spectrum    1 weight  0.10000E+01 volume  0.68325E-02 ppm1      1.445 ppm2      1.898 CV     1
 OR {  677}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 111  and name HB2 ))
 OR {  677}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 113  and name HG3 ))
 OR {  677}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 113  and name HG2 ))
 ASSI {  681}
   (  segid "    " and resid 120  and name HB% )
   (( segid "    " and resid 119  and name HB2 ))
      2.900     1.000     1.000 peak   681 spectrum    1 weight  0.10000E+01 volume  0.64226E-02 ppm1      1.442 ppm2      1.708 CV     1
 OR {  681}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 111  and name HG2 ))
 OR {  681}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 127  and name HG2 ))
 ASSI {  685}
   (  segid "    " and resid 120  and name HB% )
   (( segid "    " and resid 120  and name H   ))
      2.100     0.600     0.600 peak   685 spectrum    1 weight  0.10000E+01 volume  0.13363E-01 ppm1      1.450 ppm2      8.141 CV     1
 OR {  685}
   (  segid "    " and resid 120  and name HB% )
   (( segid "    " and resid 121  and name H   ))
 ASSI {  687}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 120  and name H   ))
      2.800     1.000     1.000 peak   687 spectrum    1 weight  0.10000E+01 volume  0.41701E-02 ppm1      4.057 ppm2      8.139 CV     1
 OR {  687}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 121  and name H   ))
 ASSI {  688}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 122  and name H   ))
      3.600     1.600     1.600 peak   688 spectrum    1 weight  0.10000E+01 volume  0.96037E-03 ppm1      4.059 ppm2      7.857 CV     1
 OR {  688}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 119  and name H   ))
 ASSI {  695}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 73   and name HB  ))
      2.000     2.000     4.000 peak   695 spectrum    1 weight  0.10000E+01 volume  0.29467E-02 ppm1      0.726 ppm2      1.809 CV     1
 OR {  695}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 81   and name HB2 ))
 OR {  695}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 84   and name HB2 ))
 OR {  695}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 127  and name HB3 ))
 ASSI {  698}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 119  and name H   ))
      2.800     1.000     1.000 peak   698 spectrum    1 weight  0.10000E+01 volume  0.20745E-02 ppm1      4.140 ppm2      7.865 CV     1
 OR {  698}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 122  and name H   ))
 ASSI {  699}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 120  and name H   ))
      3.100     1.200     1.200 peak   699 spectrum    1 weight  0.10000E+01 volume  0.16669E-02 ppm1      4.145 ppm2      8.133 CV     1
 OR {  699}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 121  and name H   ))
 ASSI {  704}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 119  and name HD2%)
      1.700     0.400     0.500 peak   704 spectrum    1 weight  0.10000E+01 volume  0.40334E-01 ppm1      0.656 ppm2      0.800 CV     1
 OR {  704}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 124  and name HG2%)
 ASSI {  706}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 115  and name HB  ))
      3.100     1.200     1.200 peak   706 spectrum    1 weight  0.10000E+01 volume  0.33571E-02 ppm1      0.656 ppm2      2.216 CV     1
 OR {  706}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 126  and name HB2 ))
 OR {  706}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 126  and name HG3 ))
 ASSI {  707}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 124  and name HB  ))
      3.100     1.200     1.200 peak   707 spectrum    1 weight  0.10000E+01 volume  0.66641E-02 ppm1      0.656 ppm2      1.876 CV     1
 OR {  707}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 127  and name HB2 ))
 OR {  707}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 127  and name HB3 ))
 ASSI {  708}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 127  and name HG2 ))
      2.100     0.500     0.500 peak   708 spectrum    1 weight  0.10000E+01 volume  0.85390E-02 ppm1      0.656 ppm2      1.753 CV     1
 OR {  708}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 119  and name HB2 ))
 ASSI {  712}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 116  and name HA  ))
      2.500     0.800     0.800 peak   712 spectrum    1 weight  0.10000E+01 volume  0.33773E-02 ppm1      0.656 ppm2      4.293 CV     1
 OR {  712}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 124  and name HA  ))
 ASSI {  717}
   (  segid "    " and resid 119  and name HD2%)
   (( segid "    " and resid 119  and name HG  ))
      1.900     0.400     0.400 peak   717 spectrum    1 weight  0.10000E+01 volume  0.26042E-01 ppm1      0.806 ppm2      1.549 CV     1
 OR {  717}
   (  segid "    " and resid 119  and name HD2%)
   (( segid "    " and resid 119  and name HB3 ))
 OR {  717}
   (  segid "    " and resid 119  and name HD2%)
   (( segid "    " and resid 127  and name HG3 ))
 OR {  717}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 37   and name HB2 ))
 ASSI {  718}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 47   and name HD2 ))
      2.900     1.100     1.100 peak   718 spectrum    1 weight  0.10000E+01 volume  0.34499E-02 ppm1      0.821 ppm2      3.303 CV     1
 OR {  718}
   (  segid "    " and resid 119  and name HD2%)
   (( segid "    " and resid 127  and name HD3 ))
 OR {  718}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 18   and name HD3 ))
 ASSI {  720}
   (  segid "    " and resid 119  and name HD2%)
   (( segid "    " and resid 116  and name HB2 ))
      4.100     2.100     1.900 peak   720 spectrum    1 weight  0.10000E+01 volume  0.10522E-02 ppm1      0.817 ppm2      2.852 CV     1
 OR {  720}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 66   and name HB2 ))
 OR {  720}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 31   and name HB3 ))
 ASSI {  721}
   (  segid "    " and resid 119  and name HD2%)
   (( segid "    " and resid 116  and name HB2 ))
      4.200     2.200     1.800 peak   721 spectrum    1 weight  0.10000E+01 volume  0.10255E-02 ppm1      0.804 ppm2      2.821 CV     1
 OR {  721}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 31   and name HB3 ))
 ASSI {  724}
   (  segid "    " and resid 119  and name HD2%)
   (( segid "    " and resid 116  and name HA  ))
      2.900     1.000     1.000 peak   724 spectrum    1 weight  0.10000E+01 volume  0.43610E-02 ppm1      0.801 ppm2      4.294 CV     1
 OR {  724}
   (  segid "    " and resid 119  and name HD2%)
   (( segid "    " and resid 125  and name HA  ))
 ASSI {  726}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 59   and name HA  ))
      3.400     1.500     1.500 peak   726 spectrum    1 weight  0.10000E+01 volume  0.42164E-02 ppm1      0.805 ppm2      4.151 CV     1
 OR {  726}
   (  segid "    " and resid 119  and name HD2%)
   (( segid "    " and resid 119  and name HA  ))
 ASSI {  727}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 34   and name HA  ))
      2.600     0.800     0.800 peak   727 spectrum    1 weight  0.10000E+01 volume  0.87049E-02 ppm1      0.823 ppm2      3.969 CV     1
 OR {  727}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 37   and name HA  ))
 ASSI {  728}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 47   and name HA  ))
      2.100     0.500     0.500 peak   728 spectrum    1 weight  0.10000E+01 volume  0.76913E-02 ppm1      0.823 ppm2      3.769 CV     1
 OR {  728}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 18   and name HA  ))
 ASSI {  731}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 128  and name H   ))
      4.400     2.400     1.600 peak   731 spectrum    1 weight  0.10000E+01 volume  0.66159E-03 ppm1      0.656 ppm2      8.594 CV     1
 OR {  731}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 115  and name H   ))
 ASSI {  733}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 120  and name H   ))
      3.600     1.600     1.600 peak   733 spectrum    1 weight  0.10000E+01 volume  0.23585E-02 ppm1      0.656 ppm2      8.142 CV     1
 OR {  733}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 116  and name H   ))
 ASSI {  735}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 126  and name H   ))
      3.600     1.600     1.600 peak   735 spectrum    1 weight  0.10000E+01 volume  0.19111E-02 ppm1      0.656 ppm2      7.620 CV     1
 OR {  735}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 123  and name H   ))
 ASSI {  737}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 131  and name HD% )
      4.900     3.000     1.100 peak   737 spectrum    1 weight  0.10000E+01 volume  0.40833E-03 ppm1      0.657 ppm2      7.104 CV     1
 OR {  737}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 88   and name HZ  ))
 ASSI {  738}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 124  and name H   ))
      4.100     2.100     1.900 peak   738 spectrum    1 weight  0.10000E+01 volume  0.12951E-02 ppm1      0.655 ppm2      6.788 CV     1
 OR {  738}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 131  and name HE% )
 ASSI {  739}
   (( segid "    " and resid 119  and name HG  ))
   (( segid "    " and resid 124  and name H   ))
      4.900     3.000     1.100 peak   739 spectrum    1 weight  0.10000E+01 volume  0.31860E-03 ppm1      1.532 ppm2      6.792 CV     1
 OR {  739}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 9    and name HZ3 ))
 ASSI {  742}
   (( segid "    " and resid 119  and name HG  ))
   (( segid "    " and resid 120  and name H   ))
      4.000     2.000     2.000 peak   742 spectrum    1 weight  0.10000E+01 volume  0.15401E-02 ppm1      1.548 ppm2      8.139 CV     1
 OR {  742}
   (( segid "    " and resid 119  and name HG  ))
   (( segid "    " and resid 121  and name H   ))
 ASSI {  743}
   (( segid "    " and resid 119  and name HB3 ))
   (( segid "    " and resid 120  and name H   ))
      3.500     1.600     1.600 peak   743 spectrum    1 weight  0.10000E+01 volume  0.14948E-02 ppm1      1.542 ppm2      8.138 CV     1
 OR {  743}
   (( segid "    " and resid 118  and name HB3 ))
   (( segid "    " and resid 120  and name H   ))
 OR {  743}
   (( segid "    " and resid 119  and name HB3 ))
   (( segid "    " and resid 121  and name H   ))
 ASSI {  749}
   (( segid "    " and resid 118  and name HB3 ))
   (( segid "    " and resid 124  and name H   ))
      4.700     2.800     1.300 peak   749 spectrum    1 weight  0.10000E+01 volume  0.21219E-03 ppm1      1.531 ppm2      6.794 CV     1
 OR {  749}
   (( segid "    " and resid 119  and name HB3 ))
   (( segid "    " and resid 124  and name H   ))
 ASSI {  751}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 29   and name HA3 ))
      4.500     2.500     1.500 peak   751 spectrum    1 weight  0.10000E+01 volume  0.11133E-02 ppm1      4.147 ppm2      3.759 CV     1
 OR {  751}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 122  and name HA3 ))
 ASSI {  752}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 84   and name HA  ))
      2.900     1.000     1.000 peak   752 spectrum    1 weight  0.10000E+01 volume  0.13885E-02 ppm1      1.754 ppm2      4.144 CV     1
 OR {  752}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HA  ))
 ASSI {  755}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 87   and name HB2 ))
      2.200     0.600     0.600 peak   755 spectrum    1 weight  0.10000E+01 volume  0.84837E-02 ppm1      4.141 ppm2      2.218 CV     1
 OR {  755}
   (( segid "    " and resid 129  and name HA  ))
   (( segid "    " and resid 129  and name HB3 ))
 OR {  755}
   (( segid "    " and resid 129  and name HA  ))
   (( segid "    " and resid 129  and name HB2 ))
 ASSI {  756}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HB2 ))
      2.300     0.700     0.700 peak   756 spectrum    1 weight  0.10000E+01 volume  0.11618E-01 ppm1      4.144 ppm2      1.817 CV     1
 OR {  756}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB2 ))
 OR {  756}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HB3 ))
 ASSI {  760}
   (( segid "    " and resid 119  and name HA  ))
   (  segid "    " and resid 119  and name HD2%)
      3.500     1.500     1.500 peak   760 spectrum    1 weight  0.10000E+01 volume  0.31690E-02 ppm1      4.141 ppm2      0.805 CV     1
 OR {  760}
   (( segid "    " and resid 119  and name HA  ))
   (  segid "    " and resid 124  and name HG2%)
 ASSI {  766}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 114  and name HG12))
      4.700     2.800     1.300 peak   766 spectrum    1 weight  0.10000E+01 volume  0.26344E-03 ppm1      1.745 ppm2      1.259 CV     1
 OR {  766}
   (( segid "    " and resid 17   and name HB2 ))
   (  segid "    " and resid 42   and name HG2%)
 ASSI {  770}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 59   and name HB2 ))
      4.500     2.600     1.500 peak   770 spectrum    1 weight  0.10000E+01 volume  0.97179E-03 ppm1      1.524 ppm2      1.244 CV     1
 OR {  770}
   (( segid "    " and resid 17   and name HG  ))
   (  segid "    " and resid 42   and name HG2%)
 OR {  770}
   (( segid "    " and resid 17   and name HG  ))
   (  segid "    " and resid 60   and name HB% )
 ASSI {  775}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 110  and name H   ))
      4.100     2.100     1.900 peak   775 spectrum    1 weight  0.10000E+01 volume  0.71769E-03 ppm1      1.387 ppm2      8.386 CV     1
 OR {  775}
   (( segid "    " and resid 73   and name HG13))
   (( segid "    " and resid 74   and name H   ))
 ASSI {  776}
   (( segid "    " and resid 117  and name HD2 ))
   (( segid "    " and resid 74   and name H   ))
      3.300     1.400     1.400 peak   776 spectrum    1 weight  0.10000E+01 volume  0.64672E-03 ppm1      1.132 ppm2      8.389 CV     1
 OR {  776}
   (( segid "    " and resid 73   and name HG12))
   (( segid "    " and resid 74   and name H   ))
 ASSI {  780}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 120  and name H   ))
      3.400     1.500     1.500 peak   780 spectrum    1 weight  0.10000E+01 volume  0.11160E-02 ppm1      4.009 ppm2      8.137 CV     1
 OR {  780}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 121  and name H   ))
 OR {  780}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 116  and name H   ))
 ASSI {  781}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 118  and name H   ))
      4.100     2.100     1.900 peak   781 spectrum    1 weight  0.10000E+01 volume  0.40881E-03 ppm1      3.998 ppm2      8.399 CV     1
 OR {  781}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 74   and name H   ))
 ASSI {  786}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 119  and name H   ))
      3.600     1.600     1.600 peak   786 spectrum    1 weight  0.10000E+01 volume  0.90441E-03 ppm1      4.288 ppm2      7.875 CV     1
 OR {  786}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 90   and name H   ))
 ASSI {  790}
   (( segid "    " and resid 95   and name HB2 ))
   (( segid "    " and resid 96   and name H   ))
      3.800     1.800     1.800 peak   790 spectrum    1 weight  0.10000E+01 volume  0.74316E-03 ppm1      2.802 ppm2      7.864 CV     1
 OR {  790}
   (( segid "    " and resid 95   and name HB3 ))
   (( segid "    " and resid 96   and name H   ))
 OR {  790}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 94   and name H   ))
 ASSI {  791}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 116  and name HA  ))
      2.900     1.000     1.000 peak   791 spectrum    1 weight  0.10000E+01 volume  0.14350E-02 ppm1      2.808 ppm2      4.307 CV     1
 OR {  791}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 113  and name HA  ))
 ASSI {  792}
   (( segid "    " and resid 116  and name HB3 ))
   (( segid "    " and resid 113  and name HA  ))
      3.000     1.200     1.200 peak   792 spectrum    1 weight  0.10000E+01 volume  0.16246E-02 ppm1      2.667 ppm2      4.303 CV     1
 OR {  792}
   (( segid "    " and resid 116  and name HB3 ))
   (( segid "    " and resid 116  and name HA  ))
 ASSI {  797}
   (( segid "    " and resid 116  and name HB3 ))
   (( segid "    " and resid 115  and name HA  ))
      4.700     2.800     1.300 peak   797 spectrum    1 weight  0.10000E+01 volume  0.35453E-03 ppm1      2.664 ppm2      3.390 CV     1
 OR {  797}
   (( segid "    " and resid 116  and name HB3 ))
   (( segid "    " and resid 113  and name HD2 ))
 OR {  797}
   (( segid "    " and resid 116  and name HB3 ))
   (( segid "    " and resid 113  and name HD3 ))
 ASSI {  798}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 115  and name HA  ))
      5.100     3.300     0.900 peak   798 spectrum    1 weight  0.10000E+01 volume  0.28172E-03 ppm1      2.795 ppm2      3.379 CV     1
 OR {  798}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 113  and name HD3 ))
 ASSI {  799}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 115  and name HB  ))
      4.400     2.500     1.600 peak   799 spectrum    1 weight  0.10000E+01 volume  0.53070E-03 ppm1      2.818 ppm2      2.246 CV     1
 OR {  799}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 113  and name HB3 ))
 OR {  799}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 97   and name HB  ))
 ASSI {  800}
   (( segid "    " and resid 95   and name HB3 ))
   (( segid "    " and resid 132  and name HB3 ))
      3.800     1.800     1.800 peak   800 spectrum    1 weight  0.10000E+01 volume  0.12687E-02 ppm1      2.799 ppm2      1.840 CV     1
 OR {  800}
   (( segid "    " and resid 95   and name HB3 ))
   (( segid "    " and resid 132  and name HB2 ))
 OR {  800}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 127  and name HB3 ))
 OR {  800}
   (( segid "    " and resid 95   and name HB2 ))
   (( segid "    " and resid 132  and name HB2 ))
 OR {  800}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 127  and name HB2 ))
 ASSI {  801}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 127  and name HG2 ))
      3.600     1.600     1.600 peak   801 spectrum    1 weight  0.10000E+01 volume  0.12201E-02 ppm1      2.799 ppm2      1.745 CV     1
 OR {  801}
   (( segid "    " and resid 95   and name HB3 ))
   (( segid "    " and resid 132  and name HD2 ))
 OR {  801}
   (( segid "    " and resid 95   and name HB2 ))
   (( segid "    " and resid 132  and name HD2 ))
 OR {  801}
   (( segid "    " and resid 95   and name HB3 ))
   (( segid "    " and resid 132  and name HD3 ))
 ASSI {  802}
   (( segid "    " and resid 95   and name HB3 ))
   (( segid "    " and resid 132  and name HG3 ))
      3.600     1.600     1.600 peak   802 spectrum    1 weight  0.10000E+01 volume  0.11033E-02 ppm1      2.807 ppm2      1.489 CV     1
 OR {  802}
   (( segid "    " and resid 95   and name HB2 ))
   (( segid "    " and resid 132  and name HG3 ))
 OR {  802}
   (( segid "    " and resid 95   and name HB3 ))
   (( segid "    " and resid 132  and name HG2 ))
 OR {  802}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 92   and name HG3 ))
 OR {  802}
   (( segid "    " and resid 116  and name HB2 ))
   (  segid "    " and resid 112  and name HB% )
 OR {  802}
   (( segid "    " and resid 95   and name HB2 ))
   (( segid "    " and resid 132  and name HG2 ))
 ASSI {  803}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 87   and name HB3 ))
      2.900     1.100     1.100 peak   803 spectrum    1 weight  0.10000E+01 volume  0.22583E-02 ppm1      4.289 ppm2      1.542 CV     1
 OR {  803}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 127  and name HG3 ))
 OR {  803}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 119  and name HG  ))
 ASSI {  804}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 127  and name HG2 ))
      2.600     0.800     0.800 peak   804 spectrum    1 weight  0.10000E+01 volume  0.20862E-02 ppm1      4.293 ppm2      1.785 CV     1
 OR {  804}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 90   and name HB2 ))
 ASSI {  805}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 119  and name HD2%)
      3.100     1.200     1.200 peak   805 spectrum    1 weight  0.10000E+01 volume  0.30497E-02 ppm1      4.293 ppm2      0.801 CV     1
 OR {  805}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 124  and name HG2%)
 ASSI {  808}
   (( segid "    " and resid 116  and name HB2 ))
   (  segid "    " and resid 119  and name HD2%)
      5.200     3.400     0.800 peak   808 spectrum    1 weight  0.10000E+01 volume  0.35855E-03 ppm1      2.806 ppm2      0.794 CV     1
 OR {  808}
   (( segid "    " and resid 116  and name HB2 ))
   (  segid "    " and resid 124  and name HG2%)
 ASSI {  809}
   (( segid "    " and resid 116  and name HB3 ))
   (  segid "    " and resid 119  and name HD2%)
      5.000     3.100     1.000 peak   809 spectrum    1 weight  0.10000E+01 volume  0.57804E-03 ppm1      2.666 ppm2      0.799 CV     1
 OR {  809}
   (( segid "    " and resid 116  and name HB3 ))
   (  segid "    " and resid 118  and name HD2%)
 OR {  809}
   (( segid "    " and resid 116  and name HB3 ))
   (  segid "    " and resid 73   and name HG2%)
 OR {  809}
   (( segid "    " and resid 116  and name HB3 ))
   (  segid "    " and resid 124  and name HG2%)
 ASSI {  810}
   (( segid "    " and resid 116  and name HB3 ))
   (  segid "    " and resid 112  and name HB% )
      4.400     2.400     1.600 peak   810 spectrum    1 weight  0.10000E+01 volume  0.55686E-03 ppm1      2.656 ppm2      1.477 CV     1
 OR {  810}
   (( segid "    " and resid 116  and name HB3 ))
   (  segid "    " and resid 120  and name HB% )
 ASSI {  815}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 118  and name HG  ))
      4.600     2.600     1.400 peak   815 spectrum    1 weight  0.10000E+01 volume  0.59369E-03 ppm1      3.343 ppm2      1.890 CV     1
 OR {  815}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 124  and name HB  ))
 OR {  815}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 127  and name HB3 ))
 OR {  815}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 114  and name HG13))
 ASSI {  818}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 118  and name HB3 ))
      4.600     2.600     1.400 peak   818 spectrum    1 weight  0.10000E+01 volume  0.36100E-03 ppm1      3.354 ppm2      1.559 CV     1
 OR {  818}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 127  and name HG3 ))
 ASSI {  819}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 130  and name HB2 ))
      5.200     3.400     0.800 peak   819 spectrum    1 weight  0.10000E+01 volume  0.22349E-03 ppm1      3.364 ppm2      1.448 CV     1
 OR {  819}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 98   and name HB2 ))
 ASSI {  822}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 130  and name HD1%)
      2.400     0.700     0.700 peak   822 spectrum    1 weight  0.10000E+01 volume  0.48841E-02 ppm1      3.348 ppm2      0.961 CV     1
 OR {  822}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 115  and name HG2%)
 OR {  822}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 130  and name HD2%)
 ASSI {  824}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 119  and name HD1%)
      4.200     2.200     1.800 peak   824 spectrum    1 weight  0.10000E+01 volume  0.61556E-03 ppm1      3.346 ppm2      0.644 CV     1
 OR {  824}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 84   and name HD2%)
 OR {  824}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 123  and name HB3 ))
 ASSI {  825}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 124  and name HG1%)
      4.000     2.000     2.000 peak   825 spectrum    1 weight  0.10000E+01 volume  0.88240E-03 ppm1      3.346 ppm2      0.516 CV     1
 OR {  825}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 118  and name HD1%)
 ASSI {  828}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 130  and name HB2 ))
      2.700     0.900     0.900 peak   828 spectrum    1 weight  0.10000E+01 volume  0.16850E-02 ppm1      2.233 ppm2      1.374 CV     1
 OR {  828}
   (( segid "    " and resid 7    and name HB3 ))
   (  segid "    " and resid 6    and name HB% )
 ASSI {  830}
   (( segid "    " and resid 7    and name HB3 ))
   (  segid "    " and resid 43   and name HG1%)
      3.000     1.100     1.100 peak   830 spectrum    1 weight  0.10000E+01 volume  0.57417E-02 ppm1      2.231 ppm2      0.743 CV     1
 OR {  830}
   (( segid "    " and resid 115  and name HB  ))
   (  segid "    " and resid 118  and name HD2%)
 OR {  830}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 51   and name HD1%)
 ASSI {  831}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 130  and name HB2 ))
      2.600     0.800     0.800 peak   831 spectrum    1 weight  0.10000E+01 volume  0.28181E-02 ppm1      2.214 ppm2      1.448 CV     1
 OR {  831}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 51   and name HG12))
 OR {  831}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 98   and name HB2 ))
 OR {  831}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 64   and name HG2 ))
 OR {  831}
   (( segid "    " and resid 115  and name HB  ))
   (  segid "    " and resid 112  and name HB% )
 ASSI {  832}
   (( segid "    " and resid 97   and name HB  ))
   (  segid "    " and resid 97   and name HG2%)
      1.700     0.400     0.500 peak   832 spectrum    1 weight  0.10000E+01 volume  0.31490E-01 ppm1      2.213 ppm2      0.956 CV     1
 OR {  832}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 63   and name HG2%)
 OR {  832}
   (( segid "    " and resid 115  and name HB  ))
   (  segid "    " and resid 115  and name HG2%)
 OR {  832}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 63   and name HG1%)
 OR {  832}
   (( segid "    " and resid 115  and name HB  ))
   (  segid "    " and resid 130  and name HD2%)
 ASSI {  833}
   (( segid "    " and resid 115  and name HB  ))
   (  segid "    " and resid 118  and name HD2%)
      3.100     1.200     1.200 peak   833 spectrum    1 weight  0.10000E+01 volume  0.56718E-02 ppm1      2.214 ppm2      0.798 CV     1
 OR {  833}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 55   and name HG1%)
 OR {  833}
   (( segid "    " and resid 115  and name HB  ))
   (  segid "    " and resid 124  and name HG2%)
 OR {  833}
   (( segid "    " and resid 115  and name HB  ))
   (  segid "    " and resid 119  and name HD2%)
 ASSI {  834}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 51   and name HG2%)
      2.800     1.000     1.000 peak   834 spectrum    1 weight  0.10000E+01 volume  0.40718E-02 ppm1      2.215 ppm2      0.677 CV     1
 OR {  834}
   (( segid "    " and resid 115  and name HB  ))
   (  segid "    " and resid 119  and name HD1%)
 ASSI {  836}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 88   and name HB2 ))
      4.600     2.600     1.400 peak   836 spectrum    1 weight  0.10000E+01 volume  0.60007E-03 ppm1      2.213 ppm2      2.991 CV     1
 OR {  836}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 51   and name HA  ))
 OR {  836}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 64   and name HE3 ))
 ASSI {  837}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 66   and name HB2 ))
      4.000     2.000     2.000 peak   837 spectrum    1 weight  0.10000E+01 volume  0.73469E-03 ppm1      2.218 ppm2      2.881 CV     1
 OR {  837}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 131  and name HB2 ))
 OR {  837}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 45   and name HD3 ))
 ASSI {  838}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 115  and name HB  ))
      2.200     0.600     0.600 peak   838 spectrum    1 weight  0.10000E+01 volume  0.85433E-02 ppm1      1.126 ppm2      2.233 CV     1
 OR {  838}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 114  and name HB  ))
 OR {  838}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 114  and name HB  ))
 ASSI {  839}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 98   and name HB3 ))
      2.900     1.000     1.000 peak   839 spectrum    1 weight  0.10000E+01 volume  0.41441E-02 ppm1      1.125 ppm2      1.858 CV     1
 OR {  839}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 111  and name HB3 ))
 OR {  839}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 114  and name HG13))
 OR {  839}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 127  and name HB3 ))
 OR {  839}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 114  and name HG13))
 OR {  839}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 124  and name HB  ))
 ASSI {  840}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 98   and name HG  ))
      2.400     0.700     0.700 peak   840 spectrum    1 weight  0.10000E+01 volume  0.50562E-02 ppm1      1.125 ppm2      1.735 CV     1
 OR {  840}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 84   and name HB2 ))
 ASSI {  842}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 84   and name HG  ))
      2.200     0.600     0.600 peak   842 spectrum    1 weight  0.10000E+01 volume  0.77110E-02 ppm1      1.125 ppm2      1.444 CV     1
 OR {  842}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 130  and name HB2 ))
 ASSI {  843}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 117  and name HB2 ))
      3.100     1.200     1.200 peak   843 spectrum    1 weight  0.10000E+01 volume  0.40406E-02 ppm1      1.125 ppm2      1.317 CV     1
 OR {  843}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 109  and name HG2 ))
 OR {  843}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 123  and name HG  ))
 OR {  843}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 117  and name HB2 ))
 ASSI {  845}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 62   and name HA  ))
      4.800     2.800     1.200 peak   845 spectrum    1 weight  0.10000E+01 volume  0.66780E-03 ppm1      2.228 ppm2      4.566 CV     1
 OR {  845}
   (( segid "    " and resid 7    and name HB3 ))
   (( segid "    " and resid 6    and name HA  ))
 ASSI {  850}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 63   and name HA  ))
      2.300     0.700     0.700 peak   850 spectrum    1 weight  0.10000E+01 volume  0.60623E-02 ppm1      2.213 ppm2      3.961 CV     1
 OR {  850}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 3    and name HB3 ))
 OR {  850}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 88   and name HA  ))
 ASSI {  854}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 85   and name HA  ))
      3.300     1.400     1.400 peak   854 spectrum    1 weight  0.10000E+01 volume  0.20076E-02 ppm1      1.089 ppm2      3.892 CV     1
 OR {  854}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 114  and name HA  ))
 OR {  854}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 114  and name HA  ))
 OR {  854}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 88   and name HA  ))
 ASSI {  860}
   (  segid "    " and resid 33   and name HG2%)
   (  segid "    " and resid 54   and name HD1%)
      2.500     0.800     0.800 peak   860 spectrum    1 weight  0.10000E+01 volume  0.38461E-02 ppm1      0.950 ppm2      0.444 CV     1
 OR {  860}
   (  segid "    " and resid 22   and name HD2%)
   (  segid "    " and resid 54   and name HD1%)
 ASSI {  861}
   (  segid "    " and resid 115  and name HG2%)
   (  segid "    " and resid 124  and name HG1%)
      3.500     1.500     1.500 peak   861 spectrum    1 weight  0.10000E+01 volume  0.43686E-02 ppm1      0.956 ppm2      0.520 CV     1
 OR {  861}
   (  segid "    " and resid 115  and name HG2%)
   (  segid "    " and resid 118  and name HD1%)
 ASSI {  864}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 51   and name HA  ))
      2.400     0.700     0.700 peak   864 spectrum    1 weight  0.10000E+01 volume  0.84000E-02 ppm1      0.945 ppm2      2.996 CV     1
 OR {  864}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 21   and name HB2 ))
 OR {  864}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 88   and name HB2 ))
 OR {  864}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 21   and name HB3 ))
 ASSI {  866}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 22   and name HG  ))
      2.000     0.500     0.500 peak   866 spectrum    1 weight  0.10000E+01 volume  0.16443E-01 ppm1      0.945 ppm2      2.066 CV     1
 OR {  866}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 36   and name HB  ))
 OR {  866}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 18   and name HB3 ))
 ASSI {  868}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 37   and name HG  ))
      2.100     0.500     0.500 peak   868 spectrum    1 weight  0.10000E+01 volume  0.10992E-01 ppm1      0.950 ppm2      1.662 CV     1
 OR {  868}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 51   and name HB  ))
 OR {  868}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 18   and name HG2 ))
 OR {  868}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 18   and name HG3 ))
 ASSI {  869}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 22   and name HB3 ))
      2.200     0.600     0.600 peak   869 spectrum    1 weight  0.10000E+01 volume  0.17249E-01 ppm1      0.947 ppm2      1.450 CV     1
 OR {  869}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 51   and name HG12))
 OR {  869}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 25   and name HB2 ))
 ASSI {  877}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 67   and name HG2 ))
      3.900     1.900     1.900 peak   877 spectrum    1 weight  0.10000E+01 volume  0.23824E-02 ppm1      0.936 ppm2      2.419 CV     1
 OR {  877}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 67   and name HG3 ))
 OR {  877}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 65   and name HB3 ))
 ASSI {  879}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 92   and name HA  ))
      2.300     0.700     0.700 peak   879 spectrum    1 weight  0.10000E+01 volume  0.55866E-02 ppm1      0.955 ppm2      3.587 CV     1
 OR {  879}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 33   and name HA  ))
 ASSI {  880}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 116  and name HA  ))
      3.300     1.400     1.400 peak   880 spectrum    1 weight  0.10000E+01 volume  0.17403E-02 ppm1      0.959 ppm2      4.298 CV     1
 OR {  880}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 113  and name HA  ))
 ASSI {  881}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 62   and name HB2 ))
      2.600     0.900     0.900 peak   881 spectrum    1 weight  0.10000E+01 volume  0.12857E-01 ppm1      0.940 ppm2      3.961 CV     1
 OR {  881}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 63   and name HA  ))
 ASSI {  883}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 62   and name HA  ))
      4.700     2.800     1.300 peak   883 spectrum    1 weight  0.10000E+01 volume  0.82892E-03 ppm1      0.938 ppm2      4.582 CV     1
 OR {  883}
   (  segid "    " and resid 27   and name HG1%)
   (( segid "    " and resid 30   and name HA  ))
 ASSI {  886}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 116  and name H   ))
      3.700     1.700     1.700 peak   886 spectrum    1 weight  0.10000E+01 volume  0.54791E-03 ppm1      3.346 ppm2      8.109 CV     1
 OR {  886}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 114  and name H   ))
 ASSI {  887}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 4    and name H   ))
      3.500     1.500     1.500 peak   887 spectrum    1 weight  0.10000E+01 volume  0.18707E-02 ppm1      2.215 ppm2      8.291 CV     1
 OR {  887}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 64   and name H   ))
 ASSI {  888}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 97   and name H   ))
      2.500     0.800     0.800 peak   888 spectrum    1 weight  0.10000E+01 volume  0.36149E-02 ppm1      2.210 ppm2      8.636 CV     1
 OR {  888}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 63   and name H   ))
 ASSI {  889}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 115  and name H   ))
      3.300     1.300     1.300 peak   889 spectrum    1 weight  0.10000E+01 volume  0.27101E-02 ppm1      2.218 ppm2      8.574 CV     1
 OR {  889}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 98   and name H   ))
 ASSI {  890}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 116  and name H   ))
      3.600     1.600     1.600 peak   890 spectrum    1 weight  0.10000E+01 volume  0.23033E-02 ppm1      2.191 ppm2      8.100 CV     1
 OR {  890}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 45   and name H   ))
 ASSI {  891}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 94   and name H   ))
      3.700     1.700     1.700 peak   891 spectrum    1 weight  0.10000E+01 volume  0.13606E-02 ppm1      2.206 ppm2      7.847 CV     1
 OR {  891}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 92   and name H   ))
 OR {  891}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 99   and name H   ))
 OR {  891}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 67   and name H   ))
 ASSI {  892}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 117  and name H   ))
      4.300     2.300     1.700 peak   892 spectrum    1 weight  0.10000E+01 volume  0.87038E-03 ppm1      2.216 ppm2      7.523 CV     1
 OR {  892}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 66   and name H   ))
 OR {  892}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 113  and name H   ))
 ASSI {  895}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 52   and name HD2 ))
      3.900     1.900     1.900 peak   895 spectrum    1 weight  0.10000E+01 volume  0.94432E-03 ppm1      2.210 ppm2      7.078 CV     1
 OR {  895}
   (( segid "    " and resid 97   and name HB  ))
   (  segid "    " and resid 88   and name HD% )
 OR {  895}
   (( segid "    " and resid 115  and name HB  ))
   (  segid "    " and resid 131  and name HD% )
 OR {  895}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 66   and name HE% )
 ASSI {  899}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 85   and name H   ))
      3.300     1.300     1.300 peak   899 spectrum    1 weight  0.10000E+01 volume  0.34311E-02 ppm1      1.126 ppm2      8.103 CV     1
 OR {  899}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 116  and name H   ))
 OR {  899}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 114  and name H   ))
 ASSI {  900}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 119  and name H   ))
      4.000     2.000     2.000 peak   900 spectrum    1 weight  0.10000E+01 volume  0.74138E-03 ppm1      1.126 ppm2      7.874 CV     1
 OR {  900}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 132  and name H   ))
 OR {  900}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 90   and name H   ))
 OR {  900}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 119  and name H   ))
 OR {  900}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 99   and name H   ))
 ASSI {  901}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 113  and name H   ))
      4.100     2.100     1.900 peak   901 spectrum    1 weight  0.10000E+01 volume  0.88440E-03 ppm1      1.127 ppm2      7.536 CV     1
 OR {  901}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 117  and name H   ))
 ASSI {  906}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 91   and name H   ))
      3.900     1.900     1.900 peak   906 spectrum    1 weight  0.10000E+01 volume  0.15390E-02 ppm1      1.104 ppm2      7.757 CV     1
 OR {  906}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 100  and name H   ))
 ASSI {  908}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 103  and name H   ))
      4.200     2.200     1.800 peak   908 spectrum    1 weight  0.10000E+01 volume  0.11289E-02 ppm1      1.105 ppm2      7.516 CV     1
 OR {  908}
   (  segid "    " and resid 87   and name HD1%)
   (( segid "    " and resid 80   and name HE21))
 ASSI {  911}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 22   and name H   ))
      2.300     0.600     0.600 peak   911 spectrum    1 weight  0.10000E+01 volume  0.72809E-02 ppm1      0.948 ppm2      8.557 CV     1
 OR {  911}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 37   and name H   ))
 ASSI {  913}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 51   and name H   ))
      3.300     1.400     1.400 peak   913 spectrum    1 weight  0.10000E+01 volume  0.30579E-02 ppm1      0.955 ppm2      8.205 CV     1
 OR {  913}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 89   and name H   ))
 OR {  913}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 50   and name H   ))
 ASSI {  914}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 33   and name H   ))
      2.800     1.000     1.000 peak   914 spectrum    1 weight  0.10000E+01 volume  0.42522E-02 ppm1      0.955 ppm2      7.989 CV     1
 OR {  914}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 34   and name H   ))
 ASSI {  915}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 23   and name H   ))
      3.600     1.600     1.600 peak   915 spectrum    1 weight  0.10000E+01 volume  0.31390E-02 ppm1      0.950 ppm2      7.853 CV     1
 OR {  915}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 35   and name H   ))
 OR {  915}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 67   and name H   ))
 ASSI {  917}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 115  and name H   ))
      2.300     0.600     0.600 peak   917 spectrum    1 weight  0.10000E+01 volume  0.71592E-02 ppm1      0.964 ppm2      8.571 CV     1
 OR {  917}
   (  segid "    " and resid 27   and name HG1%)
   (( segid "    " and resid 26   and name H   ))
 ASSI {  918}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 68   and name H   ))
      3.800     1.800     1.800 peak   918 spectrum    1 weight  0.10000E+01 volume  0.12791E-02 ppm1      0.961 ppm2      8.405 CV     1
 OR {  918}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 118  and name H   ))
 ASSI {  920}
   (  segid "    " and resid 27   and name HG1%)
   (( segid "    " and resid 30   and name HE22))
      3.100     1.200     1.200 peak   920 spectrum    1 weight  0.10000E+01 volume  0.29377E-02 ppm1      0.973 ppm2      7.754 CV     1
 OR {  920}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 130  and name H   ))
 ASSI {  921}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 113  and name H   ))
      3.500     1.500     1.500 peak   921 spectrum    1 weight  0.10000E+01 volume  0.18949E-02 ppm1      0.949 ppm2      7.517 CV     1
 OR {  921}
   (  segid "    " and resid 27   and name HG1%)
   (( segid "    " and resid 30   and name H   ))
 OR {  921}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 117  and name H   ))
 OR {  921}
   (  segid "    " and resid 27   and name HG1%)
   (( segid "    " and resid 24   and name HD22))
 ASSI {  922}
   (  segid "    " and resid 27   and name HG1%)
   (( segid "    " and resid 30   and name H   ))
      3.700     1.700     1.700 peak   922 spectrum    1 weight  0.10000E+01 volume  0.15912E-02 ppm1      0.972 ppm2      7.491 CV     1
 OR {  922}
   (  segid "    " and resid 27   and name HG1%)
   (( segid "    " and resid 24   and name HD22))
 OR {  922}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 66   and name H   ))
 ASSI {  929}
   (  segid "    " and resid 27   and name HG1%)
   (( segid "    " and resid 30   and name HE21))
      2.800     1.000     1.000 peak   929 spectrum    1 weight  0.10000E+01 volume  0.32405E-02 ppm1      0.939 ppm2      7.069 CV     1
 OR {  929}
   (  segid "    " and resid 63   and name HG1%)
   (  segid "    " and resid 66   and name HE% )
 ASSI {  930}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 114  and name HB  ))
      3.400     1.500     1.500 peak   930 spectrum    1 weight  0.10000E+01 volume  0.86780E-03 ppm1      3.866 ppm2      2.253 CV     1
 OR {  930}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 113  and name HB3 ))
 ASSI {  932}
   (( segid "    " and resid 114  and name HB  ))
   (  segid "    " and resid 115  and name HG1%)
      3.700     1.700     1.700 peak   932 spectrum    1 weight  0.10000E+01 volume  0.11949E-02 ppm1      2.256 ppm2      1.122 CV     1
 OR {  932}
   (( segid "    " and resid 114  and name HB  ))
   (  segid "    " and resid 84   and name HD1%)
 ASSI {  934}
   (( segid "    " and resid 18   and name HB2 ))
   (  segid "    " and resid 59   and name HD1%)
      2.300     0.700     0.700 peak   934 spectrum    1 weight  0.10000E+01 volume  0.51273E-02 ppm1      1.864 ppm2      0.820 CV     1
 OR {  934}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 37   and name HD2%)
 OR {  934}
   (( segid "    " and resid 47   and name HB3 ))
   (  segid "    " and resid 37   and name HD2%)
 OR {  934}
   (( segid "    " and resid 127  and name HB2 ))
   (  segid "    " and resid 119  and name HD2%)
 ASSI {  937}
   (( segid "    " and resid 114  and name HG13))
   (  segid "    " and resid 118  and name HD1%)
      4.400     2.500     1.600 peak   937 spectrum    1 weight  0.10000E+01 volume  0.76263E-03 ppm1      1.853 ppm2      0.512 CV     1
 OR {  937}
   (( segid "    " and resid 114  and name HG13))
   (( segid "    " and resid 117  and name HD3 ))
 OR {  937}
   (( segid "    " and resid 128  and name HB3 ))
   (  segid "    " and resid 124  and name HG1%)
 ASSI {  940}
   (( segid "    " and resid 114  and name HG12))
   (( segid "    " and resid 98   and name HG  ))
      4.400     2.400     1.600 peak   940 spectrum    1 weight  0.10000E+01 volume  0.84518E-03 ppm1      1.233 ppm2      1.718 CV     1
 OR {  940}
   (( segid "    " and resid 114  and name HG12))
   (( segid "    " and resid 111  and name HG2 ))
 ASSI {  941}
   (( segid "    " and resid 114  and name HG12))
   (( segid "    " and resid 114  and name HB  ))
      3.300     1.400     1.400 peak   941 spectrum    1 weight  0.10000E+01 volume  0.10707E-02 ppm1      1.240 ppm2      2.250 CV     1
 OR {  941}
   (( segid "    " and resid 114  and name HG12))
   (( segid "    " and resid 113  and name HB3 ))
 ASSI {  943}
   (( segid "    " and resid 114  and name HG12))
   (( segid "    " and resid 84   and name HG  ))
      3.300     1.300     1.300 peak   943 spectrum    1 weight  0.10000E+01 volume  0.18391E-02 ppm1      1.242 ppm2      1.438 CV     1
 OR {  943}
   (( segid "    " and resid 114  and name HG12))
   (( segid "    " and resid 109  and name HB3 ))
 OR {  943}
   (( segid "    " and resid 114  and name HG12))
   (( segid "    " and resid 109  and name HG3 ))
 ASSI {  944}
   (( segid "    " and resid 128  and name HB3 ))
   (( segid "    " and resid 126  and name HG3 ))
      2.700     0.900     0.900 peak   944 spectrum    1 weight  0.10000E+01 volume  0.51337E-02 ppm1      1.864 ppm2      2.212 CV     1
 OR {  944}
   (( segid "    " and resid 128  and name HB3 ))
   (( segid "    " and resid 126  and name HB2 ))
 OR {  944}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 126  and name HB2 ))
 OR {  944}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 126  and name HG3 ))
 OR {  944}
   (( segid "    " and resid 128  and name HB3 ))
   (( segid "    " and resid 129  and name HB3 ))
 ASSI {  945}
   (( segid "    " and resid 114  and name HG13))
   (( segid "    " and resid 109  and name HD3 ))
      2.900     1.000     1.000 peak   945 spectrum    1 weight  0.10000E+01 volume  0.20494E-02 ppm1      1.868 ppm2      2.407 CV     1
 OR {  945}
   (( segid "    " and resid 128  and name HB3 ))
   (( segid "    " and resid 129  and name HG2 ))
 OR {  945}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 129  and name HG2 ))
 OR {  945}
   (( segid "    " and resid 128  and name HB3 ))
   (( segid "    " and resid 129  and name HG3 ))
 OR {  945}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 129  and name HG3 ))
 ASSI {  955}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 84   and name HG  ))
      3.000     1.100     1.100 peak   955 spectrum    1 weight  0.10000E+01 volume  0.51370E-02 ppm1      0.951 ppm2      1.447 CV     1
 OR {  955}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 17   and name HG  ))
 OR {  955}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 98   and name HB2 ))
 OR {  955}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 51   and name HG12))
 ASSI {  957}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 114  and name HG13))
      2.800     1.000     1.000 peak   957 spectrum    1 weight  0.10000E+01 volume  0.69693E-02 ppm1      0.949 ppm2      1.864 CV     1
 OR {  957}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 98   and name HB3 ))
 ASSI {  958}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 102  and name HE% )
      3.100     1.200     1.200 peak   958 spectrum    1 weight  0.10000E+01 volume  0.58792E-02 ppm1      0.957 ppm2      2.202 CV     1
 OR {  958}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 115  and name HB  ))
 ASSI {  959}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 104  and name HB2 ))
      4.100     2.100     1.900 peak   959 spectrum    1 weight  0.10000E+01 volume  0.11314E-02 ppm1      0.955 ppm2      2.582 CV     1
 OR {  959}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 102  and name HG3 ))
 ASSI {  963}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 76   and name HH2 ))
      3.800     1.800     1.800 peak   963 spectrum    1 weight  0.10000E+01 volume  0.14778E-02 ppm1      0.948 ppm2      6.900 CV     1
 OR {  963}
   (  segid "    " and resid 50   and name HG2%)
   (  segid "    " and resid 21   and name HD% )
 OR {  963}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 9    and name HZ2 ))
 ASSI {  964}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 88   and name HD% )
      3.600     1.600     1.600 peak   964 spectrum    1 weight  0.10000E+01 volume  0.14498E-02 ppm1      0.948 ppm2      7.090 CV     1
 OR {  964}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 76   and name HZ2 ))
 ASSI {  967}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 118  and name H   ))
      3.300     1.400     1.400 peak   967 spectrum    1 weight  0.10000E+01 volume  0.13535E-02 ppm1      0.949 ppm2      8.367 CV     1
 OR {  967}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 74   and name H   ))
 ASSI {  974}
   (( segid "    " and resid 114  and name HG13))
   (( segid "    " and resid 76   and name HZ2 ))
      4.000     2.000     2.000 peak   974 spectrum    1 weight  0.10000E+01 volume  0.80127E-03 ppm1      1.854 ppm2      7.110 CV     1
 OR {  974}
   (( segid "    " and resid 128  and name HB2 ))
   (  segid "    " and resid 131  and name HD% )
 OR {  974}
   (( segid "    " and resid 128  and name HB3 ))
   (  segid "    " and resid 131  and name HD% )
 ASSI {  975}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 113  and name H   ))
      4.500     2.500     1.500 peak   975 spectrum    1 weight  0.10000E+01 volume  0.43595E-03 ppm1      2.257 ppm2      7.556 CV     1
 OR {  975}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 117  and name H   ))
 ASSI {  980}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 115  and name H   ))
      2.100     2.100     3.900 peak   980 spectrum    1 weight  0.10000E+01 volume  0.20244E-02 ppm1      0.954 ppm2      8.566 CV     1
 OR {  980}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 102  and name H   ))
 ASSI {  981}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 110  and name H   ))
      2.400     2.400     3.600 peak   981 spectrum    1 weight  0.10000E+01 volume  0.81665E-03 ppm1      0.953 ppm2      8.377 CV     1
 OR {  981}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 74   and name H   ))
 ASSI {  984}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 76   and name HE3 ))
      2.800     2.800     3.200 peak   984 spectrum    1 weight  0.10000E+01 volume  0.36125E-03 ppm1      0.951 ppm2      7.355 CV     1
 OR {  984}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 104  and name H   ))
 ASSI {  989}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 101  and name HA  ))
      2.800     2.800     3.200 peak   989 spectrum    1 weight  0.10000E+01 volume  0.37495E-03 ppm1      0.956 ppm2      3.646 CV     1
 OR {  989}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 118  and name HA  ))
 ASSI {  990}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 115  and name HA  ))
      2.700     2.700     3.300 peak   990 spectrum    1 weight  0.10000E+01 volume  0.44170E-03 ppm1      0.955 ppm2      3.355 CV     1
 OR {  990}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 113  and name HD3 ))
 OR {  990}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 113  and name HD2 ))
 ASSI {  993}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 102  and name HG3 ))
      1.900     1.900     4.100 peak   993 spectrum    1 weight  0.10000E+01 volume  0.33249E-02 ppm1      0.953 ppm2      2.585 CV     1
 OR {  993}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 104  and name HB2 ))
 ASSI {  999}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 105  and name HG12))
      2.000     2.000     4.000 peak   999 spectrum    1 weight  0.10000E+01 volume  0.25246E-02 ppm1      0.954 ppm2      1.579 CV     1
 OR {  999}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 117  and name HB3 ))
 OR {  999}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 118  and name HB3 ))
 ASSI { 1000}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 109  and name HB3 ))
      2.700     0.900     0.900 peak  1000 spectrum    1 weight  0.10000E+01 volume  0.54778E-02 ppm1      0.954 ppm2      1.465 CV     1
 OR { 1000}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 109  and name HG3 ))
 OR { 1000}
   (  segid "    " and resid 114  and name HD1%)
   (( segid "    " and resid 84   and name HG  ))
 ASSI { 1002}
   (  segid "    " and resid 114  and name HD1%)
   (  segid "    " and resid 118  and name HD2%)
      1.900     1.900     4.100 peak  1002 spectrum    1 weight  0.10000E+01 volume  0.32205E-02 ppm1      0.954 ppm2      0.761 CV     1
 OR { 1002}
   (  segid "    " and resid 114  and name HD1%)
   (  segid "    " and resid 73   and name HD1%)
 OR { 1002}
   (  segid "    " and resid 114  and name HD1%)
   (  segid "    " and resid 121  and name HD1%)
 ASSI { 1005}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 118  and name HD2%)
      2.100     0.600     0.600 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.10968E-01 ppm1      0.945 ppm2      0.760 CV     1
 OR { 1005}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 1006}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 102  and name HG2 ))
      3.900     1.900     1.900 peak  1006 spectrum    1 weight  0.10000E+01 volume  0.84423E-03 ppm1      0.949 ppm2      2.780 CV     1
 OR { 1006}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 109  and name HD2 ))
 ASSI { 1008}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 116  and name H   ))
      3.100     1.200     1.200 peak  1008 spectrum    1 weight  0.10000E+01 volume  0.18856E-02 ppm1      4.325 ppm2      8.104 CV     1
 OR { 1008}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 114  and name H   ))
 ASSI { 1020}
   (( segid "    " and resid 113  and name HD3 ))
   (( segid "    " and resid 109  and name HD2 ))
      4.200     2.200     1.800 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.56137E-03 ppm1      3.390 ppm2      2.808 CV     1
 OR { 1020}
   (( segid "    " and resid 113  and name HD2 ))
   (( segid "    " and resid 109  and name HD2 ))
 OR { 1020}
   (( segid "    " and resid 113  and name HD3 ))
   (( segid "    " and resid 116  and name HB2 ))
 ASSI { 1025}
   (( segid "    " and resid 7    and name HG3 ))
   (  segid "    " and resid 43   and name HG1%)
      3.300     1.300     1.300 peak  1025 spectrum    1 weight  0.10000E+01 volume  0.46446E-02 ppm1      1.938 ppm2      0.736 CV     1
 OR { 1025}
   (( segid "    " and resid 44   and name HG3 ))
   (  segid "    " and resid 43   and name HG1%)
 OR { 1025}
   (( segid "    " and resid 7    and name HG2 ))
   (  segid "    " and resid 43   and name HG1%)
 OR { 1025}
   (( segid "    " and resid 44   and name HG3 ))
   (  segid "    " and resid 43   and name HG2%)
 ASSI { 1028}
   (( segid "    " and resid 7    and name HG3 ))
   (( segid "    " and resid 7    and name HB3 ))
      2.200     0.600     0.600 peak  1028 spectrum    1 weight  0.10000E+01 volume  0.91570E-02 ppm1      1.942 ppm2      2.234 CV     1
 OR { 1028}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 113  and name HB3 ))
 OR { 1028}
   (( segid "    " and resid 113  and name HG3 ))
   (( segid "    " and resid 113  and name HB2 ))
 OR { 1028}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HB3 ))
 OR { 1028}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 113  and name HB2 ))
 ASSI { 1037}
   (( segid "    " and resid 113  and name HD3 ))
   (( segid "    " and resid 110  and name H   ))
      4.600     2.600     1.400 peak  1037 spectrum    1 weight  0.10000E+01 volume  0.37032E-03 ppm1      3.372 ppm2      8.358 CV     1
 OR { 1037}
   (( segid "    " and resid 18   and name HD3 ))
   (( segid "    " and resid 18   and name H   ))
 OR { 1037}
   (( segid "    " and resid 113  and name HD2 ))
   (( segid "    " and resid 110  and name H   ))
 OR { 1037}
   (( segid "    " and resid 113  and name HD3 ))
   (( segid "    " and resid 75   and name H   ))
 OR { 1037}
   (( segid "    " and resid 113  and name HD3 ))
   (( segid "    " and resid 74   and name H   ))
 ASSI { 1038}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 112  and name H   ))
      3.700     1.700     1.700 peak  1038 spectrum    1 weight  0.10000E+01 volume  0.60978E-03 ppm1      3.998 ppm2      8.535 CV     1
 OR { 1038}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 115  and name H   ))
 ASSI { 1042}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 17   and name H   ))
      2.800     1.000     1.000 peak  1042 spectrum    1 weight  0.10000E+01 volume  0.15362E-02 ppm1      3.983 ppm2      8.735 CV     1
 OR { 1042}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name H   ))
 ASSI { 1043}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 15   and name H   ))
      3.200     1.300     1.300 peak  1043 spectrum    1 weight  0.10000E+01 volume  0.17026E-02 ppm1      3.987 ppm2      8.280 CV     1
 OR { 1043}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 18   and name H   ))
 ASSI { 1049}
   (( segid "    " and resid 110  and name HA  ))
   (  segid "    " and resid 114  and name HD1%)
      4.400     2.400     1.600 peak  1049 spectrum    1 weight  0.10000E+01 volume  0.46869E-03 ppm1      4.446 ppm2      0.944 CV     1
 OR { 1049}
   (( segid "    " and resid 110  and name HA  ))
   (  segid "    " and resid 101  and name HG2%)
 OR { 1049}
   (( segid "    " and resid 110  and name HA  ))
   (  segid "    " and resid 114  and name HG2%)
 ASSI { 1050}
   (( segid "    " and resid 110  and name HA  ))
   (  segid "    " and resid 102  and name HE% )
      3.300     1.300     1.300 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.15231E-02 ppm1      4.443 ppm2      2.162 CV     1
 OR { 1050}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 113  and name HB2 ))
 ASSI { 1055}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 59   and name H   ))
      3.700     1.700     1.700 peak  1055 spectrum    1 weight  0.10000E+01 volume  0.88720E-03 ppm1      3.994 ppm2      7.686 CV     1
 OR { 1055}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 65   and name H   ))
 ASSI { 1056}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 94   and name H   ))
      2.900     1.100     1.100 peak  1056 spectrum    1 weight  0.10000E+01 volume  0.25139E-02 ppm1      3.997 ppm2      7.864 CV     1
 OR { 1056}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 96   and name H   ))
 OR { 1056}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 35   and name H   ))
 OR { 1056}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name H   ))
 ASSI { 1058}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 63   and name H   ))
      3.300     1.400     1.400 peak  1058 spectrum    1 weight  0.10000E+01 volume  0.26203E-02 ppm1      4.001 ppm2      8.659 CV     1
 OR { 1058}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 61   and name H   ))
 ASSI { 1060}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HA  ))
      3.100     1.200     1.200 peak  1060 spectrum    1 weight  0.10000E+01 volume  0.23065E-02 ppm1      4.000 ppm2      4.580 CV     1
 OR { 1060}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI { 1063}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 61   and name HB2 ))
      3.700     1.700     1.700 peak  1063 spectrum    1 weight  0.10000E+01 volume  0.92122E-03 ppm1      4.001 ppm2      2.702 CV     1
 OR { 1063}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 31   and name HB2 ))
 OR { 1063}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 61   and name HB3 ))
 OR { 1063}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 61   and name HB2 ))
 OR { 1063}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 91   and name HB3 ))
 ASSI { 1064}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 64   and name HB2 ))
      3.000     1.100     1.100 peak  1064 spectrum    1 weight  0.10000E+01 volume  0.13113E-02 ppm1      4.000 ppm2      1.829 CV     1
 OR { 1064}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 30   and name HB3 ))
 OR { 1064}
   (( segid "    " and resid 110  and name HB3 ))
   (( segid "    " and resid 111  and name HB3 ))
 OR { 1064}
   (( segid "    " and resid 110  and name HB3 ))
   (( segid "    " and resid 109  and name HB2 ))
 ASSI { 1065}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 64   and name HD2 ))
      3.700     1.700     1.700 peak  1065 spectrum    1 weight  0.10000E+01 volume  0.17617E-02 ppm1      3.997 ppm2      1.702 CV     1
 OR { 1065}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 64   and name HD3 ))
 OR { 1065}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 64   and name HB3 ))
 OR { 1065}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HB2 ))
 OR { 1065}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 54   and name HG  ))
 ASSI { 1069}
   (( segid "    " and resid 109  and name HA  ))
   (  segid "    " and resid 114  and name HD1%)
      3.800     1.800     1.800 peak  1069 spectrum    1 weight  0.10000E+01 volume  0.15168E-02 ppm1      4.608 ppm2      0.938 CV     1
 OR { 1069}
   (( segid "    " and resid 109  and name HA  ))
   (  segid "    " and resid 74   and name HG2%)
 ASSI { 1077}
   (( segid "    " and resid 84   and name HG  ))
   (( segid "    " and resid 76   and name HZ3 ))
      3.700     1.800     1.800 peak  1077 spectrum    1 weight  0.10000E+01 volume  0.10231E-02 ppm1      1.470 ppm2      7.064 CV     1
 OR { 1077}
   (( segid "    " and resid 109  and name HG3 ))
   (( segid "    " and resid 76   and name HZ2 ))
 OR { 1077}
   (( segid "    " and resid 59   and name HG  ))
   (( segid "    " and resid 60   and name H   ))
 OR { 1077}
   (( segid "    " and resid 84   and name HG  ))
   (( segid "    " and resid 76   and name HZ2 ))
 ASSI { 1078}
   (( segid "    " and resid 84   and name HG  ))
   (( segid "    " and resid 76   and name HH2 ))
      3.700     1.700     1.700 peak  1078 spectrum    1 weight  0.10000E+01 volume  0.89790E-03 ppm1      1.475 ppm2      6.879 CV     1
 OR { 1078}
   (( segid "    " and resid 109  and name HG3 ))
   (( segid "    " and resid 76   and name HH2 ))
 OR { 1078}
   (( segid "    " and resid 59   and name HG  ))
   (  segid "    " and resid 21   and name HD% )
 OR { 1078}
   (( segid "    " and resid 17   and name HG  ))
   (  segid "    " and resid 21   and name HD% )
 OR { 1078}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 9    and name HZ2 ))
 ASSI { 1079}
   (( segid "    " and resid 59   and name HG  ))
   (( segid "    " and resid 59   and name H   ))
      3.000     1.100     1.100 peak  1079 spectrum    1 weight  0.10000E+01 volume  0.20825E-02 ppm1      1.465 ppm2      7.648 CV     1
 OR { 1079}
   (( segid "    " and resid 109  and name HG3 ))
   (( segid "    " and resid 109  and name H   ))
 ASSI { 1080}
   (( segid "    " and resid 84   and name HG  ))
   (( segid "    " and resid 84   and name H   ))
      4.800     2.900     1.200 peak  1080 spectrum    1 weight  0.10000E+01 volume  0.43858E-03 ppm1      1.470 ppm2      8.052 CV     1
 OR { 1080}
   (( segid "    " and resid 109  and name HG3 ))
   (( segid "    " and resid 114  and name H   ))
 ASSI { 1081}
   (( segid "    " and resid 59   and name HG  ))
   (( segid "    " and resid 57   and name H   ))
      4.400     2.500     1.600 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.65818E-03 ppm1      1.487 ppm2      7.874 CV     1
 OR { 1081}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 57   and name H   ))
 OR { 1081}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 40   and name H   ))
 ASSI { 1082}
   (( segid "    " and resid 109  and name HG3 ))
   (( segid "    " and resid 110  and name H   ))
      3.700     1.700     1.700 peak  1082 spectrum    1 weight  0.10000E+01 volume  0.93009E-03 ppm1      1.477 ppm2      8.326 CV     1
 OR { 1082}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 18   and name H   ))
 OR { 1082}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 54   and name H   ))
 ASSI { 1083}
   (( segid "    " and resid 73   and name HG13))
   (( segid "    " and resid 73   and name H   ))
      3.000     1.100     1.100 peak  1083 spectrum    1 weight  0.10000E+01 volume  0.15161E-02 ppm1      1.386 ppm2      8.163 CV     1
 OR { 1083}
   (( segid "    " and resid 123  and name HG  ))
   (( segid "    " and resid 121  and name H   ))
 ASSI { 1091}
   (( segid "    " and resid 73   and name HG13))
   (( segid "    " and resid 73   and name HA  ))
      3.400     1.400     1.400 peak  1091 spectrum    1 weight  0.10000E+01 volume  0.20820E-02 ppm1      1.387 ppm2      4.143 CV     1
 OR { 1091}
   (( segid "    " and resid 73   and name HG13))
   (( segid "    " and resid 71   and name HB  ))
 OR { 1091}
   (( segid "    " and resid 123  and name HG  ))
   (( segid "    " and resid 121  and name HA  ))
 ASSI { 1096}
   (( segid "    " and resid 109  and name HB3 ))
   (  segid "    " and resid 102  and name HE% )
      4.200     2.200     1.800 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.42634E-03 ppm1      1.479 ppm2      2.168 CV     1
 OR { 1096}
   (( segid "    " and resid 109  and name HB3 ))
   (( segid "    " and resid 113  and name HB3 ))
 OR { 1096}
   (( segid "    " and resid 109  and name HB3 ))
   (( segid "    " and resid 113  and name HB2 ))
 ASSI { 1097}
   (( segid "    " and resid 109  and name HB3 ))
   (  segid "    " and resid 114  and name HD1%)
      3.300     1.400     1.400 peak  1097 spectrum    1 weight  0.10000E+01 volume  0.14293E-02 ppm1      1.482 ppm2      0.955 CV     1
 OR { 1097}
   (( segid "    " and resid 109  and name HB3 ))
   (  segid "    " and resid 74   and name HG2%)
 ASSI { 1102}
   (( segid "    " and resid 73   and name HG13))
   (  segid "    " and resid 73   and name HD1%)
      1.900     0.400     0.400 peak  1102 spectrum    1 weight  0.10000E+01 volume  0.20845E-01 ppm1      1.387 ppm2      0.821 CV     1
 OR { 1102}
   (( segid "    " and resid 123  and name HG  ))
   (  segid "    " and resid 123  and name HD1%)
 OR { 1102}
   (( segid "    " and resid 73   and name HG13))
   (  segid "    " and resid 73   and name HG2%)
 ASSI { 1104}
   (( segid "    " and resid 84   and name HG  ))
   (  segid "    " and resid 84   and name HD1%)
      2.200     0.600     0.600 peak  1104 spectrum    1 weight  0.10000E+01 volume  0.66110E-02 ppm1      1.474 ppm2      1.067 CV     1
 OR { 1104}
   (( segid "    " and resid 17   and name HG  ))
   (  segid "    " and resid 17   and name HD1%)
 ASSI { 1105}
   (( segid "    " and resid 73   and name HG13))
   (( segid "    " and resid 73   and name HB  ))
      2.200     0.600     0.600 peak  1105 spectrum    1 weight  0.10000E+01 volume  0.73276E-02 ppm1      1.386 ppm2      1.777 CV     1
 OR { 1105}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 109  and name HB2 ))
 ASSI { 1106}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 17   and name HB2 ))
      2.400     0.700     0.700 peak  1106 spectrum    1 weight  0.10000E+01 volume  0.58503E-02 ppm1      1.472 ppm2      1.779 CV     1
 OR { 1106}
   (( segid "    " and resid 109  and name HG3 ))
   (( segid "    " and resid 109  and name HB2 ))
 ASSI { 1107}
   (( segid "    " and resid 59   and name HG  ))
   (  segid "    " and resid 57   and name HE% )
      2.400     0.700     0.700 peak  1107 spectrum    1 weight  0.10000E+01 volume  0.33077E-02 ppm1      1.473 ppm2      1.986 CV     1
 OR { 1107}
   (( segid "    " and resid 84   and name HG  ))
   (( segid "    " and resid 84   and name HB3 ))
 OR { 1107}
   (( segid "    " and resid 17   and name HG  ))
   (  segid "    " and resid 57   and name HE% )
 ASSI { 1109}
   (( segid "    " and resid 109  and name HG2 ))
   (  segid "    " and resid 102  and name HE% )
      3.800     1.800     1.800 peak  1109 spectrum    1 weight  0.10000E+01 volume  0.71796E-03 ppm1      1.388 ppm2      2.165 CV     1
 OR { 1109}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 113  and name HB3 ))
 OR { 1109}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 113  and name HB2 ))
 ASSI { 1110}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 17   and name HB3 ))
      2.800     1.000     1.000 peak  1110 spectrum    1 weight  0.10000E+01 volume  0.26154E-02 ppm1      1.472 ppm2      2.168 CV     1
 OR { 1110}
   (( segid "    " and resid 59   and name HG  ))
   (( segid "    " and resid 57   and name HG3 ))
 OR { 1110}
   (( segid "    " and resid 59   and name HG  ))
   (( segid "    " and resid 57   and name HB2 ))
 OR { 1110}
   (( segid "    " and resid 109  and name HG3 ))
   (  segid "    " and resid 102  and name HE% )
 OR { 1110}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 53   and name HB2 ))
 OR { 1110}
   (( segid "    " and resid 84   and name HG  ))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI { 1116}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 17   and name HA  ))
      3.300     1.300     1.300 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.17264E-02 ppm1      1.481 ppm2      3.969 CV     1
 OR { 1116}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 14   and name HA  ))
 OR { 1116}
   (( segid "    " and resid 84   and name HG  ))
   (( segid "    " and resid 81   and name HA  ))
 OR { 1116}
   (( segid "    " and resid 109  and name HG3 ))
   (( segid "    " and resid 110  and name HB3 ))
 OR { 1116}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 37   and name HA  ))
 ASSI { 1117}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 18   and name HA  ))
      3.700     1.700     1.700 peak  1117 spectrum    1 weight  0.10000E+01 volume  0.93299E-03 ppm1      1.480 ppm2      3.801 CV     1
 OR { 1117}
   (( segid "    " and resid 59   and name HG  ))
   (( segid "    " and resid 18   and name HA  ))
 OR { 1117}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 50   and name HA  ))
 ASSI { 1118}
   (( segid "    " and resid 59   and name HG  ))
   (( segid "    " and resid 54   and name HA  ))
      4.200     2.200     1.800 peak  1118 spectrum    1 weight  0.10000E+01 volume  0.88145E-03 ppm1      1.474 ppm2      3.693 CV     1
 OR { 1118}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 54   and name HA  ))
 ASSI { 1121}
   (( segid "    " and resid 109  and name HD2 ))
   (  segid "    " and resid 105  and name HD1%)
      3.400     1.400     1.400 peak  1121 spectrum    1 weight  0.10000E+01 volume  0.11013E-02 ppm1      2.788 ppm2      1.048 CV     1
 OR { 1121}
   (( segid "    " and resid 109  and name HD2 ))
   (  segid "    " and resid 84   and name HD1%)
 ASSI { 1122}
   (( segid "    " and resid 109  and name HD2 ))
   (  segid "    " and resid 74   and name HG2%)
      3.100     1.200     1.200 peak  1122 spectrum    1 weight  0.10000E+01 volume  0.18535E-02 ppm1      2.788 ppm2      0.947 CV     1
 OR { 1122}
   (( segid "    " and resid 109  and name HD2 ))
   (  segid "    " and resid 114  and name HD1%)
 ASSI { 1125}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 109  and name HG2 ))
      2.900     1.000     1.000 peak  1125 spectrum    1 weight  0.10000E+01 volume  0.16630E-02 ppm1      2.791 ppm2      1.375 CV     1
 OR { 1125}
   (( segid "    " and resid 45   and name HD3 ))
   (( segid "    " and resid 45   and name HG3 ))
 ASSI { 1131}
   (( segid "    " and resid 109  and name HD3 ))
   (  segid "    " and resid 105  and name HD1%)
      3.300     1.300     1.300 peak  1131 spectrum    1 weight  0.10000E+01 volume  0.14903E-02 ppm1      2.425 ppm2      1.046 CV     1
 OR { 1131}
   (( segid "    " and resid 109  and name HD3 ))
   (  segid "    " and resid 84   and name HD1%)
 ASSI { 1132}
   (( segid "    " and resid 109  and name HD3 ))
   (  segid "    " and resid 74   and name HG2%)
      3.000     1.100     1.100 peak  1132 spectrum    1 weight  0.10000E+01 volume  0.22247E-02 ppm1      2.423 ppm2      0.951 CV     1
 OR { 1132}
   (( segid "    " and resid 109  and name HD3 ))
   (  segid "    " and resid 114  and name HD1%)
 ASSI { 1140}
   (( segid "    " and resid 5    and name HB2 ))
   (( segid "    " and resid 5    and name H   ))
      2.700     0.900     0.900 peak  1140 spectrum    1 weight  0.10000E+01 volume  0.29121E-02 ppm1      1.732 ppm2      8.180 CV     1
 OR { 1140}
   (( segid "    " and resid 108  and name HB2 ))
   (( segid "    " and resid 108  and name H   ))
 OR { 1140}
   (( segid "    " and resid 108  and name HB3 ))
   (( segid "    " and resid 108  and name H   ))
 ASSI { 1150}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 7    and name HD2 ))
      3.400     1.500     1.500 peak  1150 spectrum    1 weight  0.10000E+01 volume  0.17184E-02 ppm1      1.720 ppm2      3.809 CV     1
 OR { 1150}
   (( segid "    " and resid 64   and name HB3 ))
   (( segid "    " and resid 62   and name HB3 ))
 ASSI { 1154}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 135  and name HG3 ))
      3.200     1.300     1.300 peak  1154 spectrum    1 weight  0.10000E+01 volume  0.26517E-02 ppm1      1.462 ppm2      2.397 CV     1
 OR { 1154}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 135  and name HG2 ))
 OR { 1154}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 135  and name HG3 ))
 OR { 1154}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 135  and name HG2 ))
 OR { 1154}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 65   and name HB3 ))
 OR { 1154}
   (( segid "    " and resid 64   and name HG3 ))
   (( segid "    " and resid 65   and name HB3 ))
 ASSI { 1156}
   (( segid "    " and resid 105  and name HG12))
   (  segid "    " and resid 105  and name HD1%)
      2.100     0.500     0.500 peak  1156 spectrum    1 weight  0.10000E+01 volume  0.96163E-02 ppm1      1.591 ppm2      1.035 CV     1
 OR { 1156}
   (( segid "    " and resid 105  and name HG12))
   (  segid "    " and resid 105  and name HG2%)
 OR { 1156}
   (( segid "    " and resid 105  and name HG12))
   (  segid "    " and resid 101  and name HG2%)
 ASSI { 1157}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 50   and name HB  ))
      2.800     1.000     1.000 peak  1157 spectrum    1 weight  0.10000E+01 volume  0.35626E-02 ppm1      1.615 ppm2      2.170 CV     1
 OR { 1157}
   (( segid "    " and resid 111  and name HG3 ))
   (  segid "    " and resid 102  and name HE% )
 OR { 1157}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 53   and name HB2 ))
 OR { 1157}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 17   and name HB3 ))
 OR { 1157}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 49   and name HB3 ))
 ASSI { 1158}
   (( segid "    " and resid 111  and name HG3 ))
   (( segid "    " and resid 111  and name HB3 ))
      2.700     0.900     0.900 peak  1158 spectrum    1 weight  0.10000E+01 volume  0.60976E-02 ppm1      1.624 ppm2      1.845 CV     1
 OR { 1158}
   (( segid "    " and resid 111  and name HG3 ))
   (( segid "    " and resid 98   and name HB3 ))
 OR { 1158}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 37   and name HB3 ))
 ASSI { 1161}
   (( segid "    " and resid 111  and name HG3 ))
   (( segid "    " and resid 111  and name HA  ))
      3.300     1.400     1.400 peak  1161 spectrum    1 weight  0.10000E+01 volume  0.24146E-02 ppm1      1.612 ppm2      3.977 CV     1
 OR { 1161}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 37   and name HA  ))
 OR { 1161}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 17   and name HA  ))
 ASSI { 1162}
   (( segid "    " and resid 108  and name HD3 ))
   (( segid "    " and resid 108  and name HA  ))
      3.100     1.200     1.200 peak  1162 spectrum    1 weight  0.10000E+01 volume  0.43804E-02 ppm1      1.596 ppm2      4.076 CV     1
 OR { 1162}
   (( segid "    " and resid 108  and name HD2 ))
   (( segid "    " and resid 108  and name HA  ))
 OR { 1162}
   (( segid "    " and resid 105  and name HG12))
   (( segid "    " and resid 106  and name HA  ))
 ASSI { 1166}
   (( segid "    " and resid 105  and name HG12))
   (( segid "    " and resid 105  and name H   ))
      4.300     2.300     1.700 peak  1166 spectrum    1 weight  0.10000E+01 volume  0.76930E-03 ppm1      1.568 ppm2      8.113 CV     1
 OR { 1166}
   (( segid "    " and resid 127  and name HG3 ))
   (( segid "    " and resid 116  and name H   ))
 OR { 1166}
   (( segid "    " and resid 50   and name HG12))
   (( segid "    " and resid 36   and name H   ))
 ASSI { 1168}
   (( segid "    " and resid 111  and name HG3 ))
   (( segid "    " and resid 112  and name H   ))
      4.600     2.600     1.400 peak  1168 spectrum    1 weight  0.10000E+01 volume  0.62975E-03 ppm1      1.617 ppm2      8.545 CV     1
 OR { 1168}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 37   and name H   ))
 OR { 1168}
   (( segid "    " and resid 111  and name HG3 ))
   (( segid "    " and resid 98   and name H   ))
 ASSI { 1169}
   (( segid "    " and resid 107  and name HA  ))
   (  segid "    " and resid 74   and name HG1%)
      4.400     2.400     1.600 peak  1169 spectrum    1 weight  0.10000E+01 volume  0.52559E-03 ppm1      4.467 ppm2      0.822 CV     1
 OR { 1169}
   (( segid "    " and resid 107  and name HA  ))
   (  segid "    " and resid 73   and name HG2%)
 ASSI { 1172}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 105  and name HG12))
      4.400     2.400     1.600 peak  1172 spectrum    1 weight  0.10000E+01 volume  0.73206E-03 ppm1      4.455 ppm2      1.598 CV     1
 OR { 1172}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 108  and name HD2 ))
 ASSI { 1173}
   (  segid "    " and resid 107  and name HB% )
   (  segid "    " and resid 74   and name HG1%)
      2.900     1.000     1.000 peak  1173 spectrum    1 weight  0.10000E+01 volume  0.46146E-02 ppm1      1.157 ppm2      0.832 CV     1
 OR { 1173}
   (  segid "    " and resid 107  and name HB% )
   (  segid "    " and resid 73   and name HG2%)
 ASSI { 1176}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 80   and name HG3 ))
      3.600     1.600     1.600 peak  1176 spectrum    1 weight  0.10000E+01 volume  0.62206E-03 ppm1      1.158 ppm2      2.779 CV     1
 OR { 1176}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 109  and name HD2 ))
 ASSI { 1178}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 80   and name HB3 ))
      2.700     2.700     3.300 peak  1178 spectrum    1 weight  0.10000E+01 volume  0.72699E-03 ppm1      1.154 ppm2      2.553 CV     1
 OR { 1178}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 102  and name HG3 ))
 ASSI { 1182}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 105  and name HB  ))
      2.500     2.500     3.500 peak  1182 spectrum    1 weight  0.10000E+01 volume  0.81387E-03 ppm1      1.154 ppm2      1.967 CV     1
 OR { 1182}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 111  and name HB2 ))
 ASSI { 1183}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 84   and name HB2 ))
      3.200     1.300     1.300 peak  1183 spectrum    1 weight  0.10000E+01 volume  0.27432E-02 ppm1      1.157 ppm2      1.744 CV     1
 OR { 1183}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 109  and name HB2 ))
 OR { 1183}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 108  and name HB2 ))
 ASSI { 1185}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 105  and name HG13))
      3.000     1.100     1.100 peak  1185 spectrum    1 weight  0.10000E+01 volume  0.63349E-02 ppm1      1.157 ppm2      1.433 CV     1
 OR { 1185}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 109  and name HG3 ))
 ASSI { 1186}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 108  and name HA  ))
      4.000     2.000     2.000 peak  1186 spectrum    1 weight  0.10000E+01 volume  0.78851E-03 ppm1      4.466 ppm2      4.076 CV     1
 OR { 1186}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 106  and name HA  ))
 ASSI { 1187}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 84   and name HA  ))
      2.800     2.800     3.200 peak  1187 spectrum    1 weight  0.10000E+01 volume  0.89873E-03 ppm1      1.161 ppm2      4.157 CV     1
 OR { 1187}
   (  segid "    " and resid 107  and name HB% )
   (( segid "    " and resid 73   and name HA  ))
 ASSI { 1221}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 84   and name H   ))
      2.500     2.500     3.500 peak  1221 spectrum    1 weight  0.10000E+01 volume  0.82731E-03 ppm1      1.310 ppm2      8.069 CV     1
 OR { 1221}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 83   and name H   ))
 OR { 1221}
   (  segid "    " and resid 106  and name HG2%)
   (( segid "    " and resid 114  and name H   ))
 ASSI { 1237}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 105  and name H   ))
      3.600     1.700     1.700 peak  1237 spectrum    1 weight  0.10000E+01 volume  0.23932E-02 ppm1      1.047 ppm2      8.078 CV     1
 OR { 1237}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 105  and name H   ))
 ASSI { 1238}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 76   and name HE3 ))
      4.100     2.100     1.900 peak  1238 spectrum    1 weight  0.10000E+01 volume  0.65570E-03 ppm1      1.044 ppm2      7.362 CV     1
 OR { 1238}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 104  and name H   ))
 ASSI { 1244}
   (( segid "    " and resid 105  and name HA  ))
   (  segid "    " and resid 87   and name HD2%)
      3.000     1.100     1.100 peak  1244 spectrum    1 weight  0.10000E+01 volume  0.39078E-02 ppm1      4.222 ppm2      1.041 CV     1
 OR { 1244}
   (( segid "    " and resid 105  and name HA  ))
   (  segid "    " and resid 105  and name HG2%)
 OR { 1244}
   (( segid "    " and resid 105  and name HA  ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI { 1245}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HG13))
      3.100     1.200     1.200 peak  1245 spectrum    1 weight  0.10000E+01 volume  0.86896E-03 ppm1      4.235 ppm2      1.355 CV     1
 OR { 1245}
   (( segid "    " and resid 105  and name HA  ))
   (  segid "    " and resid 106  and name HG2%)
 ASSI { 1249}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 87   and name HB2 ))
      4.100     2.100     1.900 peak  1249 spectrum    1 weight  0.10000E+01 volume  0.42413E-03 ppm1      4.230 ppm2      2.232 CV     1
 OR { 1249}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 83   and name HB3 ))
 ASSI { 1250}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 104  and name HB3 ))
      4.000     2.000     2.000 peak  1250 spectrum    1 weight  0.10000E+01 volume  0.87677E-03 ppm1      4.240 ppm2      2.895 CV     1
 OR { 1250}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 9    and name HB3 ))
 OR { 1250}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 9    and name HB2 ))
 ASSI { 1255}
   (( segid "    " and resid 105  and name HB  ))
   (( segid "    " and resid 102  and name HA  ))
      4.800     2.900     1.200 peak  1255 spectrum    1 weight  0.10000E+01 volume  0.24241E-03 ppm1      1.955 ppm2      4.065 CV     1
 OR { 1255}
   (( segid "    " and resid 105  and name HB  ))
   (( segid "    " and resid 106  and name HA  ))
 ASSI { 1258}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 105  and name HG13))
      2.200     0.600     0.600 peak  1258 spectrum    1 weight  0.10000E+01 volume  0.73262E-02 ppm1      1.049 ppm2      1.419 CV     1
 OR { 1258}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 84   and name HG  ))
 OR { 1258}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 98   and name HB2 ))
 ASSI { 1259}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 105  and name HB  ))
      2.500     0.800     0.800 peak  1259 spectrum    1 weight  0.10000E+01 volume  0.48922E-02 ppm1      1.048 ppm2      1.970 CV     1
 OR { 1259}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 105  and name HB  ))
 ASSI { 1261}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 108  and name HB3 ))
      3.500     1.500     1.500 peak  1261 spectrum    1 weight  0.10000E+01 volume  0.24666E-02 ppm1      1.035 ppm2      1.713 CV     1
 OR { 1261}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 108  and name HB2 ))
 OR { 1261}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 111  and name HG2 ))
 ASSI { 1264}
   (  segid "    " and resid 105  and name HG2%)
   (  segid "    " and resid 102  and name HE% )
      2.900     1.000     1.000 peak  1264 spectrum    1 weight  0.10000E+01 volume  0.33466E-02 ppm1      1.032 ppm2      2.159 CV     1
 OR { 1264}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 87   and name HG  ))
 ASSI { 1267}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 102  and name HG2 ))
      4.200     2.200     1.800 peak  1267 spectrum    1 weight  0.10000E+01 volume  0.79525E-03 ppm1      1.031 ppm2      2.756 CV     1
 OR { 1267}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 109  and name HD2 ))
 ASSI { 1271}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 102  and name HA  ))
      2.500     0.800     0.800 peak  1271 spectrum    1 weight  0.10000E+01 volume  0.49791E-02 ppm1      1.031 ppm2      4.061 CV     1
 OR { 1271}
   (  segid "    " and resid 105  and name HG2%)
   (( segid "    " and resid 106  and name HA  ))
 ASSI { 1276}
   (( segid "    " and resid 31   and name HB3 ))
   (( segid "    " and resid 67   and name H   ))
      3.400     1.400     1.400 peak  1276 spectrum    1 weight  0.10000E+01 volume  0.10806E-02 ppm1      2.888 ppm2      7.759 CV     1
 OR { 1276}
   (( segid "    " and resid 31   and name HB3 ))
   (( segid "    " and resid 30   and name HE22))
 ASSI { 1280}
   (( segid "    " and resid 31   and name HB3 ))
   (  segid "    " and resid 66   and name HE% )
      4.200     2.200     1.800 peak  1280 spectrum    1 weight  0.10000E+01 volume  0.50524E-03 ppm1      2.891 ppm2      7.076 CV     1
 OR { 1280}
   (( segid "    " and resid 31   and name HB3 ))
   (( segid "    " and resid 30   and name HE21))
 ASSI { 1281}
   (( segid "    " and resid 103  and name HE3 ))
   (( segid "    " and resid 100  and name HA  ))
      3.500     1.600     1.600 peak  1281 spectrum    1 weight  0.10000E+01 volume  0.15946E-02 ppm1      2.889 ppm2      3.933 CV     1
 OR { 1281}
   (( segid "    " and resid 103  and name HE2 ))
   (( segid "    " and resid 100  and name HA  ))
 OR { 1281}
   (( segid "    " and resid 31   and name HB3 ))
   (( segid "    " and resid 34   and name HA  ))
 ASSI { 1290}
   (( segid "    " and resid 103  and name HE2 ))
   (( segid "    " and resid 102  and name HB2 ))
      3.200     1.300     1.300 peak  1290 spectrum    1 weight  0.10000E+01 volume  0.10941E-02 ppm1      2.887 ppm2      2.097 CV     1
 OR { 1290}
   (( segid "    " and resid 103  and name HE3 ))
   (( segid "    " and resid 102  and name HB2 ))
 OR { 1290}
   (( segid "    " and resid 31   and name HB3 ))
   (( segid "    " and resid 30   and name HG2 ))
 ASSI { 1303}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 114  and name H   ))
      4.100     2.100     1.900 peak  1303 spectrum    1 weight  0.10000E+01 volume  0.87807E-03 ppm1      2.158 ppm2      8.093 CV     1
 OR { 1303}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 105  and name H   ))
 ASSI { 1309}
   (( segid "    " and resid 27   and name HB  ))
   (( segid "    " and resid 30   and name H   ))
      4.300     2.300     1.700 peak  1309 spectrum    1 weight  0.10000E+01 volume  0.95329E-03 ppm1      2.109 ppm2      7.479 CV     1
 OR { 1309}
   (( segid "    " and resid 27   and name HB  ))
   (( segid "    " and resid 24   and name HD22))
 ASSI { 1312}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 103  and name H   ))
      3.400     1.500     1.500 peak  1312 spectrum    1 weight  0.10000E+01 volume  0.12983E-02 ppm1      4.048 ppm2      7.437 CV     1
 OR { 1312}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 131  and name H   ))
 ASSI { 1314}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 110  and name HB2 ))
      4.300     2.300     1.700 peak  1314 spectrum    1 weight  0.10000E+01 volume  0.75341E-03 ppm1      2.159 ppm2      4.283 CV     1
 OR { 1314}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 113  and name HA  ))
 ASSI { 1315}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 102  and name HA  ))
      2.400     0.700     0.700 peak  1315 spectrum    1 weight  0.10000E+01 volume  0.62451E-02 ppm1      2.159 ppm2      4.021 CV     1
 OR { 1315}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 111  and name HA  ))
 ASSI { 1316}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 101  and name HA  ))
      4.200     2.200     1.800 peak  1316 spectrum    1 weight  0.10000E+01 volume  0.10513E-02 ppm1      2.160 ppm2      3.624 CV     1
 OR { 1316}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 99   and name HA3 ))
 ASSI { 1319}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 103  and name HE2 ))
      4.100     2.100     1.900 peak  1319 spectrum    1 weight  0.10000E+01 volume  0.79666E-03 ppm1      2.159 ppm2      2.891 CV     1
 OR { 1319}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 104  and name HB3 ))
 ASSI { 1323}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 111  and name HG2 ))
      2.400     0.700     0.700 peak  1323 spectrum    1 weight  0.10000E+01 volume  0.62366E-02 ppm1      2.159 ppm2      1.745 CV     1
 OR { 1323}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 98   and name HG  ))
 ASSI { 1325}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 109  and name HB3 ))
      3.200     1.200     1.200 peak  1325 spectrum    1 weight  0.10000E+01 volume  0.41833E-02 ppm1      2.159 ppm2      1.444 CV     1
 OR { 1325}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 109  and name HG3 ))
 OR { 1325}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 98   and name HB2 ))
 OR { 1325}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 105  and name HG13))
 OR { 1325}
   (  segid "    " and resid 102  and name HE% )
   (( segid "    " and resid 84   and name HG  ))
 ASSI { 1327}
   (  segid "    " and resid 102  and name HE% )
   (  segid "    " and resid 114  and name HD1%)
      2.100     0.600     0.600 peak  1327 spectrum    1 weight  0.10000E+01 volume  0.11530E-01 ppm1      2.159 ppm2      0.956 CV     1
 OR { 1327}
   (  segid "    " and resid 102  and name HE% )
   (  segid "    " and resid 101  and name HG2%)
 ASSI { 1328}
   (( segid "    " and resid 102  and name HG2 ))
   (  segid "    " and resid 101  and name HG2%)
      3.300     1.400     1.400 peak  1328 spectrum    1 weight  0.10000E+01 volume  0.30192E-02 ppm1      2.737 ppm2      0.959 CV     1
 OR { 1328}
   (( segid "    " and resid 102  and name HG2 ))
   (  segid "    " and resid 114  and name HD1%)
 ASSI { 1329}
   (( segid "    " and resid 102  and name HG3 ))
   (  segid "    " and resid 101  and name HG2%)
      3.900     1.900     1.900 peak  1329 spectrum    1 weight  0.10000E+01 volume  0.32351E-02 ppm1      2.583 ppm2      0.957 CV     1
 OR { 1329}
   (( segid "    " and resid 102  and name HG3 ))
   (  segid "    " and resid 114  and name HD1%)
 ASSI { 1335}
   (( segid "    " and resid 102  and name HA  ))
   (  segid "    " and resid 105  and name HG2%)
      2.400     0.700     0.700 peak  1335 spectrum    1 weight  0.10000E+01 volume  0.63802E-02 ppm1      4.046 ppm2      1.021 CV     1
 OR { 1335}
   (( segid "    " and resid 102  and name HA  ))
   (  segid "    " and resid 101  and name HG2%)
 OR { 1335}
   (( segid "    " and resid 102  and name HA  ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI { 1336}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 23   and name HB% )
      3.400     1.400     1.400 peak  1336 spectrum    1 weight  0.10000E+01 volume  0.30277E-02 ppm1      4.025 ppm2      1.449 CV     1
 OR { 1336}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 22   and name HB3 ))
 OR { 1336}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 35   and name HB% )
 OR { 1336}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 17   and name HG  ))
 OR { 1336}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 51   and name HG12))
 ASSI { 1339}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HB3 ))
      2.400     0.700     0.700 peak  1339 spectrum    1 weight  0.10000E+01 volume  0.10170E-01 ppm1      4.022 ppm2      2.239 CV     1
 OR { 1339}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HB3 ))
 OR { 1339}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HB2 ))
 OR { 1339}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HB2 ))
 OR { 1339}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HG3 ))
 ASSI { 1341}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HG2 ))
      3.300     1.400     1.400 peak  1341 spectrum    1 weight  0.10000E+01 volume  0.12461E-02 ppm1      4.045 ppm2      2.738 CV     1
 OR { 1341}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HG3 ))
 OR { 1341}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HG2 ))
 ASSI { 1342}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HB3 ))
      3.400     1.500     1.500 peak  1342 spectrum    1 weight  0.10000E+01 volume  0.14251E-02 ppm1      4.044 ppm2      2.583 CV     1
 OR { 1342}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HG3 ))
 ASSI { 1348}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 98   and name H   ))
      3.800     1.800     1.800 peak  1348 spectrum    1 weight  0.10000E+01 volume  0.19196E-02 ppm1      1.019 ppm2      8.585 CV     1
 OR { 1348}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 37   and name H   ))
 OR { 1348}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 102  and name H   ))
 OR { 1348}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 22   and name H   ))
 ASSI { 1349}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 37   and name H   ))
      3.700     1.800     1.800 peak  1349 spectrum    1 weight  0.10000E+01 volume  0.61268E-03 ppm1      3.591 ppm2      8.587 CV     1
 OR { 1349}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 102  and name H   ))
 ASSI { 1351}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 88   and name H   ))
      3.000     3.000     3.000 peak  1351 spectrum    1 weight  0.10000E+01 volume  0.45715E-03 ppm1      0.972 ppm2      8.899 CV     1
 OR { 1351}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 125  and name H   ))
 ASSI { 1352}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 88   and name H   ))
      3.400     1.400     1.400 peak  1352 spectrum    1 weight  0.10000E+01 volume  0.12285E-02 ppm1      1.019 ppm2      8.907 CV     1
 OR { 1352}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 21   and name H   ))
 ASSI { 1355}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 103  and name H   ))
      4.200     2.200     1.800 peak  1355 spectrum    1 weight  0.10000E+01 volume  0.75779E-03 ppm1      0.987 ppm2      7.500 CV     1
 OR { 1355}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 80   and name HE21))
 ASSI { 1356}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 104  and name H   ))
      4.300     2.300     1.700 peak  1356 spectrum    1 weight  0.10000E+01 volume  0.55095E-03 ppm1      0.970 ppm2      7.327 CV     1
 OR { 1356}
   (  segid "    " and resid 101  and name HG2%)
   (  segid "    " and resid 91   and name HE% )
 ASSI { 1357}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 88   and name HD% )
      3.700     1.700     1.700 peak  1357 spectrum    1 weight  0.10000E+01 volume  0.12998E-02 ppm1      0.972 ppm2      7.060 CV     1
 OR { 1357}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 76   and name HZ2 ))
 OR { 1357}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 76   and name HZ2 ))
 OR { 1357}
   (  segid "    " and resid 101  and name HG2%)
   (  segid "    " and resid 88   and name HD% )
 ASSI { 1358}
   (  segid "    " and resid 101  and name HD1%)
   (  segid "    " and resid 88   and name HD% )
      2.900     1.100     1.100 peak  1358 spectrum    1 weight  0.10000E+01 volume  0.33893E-02 ppm1      1.024 ppm2      7.047 CV     1
 OR { 1358}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 76   and name HZ3 ))
 OR { 1358}
   (  segid "    " and resid 36   and name HD1%)
   (  segid "    " and resid 66   and name HE% )
 ASSI { 1360}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 35   and name H   ))
      4.200     2.200     1.800 peak  1360 spectrum    1 weight  0.10000E+01 volume  0.79745E-03 ppm1      1.016 ppm2      7.862 CV     1
 OR { 1360}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 99   and name H   ))
 ASSI { 1361}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 100  and name H   ))
      2.800     2.800     3.200 peak  1361 spectrum    1 weight  0.10000E+01 volume  0.79028E-03 ppm1      1.023 ppm2      7.753 CV     1
 OR { 1361}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 91   and name H   ))
 OR { 1361}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 130  and name H   ))
 OR { 1361}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 49   and name H   ))
 ASSI { 1364}
   (  segid "    " and resid 101  and name HD1%)
   (  segid "    " and resid 118  and name HD2%)
      3.100     1.200     1.200 peak  1364 spectrum    1 weight  0.10000E+01 volume  0.54297E-02 ppm1      1.020 ppm2      0.769 CV     1
 OR { 1364}
   (  segid "    " and resid 36   and name HD1%)
   (  segid "    " and resid 17   and name HD2%)
 OR { 1364}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 54   and name HB2 ))
 OR { 1364}
   (  segid "    " and resid 36   and name HD1%)
   (  segid "    " and resid 51   and name HD1%)
 OR { 1364}
   (  segid "    " and resid 101  and name HD1%)
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 1365}
   (  segid "    " and resid 101  and name HD1%)
   (  segid "    " and resid 84   and name HD2%)
      3.000     3.000     3.000 peak  1365 spectrum    1 weight  0.10000E+01 volume  0.35774E-02 ppm1      1.018 ppm2      0.620 CV     1
 OR { 1365}
   (  segid "    " and resid 105  and name HD1%)
   (  segid "    " and resid 84   and name HD2%)
 OR { 1365}
   (  segid "    " and resid 36   and name HD1%)
   (  segid "    " and resid 20   and name HD1%)
 OR { 1365}
   (  segid "    " and resid 36   and name HD1%)
   (  segid "    " and resid 20   and name HD2%)
 ASSI { 1367}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 84   and name HB2 ))
      2.700     0.900     0.900 peak  1367 spectrum    1 weight  0.10000E+01 volume  0.33634E-02 ppm1      1.046 ppm2      1.831 CV     1
 OR { 1367}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 98   and name HB3 ))
 OR { 1367}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 114  and name HG13))
 OR { 1367}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 114  and name HG13))
 ASSI { 1368}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 84   and name HB2 ))
      2.700     0.900     0.900 peak  1368 spectrum    1 weight  0.10000E+01 volume  0.24408E-02 ppm1      1.030 ppm2      1.762 CV     1
 OR { 1368}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 54   and name HG  ))
 OR { 1368}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 109  and name HB2 ))
 OR { 1368}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 111  and name HG2 ))
 ASSI { 1370}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 109  and name HD2 ))
      3.900     1.900     1.900 peak  1370 spectrum    1 weight  0.10000E+01 volume  0.93948E-03 ppm1      1.044 ppm2      2.767 CV     1
 OR { 1370}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 80   and name HG3 ))
 OR { 1370}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 102  and name HG2 ))
 ASSI { 1371}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 102  and name HG3 ))
      3.800     1.800     1.800 peak  1371 spectrum    1 weight  0.10000E+01 volume  0.84829E-03 ppm1      1.026 ppm2      2.572 CV     1
 OR { 1371}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 102  and name HG3 ))
 ASSI { 1372}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 109  and name HD3 ))
      3.400     1.400     1.400 peak  1372 spectrum    1 weight  0.10000E+01 volume  0.15506E-02 ppm1      1.047 ppm2      2.424 CV     1
 OR { 1372}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 89   and name HG2 ))
 ASSI { 1374}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 98   and name HA  ))
      2.200     0.600     0.600 peak  1374 spectrum    1 weight  0.10000E+01 volume  0.45024E-02 ppm1      1.018 ppm2      3.981 CV     1
 OR { 1374}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 21   and name HA  ))
 OR { 1374}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 88   and name HA  ))
 ASSI { 1375}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 33   and name HA  ))
      2.200     0.600     0.600 peak  1375 spectrum    1 weight  0.10000E+01 volume  0.33977E-02 ppm1      1.016 ppm2      3.624 CV     1
 OR { 1375}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 101  and name HA  ))
 OR { 1375}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 36   and name HA  ))
 ASSI { 1376}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 91   and name HB2 ))
      4.000     2.000     2.000 peak  1376 spectrum    1 weight  0.10000E+01 volume  0.60898E-03 ppm1      1.014 ppm2      3.364 CV     1
 OR { 1376}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 115  and name HA  ))
 OR { 1376}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 66   and name HB3 ))
 ASSI { 1378}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 102  and name HA  ))
      3.200     1.300     1.300 peak  1378 spectrum    1 weight  0.10000E+01 volume  0.27373E-02 ppm1      0.984 ppm2      4.014 CV     1
 OR { 1378}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 98   and name HA  ))
 ASSI { 1379}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 102  and name HG2 ))
      3.700     1.800     1.800 peak  1379 spectrum    1 weight  0.10000E+01 volume  0.10971E-02 ppm1      0.977 ppm2      2.738 CV     1
 OR { 1379}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 109  and name HD2 ))
 ASSI { 1382}
   (( segid "    " and resid 36   and name HB  ))
   (  segid "    " and resid 36   and name HG2%)
      2.300     0.700     0.700 peak  1382 spectrum    1 weight  0.10000E+01 volume  0.47906E-02 ppm1      2.050 ppm2      1.002 CV     1
 OR { 1382}
   (( segid "    " and resid 101  and name HB  ))
   (  segid "    " and resid 101  and name HG2%)
 OR { 1382}
   (( segid "    " and resid 36   and name HB  ))
   (  segid "    " and resid 36   and name HD1%)
 OR { 1382}
   (( segid "    " and resid 101  and name HB  ))
   (  segid "    " and resid 101  and name HD1%)
 ASSI { 1383}
   (( segid "    " and resid 36   and name HB  ))
   (  segid "    " and resid 36   and name HG2%)
      2.200     0.600     0.600 peak  1383 spectrum    1 weight  0.10000E+01 volume  0.62305E-02 ppm1      2.102 ppm2      0.984 CV     1
 OR { 1383}
   (( segid "    " and resid 36   and name HB  ))
   (  segid "    " and resid 36   and name HD1%)
 OR { 1383}
   (( segid "    " and resid 36   and name HB  ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI { 1385}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 98   and name HA  ))
      4.600     2.700     1.400 peak  1385 spectrum    1 weight  0.10000E+01 volume  0.56991E-03 ppm1      3.581 ppm2      3.967 CV     1
 OR { 1385}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 100  and name HA  ))
 OR { 1385}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 21   and name HA  ))
 OR { 1385}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 88   and name HA  ))
 OR { 1385}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 37   and name HA  ))
 ASSI { 1386}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 36   and name HG12))
      4.000     2.000     2.000 peak  1386 spectrum    1 weight  0.10000E+01 volume  0.13429E-02 ppm1      3.623 ppm2      2.228 CV     1
 OR { 1386}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 87   and name HB2 ))
 OR { 1386}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 50   and name HB  ))
 ASSI { 1391}
   (( segid "    " and resid 100  and name HB2 ))
   (  segid "    " and resid 91   and name HD% )
      3.600     1.600     1.600 peak  1391 spectrum    1 weight  0.10000E+01 volume  0.63103E-03 ppm1      2.293 ppm2      7.074 CV     1
 OR { 1391}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 100  and name HD2 ))
 ASSI { 1394}
   (( segid "    " and resid 100  and name HD2 ))
   (( segid "    " and resid 99   and name H   ))
      4.100     2.100     1.900 peak  1394 spectrum    1 weight  0.10000E+01 volume  0.43963E-03 ppm1      7.074 ppm2      7.858 CV     1
 OR { 1394}
   (( segid "    " and resid 100  and name HD2 ))
   (( segid "    " and resid 96   and name H   ))
 ASSI { 1403}
   (( segid "    " and resid 11   and name HG3 ))
   (( segid "    " and resid 11   and name HD2 ))
      3.000     1.100     1.100 peak  1403 spectrum    1 weight  0.10000E+01 volume  0.20226E-02 ppm1      2.291 ppm2      3.984 CV     1
 OR { 1403}
   (( segid "    " and resid 11   and name HG3 ))
   (( segid "    " and resid 11   and name HD3 ))
 OR { 1403}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 100  and name HA  ))
 ASSI { 1404}
   (( segid "    " and resid 11   and name HG3 ))
   (( segid "    " and resid 11   and name HA  ))
      3.600     1.600     1.600 peak  1404 spectrum    1 weight  0.10000E+01 volume  0.54691E-03 ppm1      2.292 ppm2      4.518 CV     1
 OR { 1404}
   (( segid "    " and resid 11   and name HG3 ))
   (( segid "    " and resid 10   and name HB2 ))
 ASSI { 1406}
   (( segid "    " and resid 11   and name HG3 ))
   (( segid "    " and resid 11   and name HB2 ))
      2.900     1.100     1.100 peak  1406 spectrum    1 weight  0.10000E+01 volume  0.43415E-02 ppm1      2.276 ppm2      2.493 CV     1
 OR { 1406}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 85   and name HG2 ))
 ASSI { 1408}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 86   and name HG2 ))
      4.300     2.300     1.700 peak  1408 spectrum    1 weight  0.10000E+01 volume  0.11523E-02 ppm1      2.276 ppm2      1.815 CV     1
 OR { 1408}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 84   and name HB2 ))
 OR { 1408}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 82   and name HG  ))
 OR { 1408}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 103  and name HB2 ))
 ASSI { 1409}
   (( segid "    " and resid 11   and name HG3 ))
   (( segid "    " and resid 57   and name HB3 ))
      4.600     2.600     1.400 peak  1409 spectrum    1 weight  0.10000E+01 volume  0.27797E-03 ppm1      2.281 ppm2      1.695 CV     1
 OR { 1409}
   (( segid "    " and resid 11   and name HG3 ))
   (( segid "    " and resid 18   and name HG3 ))
 ASSI { 1411}
   (( segid "    " and resid 100  and name HB3 ))
   (  segid "    " and resid 91   and name HD% )
      3.900     1.900     1.900 peak  1411 spectrum    1 weight  0.10000E+01 volume  0.52649E-03 ppm1      0.996 ppm2      7.097 CV     1
 OR { 1411}
   (( segid "    " and resid 100  and name HB3 ))
   (( segid "    " and resid 100  and name HD2 ))
 ASSI { 1412}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HD2 ))
      3.900     1.900     1.900 peak  1412 spectrum    1 weight  0.10000E+01 volume  0.93164E-03 ppm1      3.940 ppm2      7.069 CV     1
 OR { 1412}
   (( segid "    " and resid 100  and name HA  ))
   (  segid "    " and resid 91   and name HD% )
 ASSI { 1417}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 101  and name HD1%)
      2.200     0.600     0.600 peak  1417 spectrum    1 weight  0.10000E+01 volume  0.61473E-02 ppm1      3.983 ppm2      0.991 CV     1
 OR { 1417}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 97   and name HG2%)
 OR { 1417}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 101  and name HG2%)
 OR { 1417}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 114  and name HG2%)
 ASSI { 1420}
   (( segid "    " and resid 20   and name HA  ))
   (  segid "    " and resid 23   and name HB% )
      2.400     0.800     0.800 peak  1420 spectrum    1 weight  0.10000E+01 volume  0.52079E-02 ppm1      3.964 ppm2      1.438 CV     1
 OR { 1420}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HB2 ))
 ASSI { 1421}
   (( segid "    " and resid 117  and name HA  ))
   (  segid "    " and resid 120  and name HB% )
      2.700     0.900     0.900 peak  1421 spectrum    1 weight  0.10000E+01 volume  0.43216E-02 ppm1      4.004 ppm2      1.451 CV     1
 OR { 1421}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 59   and name HG  ))
 ASSI { 1429}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 98   and name HA  ))
      2.900     1.000     1.000 peak  1429 spectrum    1 weight  0.10000E+01 volume  0.18839E-02 ppm1      1.434 ppm2      3.995 CV     1
 OR { 1429}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 111  and name HA  ))
 ASSI { 1430}
   (( segid "    " and resid 98   and name HB3 ))
   (( segid "    " and resid 98   and name HA  ))
      2.600     0.900     0.900 peak  1430 spectrum    1 weight  0.10000E+01 volume  0.26202E-02 ppm1      1.824 ppm2      3.988 CV     1
 OR { 1430}
   (( segid "    " and resid 98   and name HB3 ))
   (( segid "    " and resid 111  and name HA  ))
 ASSI { 1432}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 36   and name HA  ))
      4.300     2.300     1.700 peak  1432 spectrum    1 weight  0.10000E+01 volume  0.53340E-03 ppm1      1.852 ppm2      3.692 CV     1
 OR { 1432}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 54   and name HA  ))
 ASSI { 1436}
   (( segid "    " and resid 84   and name HB2 ))
   (  segid "    " and resid 84   and name HD1%)
      2.500     0.800     0.800 peak  1436 spectrum    1 weight  0.10000E+01 volume  0.40713E-02 ppm1      1.814 ppm2      1.040 CV     1
 OR { 1436}
   (( segid "    " and resid 84   and name HB2 ))
   (  segid "    " and resid 105  and name HD1%)
 OR { 1436}
   (( segid "    " and resid 17   and name HB2 ))
   (  segid "    " and resid 17   and name HD1%)
 OR { 1436}
   (( segid "    " and resid 98   and name HB3 ))
   (  segid "    " and resid 101  and name HD1%)
 OR { 1436}
   (( segid "    " and resid 98   and name HB3 ))
   (  segid "    " and resid 97   and name HG1%)
 ASSI { 1438}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HA  ))
      2.700     0.900     0.900 peak  1438 spectrum    1 weight  0.10000E+01 volume  0.54932E-02 ppm1      1.702 ppm2      4.351 CV     1
 OR { 1438}
   (( segid "    " and resid 4    and name HG3 ))
   (( segid "    " and resid 4    and name HA  ))
 OR { 1438}
   (( segid "    " and resid 134  and name HG3 ))
   (( segid "    " and resid 134  and name HA  ))
 OR { 1438}
   (( segid "    " and resid 134  and name HG2 ))
   (( segid "    " and resid 134  and name HA  ))
 ASSI { 1439}
   (  segid "    " and resid 98   and name HD2%)
   (  segid "    " and resid 118  and name HD1%)
      3.100     1.200     1.200 peak  1439 spectrum    1 weight  0.10000E+01 volume  0.49545E-02 ppm1      0.852 ppm2      0.522 CV     1
 OR { 1439}
   (  segid "    " and resid 98   and name HD2%)
   (  segid "    " and resid 124  and name HG1%)
 ASSI { 1440}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 31   and name HB3 ))
      4.800     2.800     1.200 peak  1440 spectrum    1 weight  0.10000E+01 volume  0.10309E-02 ppm1      0.853 ppm2      2.852 CV     1
 OR { 1440}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 39   and name HB3 ))
 OR { 1440}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 66   and name HB2 ))
 ASSI { 1442}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 102  and name HG3 ))
      4.200     2.200     1.800 peak  1442 spectrum    1 weight  0.10000E+01 volume  0.10926E-02 ppm1      0.851 ppm2      2.583 CV     1
 OR { 1442}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 96   and name HB2 ))
 OR { 1442}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 96   and name HB3 ))
 ASSI { 1443}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 114  and name HB  ))
      2.900     1.000     1.000 peak  1443 spectrum    1 weight  0.10000E+01 volume  0.63384E-02 ppm1      0.852 ppm2      2.209 CV     1
 OR { 1443}
   (  segid "    " and resid 98   and name HD2%)
   (  segid "    " and resid 102  and name HE% )
 OR { 1443}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 34   and name HG3 ))
 OR { 1443}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 50   and name HB  ))
 ASSI { 1444}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 101  and name HB  ))
      3.100     1.200     1.200 peak  1444 spectrum    1 weight  0.10000E+01 volume  0.41085E-02 ppm1      0.852 ppm2      2.046 CV     1
 OR { 1444}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 118  and name HB2 ))
 ASSI { 1445}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 98   and name HB3 ))
      2.400     0.700     0.700 peak  1445 spectrum    1 weight  0.10000E+01 volume  0.14018E-01 ppm1      0.852 ppm2      1.854 CV     1
 OR { 1445}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 37   and name HB3 ))
 OR { 1445}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 47   and name HB2 ))
 OR { 1445}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 47   and name HB3 ))
 ASSI { 1446}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 98   and name HG  ))
      1.700     0.400     0.500 peak  1446 spectrum    1 weight  0.10000E+01 volume  0.24348E-01 ppm1      0.852 ppm2      1.682 CV     1
 OR { 1446}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 37   and name HG  ))
 ASSI { 1447}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 37   and name HB2 ))
      1.900     0.400     0.400 peak  1447 spectrum    1 weight  0.10000E+01 volume  0.18271E-01 ppm1      0.852 ppm2      1.566 CV     1
 OR { 1447}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 47   and name HG2 ))
 OR { 1447}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 50   and name HG12))
 ASSI { 1448}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 98   and name HB2 ))
      2.200     0.600     0.600 peak  1448 spectrum    1 weight  0.10000E+01 volume  0.11385E-01 ppm1      0.851 ppm2      1.440 CV     1
 OR { 1448}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 130  and name HB2 ))
 ASSI { 1449}
   (  segid "    " and resid 98   and name HD2%)
   (  segid "    " and resid 115  and name HG1%)
      2.100     0.500     0.500 peak  1449 spectrum    1 weight  0.10000E+01 volume  0.18710E-01 ppm1      0.851 ppm2      1.118 CV     1
 OR { 1449}
   (  segid "    " and resid 98   and name HD2%)
   (  segid "    " and resid 84   and name HD1%)
 ASSI { 1450}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 130  and name HA  ))
      3.800     1.800     1.800 peak  1450 spectrum    1 weight  0.10000E+01 volume  0.16265E-02 ppm1      0.854 ppm2      4.298 CV     1
 OR { 1450}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 116  and name HA  ))
 ASSI { 1451}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 34   and name HA  ))
      1.900     0.400     0.400 peak  1451 spectrum    1 weight  0.10000E+01 volume  0.12956E-01 ppm1      0.852 ppm2      3.944 CV     1
 OR { 1451}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 98   and name HA  ))
 ASSI { 1453}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 115  and name HA  ))
      3.200     1.200     1.200 peak  1453 spectrum    1 weight  0.10000E+01 volume  0.21954E-02 ppm1      0.851 ppm2      3.337 CV     1
 OR { 1453}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 111  and name HD2 ))
 ASSI { 1454}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 47   and name HD3 ))
      3.000     1.200     1.200 peak  1454 spectrum    1 weight  0.10000E+01 volume  0.24796E-02 ppm1      0.852 ppm2      3.249 CV     1
 OR { 1454}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 47   and name HD2 ))
 OR { 1454}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 111  and name HD2 ))
 OR { 1454}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 111  and name HD3 ))
 ASSI { 1456}
   (  segid "    " and resid 98   and name HD1%)
   (  segid "    " and resid 118  and name HD1%)
      3.400     1.400     1.400 peak  1456 spectrum    1 weight  0.10000E+01 volume  0.29686E-02 ppm1      0.895 ppm2      0.536 CV     1
 OR { 1456}
   (  segid "    " and resid 98   and name HD1%)
   (  segid "    " and resid 124  and name HG1%)
 ASSI { 1457}
   (  segid "    " and resid 98   and name HD1%)
   (  segid "    " and resid 115  and name HG1%)
      2.100     0.600     0.600 peak  1457 spectrum    1 weight  0.10000E+01 volume  0.16528E-01 ppm1      0.894 ppm2      1.120 CV     1
 OR { 1457}
   (  segid "    " and resid 98   and name HD1%)
   (  segid "    " and resid 84   and name HD1%)
 ASSI { 1458}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 98   and name HB2 ))
      2.500     0.800     0.800 peak  1458 spectrum    1 weight  0.10000E+01 volume  0.84837E-02 ppm1      0.893 ppm2      1.432 CV     1
 OR { 1458}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 130  and name HB2 ))
 OR { 1458}
   (  segid "    " and resid 138  and name HD2%)
   (  segid "    " and resid 139  and name HB% )
 ASSI { 1460}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 102  and name HG3 ))
      4.000     2.000     2.000 peak  1460 spectrum    1 weight  0.10000E+01 volume  0.12090E-02 ppm1      0.893 ppm2      2.581 CV     1
 OR { 1460}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 96   and name HB3 ))
 ASSI { 1461}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 67   and name HE22))
      5.000     3.100     1.000 peak  1461 spectrum    1 weight  0.10000E+01 volume  0.44365E-03 ppm1      0.852 ppm2      6.910 CV     1
 OR { 1461}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 76   and name HH2 ))
 OR { 1461}
   (  segid "    " and resid 37   and name HD1%)
   (  segid "    " and resid 21   and name HD% )
 ASSI { 1462}
   (  segid "    " and resid 98   and name HD2%)
   (  segid "    " and resid 131  and name HD% )
      4.000     2.000     2.000 peak  1462 spectrum    1 weight  0.10000E+01 volume  0.15223E-02 ppm1      0.853 ppm2      7.102 CV     1
 OR { 1462}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 88   and name HZ  ))
 OR { 1462}
   (  segid "    " and resid 98   and name HD2%)
   (  segid "    " and resid 91   and name HD% )
 OR { 1462}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 76   and name HZ2 ))
 OR { 1462}
   (  segid "    " and resid 37   and name HD1%)
   (  segid "    " and resid 66   and name HE% )
 OR { 1462}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 76   and name HZ3 ))
 ASSI { 1464}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 35   and name H   ))
      3.800     1.800     1.800 peak  1464 spectrum    1 weight  0.10000E+01 volume  0.18406E-02 ppm1      0.852 ppm2      7.859 CV     1
 OR { 1464}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 99   and name H   ))
 OR { 1464}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 40   and name H   ))
 ASSI { 1465}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 100  and name H   ))
      4.000     2.000     2.000 peak  1465 spectrum    1 weight  0.10000E+01 volume  0.13326E-02 ppm1      0.851 ppm2      7.761 CV     1
 OR { 1465}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 130  and name H   ))
 OR { 1465}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 49   and name H   ))
 ASSI { 1466}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 37   and name H   ))
      2.500     0.800     0.800 peak  1466 spectrum    1 weight  0.10000E+01 volume  0.67094E-02 ppm1      0.851 ppm2      8.577 CV     1
 OR { 1466}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 98   and name H   ))
 OR { 1466}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 115  and name H   ))
 ASSI { 1468}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 50   and name H   ))
      4.500     2.500     1.500 peak  1468 spectrum    1 weight  0.10000E+01 volume  0.13920E-02 ppm1      0.853 ppm2      8.200 CV     1
 OR { 1468}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 51   and name H   ))
 OR { 1468}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 89   and name H   ))
 ASSI { 1469}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 36   and name H   ))
      3.300     1.300     1.300 peak  1469 spectrum    1 weight  0.10000E+01 volume  0.27081E-02 ppm1      0.852 ppm2      8.102 CV     1
 OR { 1469}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 114  and name H   ))
 ASSI { 1470}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 47   and name H   ))
      4.900     3.000     1.100 peak  1470 spectrum    1 weight  0.10000E+01 volume  0.45173E-03 ppm1      0.848 ppm2      9.005 CV     1
 OR { 1470}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 111  and name H   ))
 ASSI { 1471}
   (( segid "    " and resid 54   and name HG  ))
   (  segid "    " and resid 66   and name HE% )
      4.700     2.700     1.300 peak  1471 spectrum    1 weight  0.10000E+01 volume  0.50789E-03 ppm1      1.723 ppm2      7.089 CV     1
 OR { 1471}
   (( segid "    " and resid 98   and name HG  ))
   (  segid "    " and resid 88   and name HD% )
 OR { 1471}
   (( segid "    " and resid 54   and name HG  ))
   (( segid "    " and resid 60   and name H   ))
 ASSI { 1472}
   (( segid "    " and resid 98   and name HG  ))
   (( segid "    " and resid 100  and name H   ))
      4.600     2.700     1.400 peak  1472 spectrum    1 weight  0.10000E+01 volume  0.66786E-03 ppm1      1.724 ppm2      7.766 CV     1
 OR { 1472}
   (( segid "    " and resid 98   and name HG  ))
   (( segid "    " and resid 130  and name H   ))
 ASSI { 1473}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 98   and name H   ))
      2.400     0.700     0.700 peak  1473 spectrum    1 weight  0.10000E+01 volume  0.24496E-02 ppm1      1.432 ppm2      8.570 CV     1
 OR { 1473}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 22   and name H   ))
 ASSI { 1477}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name H   ))
      2.800     1.000     1.000 peak  1477 spectrum    1 weight  0.10000E+01 volume  0.20691E-02 ppm1      3.991 ppm2      8.593 CV     1
 OR { 1477}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 102  and name H   ))
 OR { 1477}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 97   and name H   ))
 ASSI { 1481}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 92   and name HA  ))
      2.500     0.800     0.800 peak  1481 spectrum    1 weight  0.10000E+01 volume  0.20560E-02 ppm1      2.190 ppm2      3.554 CV     1
 OR { 1481}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 44   and name HD2 ))
 ASSI { 1482}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 97   and name HA  ))
      2.800     1.000     1.000 peak  1482 spectrum    1 weight  0.10000E+01 volume  0.22717E-02 ppm1      2.193 ppm2      3.705 CV     1
 OR { 1482}
   (( segid "    " and resid 44   and name HB3 ))
   (( segid "    " and resid 44   and name HD3 ))
 ASSI { 1485}
   (  segid "    " and resid 97   and name HG1%)
   (  segid "    " and resid 124  and name HG1%)
      3.800     1.800     1.800 peak  1485 spectrum    1 weight  0.10000E+01 volume  0.17339E-02 ppm1      1.052 ppm2      0.519 CV     1
 OR { 1485}
   (  segid "    " and resid 97   and name HG1%)
   (  segid "    " and resid 118  and name HD1%)
 ASSI { 1487}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 101  and name HB  ))
      4.000     2.000     2.000 peak  1487 spectrum    1 weight  0.10000E+01 volume  0.15175E-02 ppm1      1.050 ppm2      2.030 CV     1
 OR { 1487}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 118  and name HB2 ))
 ASSI { 1488}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 98   and name HG  ))
      3.000     1.100     1.100 peak  1488 spectrum    1 weight  0.10000E+01 volume  0.45749E-02 ppm1      1.053 ppm2      1.734 CV     1
 OR { 1488}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 111  and name HG2 ))
 ASSI { 1492}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 102  and name HG2 ))
      4.800     2.900     1.200 peak  1492 spectrum    1 weight  0.10000E+01 volume  0.43230E-03 ppm1      1.050 ppm2      2.763 CV     1
 OR { 1492}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 95   and name HB3 ))
 OR { 1492}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 95   and name HB2 ))
 ASSI { 1494}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 96   and name HB2 ))
      5.200     3.400     0.800 peak  1494 spectrum    1 weight  0.10000E+01 volume  0.74482E-03 ppm1      1.048 ppm2      2.547 CV     1
 OR { 1494}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 96   and name HB3 ))
 OR { 1494}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 89   and name HG3 ))
 ASSI { 1496}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 98   and name HA  ))
      3.200     1.300     1.300 peak  1496 spectrum    1 weight  0.10000E+01 volume  0.24365E-02 ppm1      1.050 ppm2      3.976 CV     1
 OR { 1496}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 88   and name HA  ))
 ASSI { 1497}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 97   and name HA  ))
      3.300     1.400     1.400 peak  1497 spectrum    1 weight  0.10000E+01 volume  0.36887E-02 ppm1      1.050 ppm2      3.628 CV     1
 OR { 1497}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 92   and name HA  ))
 ASSI { 1498}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 91   and name HB2 ))
      4.600     2.600     1.400 peak  1498 spectrum    1 weight  0.10000E+01 volume  0.64572E-03 ppm1      1.051 ppm2      3.355 CV     1
 OR { 1498}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 115  and name HA  ))
 ASSI { 1499}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 88   and name HB3 ))
      5.100     3.300     0.900 peak  1499 spectrum    1 weight  0.10000E+01 volume  0.54046E-03 ppm1      1.049 ppm2      3.235 CV     1
 OR { 1499}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 111  and name HD3 ))
 ASSI { 1500}
   (  segid "    " and resid 97   and name HG2%)
   (  segid "    " and resid 118  and name HD1%)
      3.700     1.700     1.700 peak  1500 spectrum    1 weight  0.10000E+01 volume  0.22049E-02 ppm1      0.998 ppm2      0.516 CV     1
 OR { 1500}
   (  segid "    " and resid 97   and name HG2%)
   (  segid "    " and resid 124  and name HG1%)
 ASSI { 1503}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 37   and name HB3 ))
      3.400     1.500     1.500 peak  1503 spectrum    1 weight  0.10000E+01 volume  0.27461E-02 ppm1      0.998 ppm2      1.834 CV     1
 OR { 1503}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 98   and name HB3 ))
 OR { 1503}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 47   and name HB3 ))
 ASSI { 1506}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 35   and name HA  ))
      3.900     1.900     1.900 peak  1506 spectrum    1 weight  0.10000E+01 volume  0.12820E-02 ppm1      1.002 ppm2      4.198 CV     1
 OR { 1506}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 59   and name HA  ))
 ASSI { 1508}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 97   and name HA  ))
      2.300     0.700     0.700 peak  1508 spectrum    1 weight  0.10000E+01 volume  0.70557E-02 ppm1      1.000 ppm2      3.620 CV     1
 OR { 1508}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 92   and name HA  ))
 ASSI { 1511}
   (  segid "    " and resid 97   and name HG2%)
   (  segid "    " and resid 88   and name HD% )
      2.500     0.800     0.800 peak  1511 spectrum    1 weight  0.10000E+01 volume  0.44043E-02 ppm1      1.000 ppm2      7.061 CV     1
 OR { 1511}
   (  segid "    " and resid 97   and name HG2%)
   (  segid "    " and resid 91   and name HD% )
 ASSI { 1512}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 92   and name H   ))
      2.800     1.000     1.000 peak  1512 spectrum    1 weight  0.10000E+01 volume  0.31353E-02 ppm1      1.000 ppm2      7.836 CV     1
 OR { 1512}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 99   and name H   ))
 ASSI { 1514}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 98   and name H   ))
      3.200     1.300     1.300 peak  1514 spectrum    1 weight  0.10000E+01 volume  0.39026E-02 ppm1      1.001 ppm2      8.615 CV     1
 OR { 1514}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 97   and name H   ))
 ASSI { 1518}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 99   and name H   ))
      3.900     1.900     1.900 peak  1518 spectrum    1 weight  0.10000E+01 volume  0.19201E-02 ppm1      1.050 ppm2      7.834 CV     1
 OR { 1518}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 96   and name H   ))
 ASSI { 1519}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 98   and name H   ))
      2.200     0.600     0.600 peak  1519 spectrum    1 weight  0.10000E+01 volume  0.65696E-02 ppm1      1.050 ppm2      8.594 CV     1
 OR { 1519}
   (  segid "    " and resid 97   and name HG1%)
   (( segid "    " and resid 97   and name H   ))
 ASSI { 1522}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 100  and name HD2 ))
      4.000     2.000     2.000 peak  1522 spectrum    1 weight  0.10000E+01 volume  0.77690E-03 ppm1      3.668 ppm2      7.077 CV     1
 OR { 1522}
   (( segid "    " and resid 97   and name HA  ))
   (  segid "    " and resid 91   and name HD% )
 OR { 1522}
   (( segid "    " and resid 97   and name HA  ))
   (  segid "    " and resid 88   and name HD% )
 ASSI { 1523}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 100  and name H   ))
      4.200     2.300     1.800 peak  1523 spectrum    1 weight  0.10000E+01 volume  0.34734E-03 ppm1      3.660 ppm2      7.758 CV     1
 OR { 1523}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 91   and name H   ))
 ASSI { 1524}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 94   and name H   ))
      3.900     1.900     1.900 peak  1524 spectrum    1 weight  0.10000E+01 volume  0.62128E-03 ppm1      3.661 ppm2      7.834 CV     1
 OR { 1524}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 99   and name H   ))
 OR { 1524}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 92   and name H   ))
 ASSI { 1525}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name H   ))
      3.100     1.200     1.200 peak  1525 spectrum    1 weight  0.10000E+01 volume  0.12736E-02 ppm1      3.664 ppm2      8.598 CV     1
 OR { 1525}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 98   and name H   ))
 ASSI { 1526}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 97   and name H   ))
      4.300     2.300     1.700 peak  1526 spectrum    1 weight  0.10000E+01 volume  0.83832E-03 ppm1      2.559 ppm2      8.604 CV     1
 OR { 1526}
   (( segid "    " and resid 96   and name HB3 ))
   (( segid "    " and resid 97   and name H   ))
 OR { 1526}
   (( segid "    " and resid 96   and name HB3 ))
   (( segid "    " and resid 98   and name H   ))
 ASSI { 1527}
   (( segid "    " and resid 96   and name HB3 ))
   (( segid "    " and resid 96   and name H   ))
      3.800     1.800     1.800 peak  1527 spectrum    1 weight  0.10000E+01 volume  0.56472E-03 ppm1      2.569 ppm2      7.872 CV     1
 OR { 1527}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 99   and name H   ))
 OR { 1527}
   (( segid "    " and resid 96   and name HB3 ))
   (( segid "    " and resid 99   and name H   ))
 OR { 1527}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 96   and name H   ))
 ASSI { 1537}
   (( segid "    " and resid 94   and name HB3 ))
   (( segid "    " and resid 100  and name HD2 ))
      4.200     2.200     1.800 peak  1537 spectrum    1 weight  0.10000E+01 volume  0.32578E-03 ppm1      4.178 ppm2      7.089 CV     1
 OR { 1537}
   (( segid "    " and resid 94   and name HB3 ))
   (  segid "    " and resid 91   and name HD% )
 ASSI { 1539}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 94   and name H   ))
      3.700     1.700     1.700 peak  1539 spectrum    1 weight  0.10000E+01 volume  0.82632E-03 ppm1      4.540 ppm2      7.827 CV     1
 OR { 1539}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 96   and name H   ))
 ASSI { 1544}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 94   and name H   ))
      3.800     1.800     1.800 peak  1544 spectrum    1 weight  0.10000E+01 volume  0.83933E-03 ppm1      4.934 ppm2      7.827 CV     1
 OR { 1544}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 92   and name H   ))
 ASSI { 1545}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 24   and name H   ))
      3.100     1.200     1.200 peak  1545 spectrum    1 weight  0.10000E+01 volume  0.17123E-02 ppm1      4.936 ppm2      7.279 CV     1
 OR { 1545}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 27   and name H   ))
 ASSI { 1546}
   (( segid "    " and resid 26   and name HB2 ))
   (  segid "    " and resid 27   and name HG1%)
      4.500     2.500     1.500 peak  1546 spectrum    1 weight  0.10000E+01 volume  0.71952E-03 ppm1      2.861 ppm2      0.959 CV     1
 OR { 1546}
   (( segid "    " and resid 93   and name HB2 ))
   (  segid "    " and resid 97   and name HG2%)
 ASSI { 1550}
   (( segid "    " and resid 26   and name HB3 ))
   (( segid "    " and resid 27   and name HA  ))
      4.200     2.200     1.800 peak  1550 spectrum    1 weight  0.10000E+01 volume  0.48700E-03 ppm1      2.487 ppm2      3.880 CV     1
 OR { 1550}
   (( segid "    " and resid 26   and name HB3 ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI { 1551}
   (( segid "    " and resid 26   and name HB3 ))
   (( segid "    " and resid 26   and name HB2 ))
      1.900     0.500     0.500 peak  1551 spectrum    1 weight  0.10000E+01 volume  0.11297E-01 ppm1      2.473 ppm2      2.860 CV     1
 OR { 1551}
   (( segid "    " and resid 93   and name HB3 ))
   (( segid "    " and resid 93   and name HB2 ))
 ASSI { 1552}
   (( segid "    " and resid 26   and name HB3 ))
   (  segid "    " and resid 27   and name HG1%)
      4.300     2.300     1.700 peak  1552 spectrum    1 weight  0.10000E+01 volume  0.13780E-02 ppm1      2.482 ppm2      0.980 CV     1
 OR { 1552}
   (( segid "    " and resid 65   and name HB2 ))
   (  segid "    " and resid 33   and name HG1%)
 OR { 1552}
   (( segid "    " and resid 65   and name HB2 ))
   (  segid "    " and resid 63   and name HG2%)
 OR { 1552}
   (( segid "    " and resid 65   and name HB2 ))
   (  segid "    " and resid 63   and name HG1%)
 ASSI { 1554}
   (( segid "    " and resid 93   and name HB3 ))
   (( segid "    " and resid 92   and name HG3 ))
      3.900     1.900     1.900 peak  1554 spectrum    1 weight  0.10000E+01 volume  0.86767E-03 ppm1      2.467 ppm2      1.510 CV     1
 OR { 1554}
   (( segid "    " and resid 93   and name HB3 ))
   (( segid "    " and resid 92   and name HB2 ))
 OR { 1554}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 51   and name HG12))
 ASSI { 1556}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 62   and name H   ))
      3.400     1.500     1.500 peak  1556 spectrum    1 weight  0.10000E+01 volume  0.84277E-03 ppm1      2.470 ppm2      7.831 CV     1
 OR { 1556}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 62   and name H   ))
 OR { 1556}
   (( segid "    " and resid 93   and name HB3 ))
   (( segid "    " and resid 94   and name H   ))
 ASSI { 1560}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 94   and name H   ))
      4.000     2.000     2.000 peak  1560 spectrum    1 weight  0.10000E+01 volume  0.75791E-03 ppm1      2.835 ppm2      7.837 CV     1
 OR { 1560}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 92   and name H   ))
 ASSI { 1565}
   (( segid "    " and resid 92   and name HD2 ))
   (  segid "    " and resid 123  and name HD1%)
      2.500     2.500     3.500 peak  1565 spectrum    1 weight  0.10000E+01 volume  0.69114E-03 ppm1      2.905 ppm2      0.797 CV     1
 OR { 1565}
   (( segid "    " and resid 92   and name HD2 ))
   (  segid "    " and resid 118  and name HD2%)
 ASSI { 1582}
   (( segid "    " and resid 92   and name HG2 ))
   (( segid "    " and resid 97   and name HB  ))
      4.600     2.600     1.400 peak  1582 spectrum    1 weight  0.10000E+01 volume  0.46366E-03 ppm1      1.272 ppm2      2.200 CV     1
 OR { 1582}
   (( segid "    " and resid 92   and name HG2 ))
   (( segid "    " and resid 89   and name HB3 ))
 ASSI { 1587}
   (( segid "    " and resid 48   and name HG3 ))
   (  segid "    " and resid 51   and name HD1%)
      3.900     1.900     1.900 peak  1587 spectrum    1 weight  0.10000E+01 volume  0.13086E-02 ppm1      1.518 ppm2      0.789 CV     1
 OR { 1587}
   (( segid "    " and resid 48   and name HG3 ))
   (  segid "    " and resid 37   and name HD2%)
 ASSI { 1590}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 132  and name HD2 ))
      1.600     0.300     0.600 peak  1590 spectrum    1 weight  0.10000E+01 volume  0.68783E-01 ppm1      1.506 ppm2      1.715 CV     1
 OR { 1590}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 133  and name HD2 ))
 OR { 1590}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 133  and name HD3 ))
 OR { 1590}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 64   and name HB3 ))
 OR { 1590}
   (( segid "    " and resid 132  and name HG2 ))
   (( segid "    " and resid 132  and name HD3 ))
 OR { 1590}
   (( segid "    " and resid 132  and name HG2 ))
   (( segid "    " and resid 132  and name HD2 ))
 OR { 1590}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 132  and name HD3 ))
 OR { 1590}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 133  and name HD3 ))
 OR { 1590}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 133  and name HD2 ))
 ASSI { 1596}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 133  and name HA  ))
      2.600     0.800     0.800 peak  1596 spectrum    1 weight  0.10000E+01 volume  0.50221E-02 ppm1      1.514 ppm2      4.380 CV     1
 OR { 1596}
   (( segid "    " and resid 69   and name HG2 ))
   (( segid "    " and resid 69   and name HA  ))
 OR { 1596}
   (( segid "    " and resid 133  and name HG3 ))
   (( segid "    " and resid 133  and name HA  ))
 OR { 1596}
   (( segid "    " and resid 69   and name HG3 ))
   (( segid "    " and resid 69   and name HA  ))
 OR { 1596}
   (( segid "    " and resid 132  and name HG3 ))
   (( segid "    " and resid 132  and name HA  ))
 ASSI { 1613}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 88   and name HD% )
      5.400     3.600     0.600 peak  1613 spectrum    1 weight  0.10000E+01 volume  0.22860E-03 ppm1      3.600 ppm2      7.054 CV     1
 OR { 1613}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 88   and name HZ  ))
 OR { 1613}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 91   and name HD% )
 ASSI { 1615}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name H   ))
      3.000     1.100     1.100 peak  1615 spectrum    1 weight  0.10000E+01 volume  0.13002E-02 ppm1      3.596 ppm2      7.835 CV     1
 OR { 1615}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 94   and name H   ))
 ASSI { 1619}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 93   and name H   ))
      4.900     3.000     1.100 peak  1619 spectrum    1 weight  0.10000E+01 volume  0.32184E-03 ppm1      1.524 ppm2      8.371 CV     1
 OR { 1619}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 48   and name H   ))
 ASSI { 1625}
   (( segid "    " and resid 48   and name HG3 ))
   (( segid "    " and resid 52   and name HD2 ))
      3.100     1.200     1.200 peak  1625 spectrum    1 weight  0.10000E+01 volume  0.13040E-02 ppm1      1.515 ppm2      7.067 CV     1
 OR { 1625}
   (( segid "    " and resid 92   and name HG3 ))
   (  segid "    " and resid 88   and name HD% )
 ASSI { 1636}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 66   and name H   ))
      3.900     1.900     1.900 peak  1636 spectrum    1 weight  0.10000E+01 volume  0.10797E-02 ppm1      7.089 ppm2      7.498 CV     1
 OR { 1636}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 55   and name H   ))
 ASSI { 1638}
   (( segid "    " and resid 66   and name HB3 ))
   (  segid "    " and resid 33   and name HG1%)
      2.800     1.000     1.000 peak  1638 spectrum    1 weight  0.10000E+01 volume  0.20195E-02 ppm1      3.367 ppm2      0.970 CV     1
 OR { 1638}
   (( segid "    " and resid 91   and name HB2 ))
   (  segid "    " and resid 97   and name HG2%)
 OR { 1638}
   (( segid "    " and resid 66   and name HB3 ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI { 1644}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 66   and name HZ  ))
      3.100     1.200     1.200 peak  1644 spectrum    1 weight  0.10000E+01 volume  0.29345E-02 ppm1      7.294 ppm2      6.953 CV     1
 OR { 1644}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 67   and name HE22))
 ASSI { 1651}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 51   and name HA  ))
      3.400     1.500     1.500 peak  1651 spectrum    1 weight  0.10000E+01 volume  0.93065E-03 ppm1      7.089 ppm2      2.928 CV     1
 OR { 1651}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 104  and name HB3 ))
 ASSI { 1652}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 63   and name HA  ))
      3.100     1.200     1.200 peak  1652 spectrum    1 weight  0.10000E+01 volume  0.12071E-02 ppm1      7.089 ppm2      3.961 CV     1
 OR { 1652}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 55   and name HA  ))
 OR { 1652}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 100  and name HA  ))
 ASSI { 1654}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 87   and name HB2 ))
      4.400     2.400     1.600 peak  1654 spectrum    1 weight  0.10000E+01 volume  0.70165E-03 ppm1      7.086 ppm2      2.210 CV     1
 OR { 1654}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 97   and name HB  ))
 ASSI { 1655}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 55   and name HB  ))
      4.200     2.200     1.800 peak  1655 spectrum    1 weight  0.10000E+01 volume  0.62843E-03 ppm1      7.081 ppm2      2.001 CV     1
 OR { 1655}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 101  and name HB  ))
 ASSI { 1658}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 90   and name HB3 ))
      3.600     1.600     1.600 peak  1658 spectrum    1 weight  0.10000E+01 volume  0.96063E-03 ppm1      7.090 ppm2      1.475 CV     1
 OR { 1658}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 87   and name HB3 ))
 ASSI { 1659}
   (  segid "    " and resid 91   and name HD% )
   (( segid "    " and resid 100  and name HB3 ))
      2.800     1.000     1.000 peak  1659 spectrum    1 weight  0.10000E+01 volume  0.40375E-02 ppm1      7.090 ppm2      0.949 CV     1
 OR { 1659}
   (  segid "    " and resid 66   and name HE% )
   (  segid "    " and resid 33   and name HG2%)
 OR { 1659}
   (  segid "    " and resid 66   and name HE% )
   (  segid "    " and resid 33   and name HG1%)
 ASSI { 1660}
   (  segid "    " and resid 66   and name HE% )
   (  segid "    " and resid 55   and name HG1%)
      2.500     0.800     0.800 peak  1660 spectrum    1 weight  0.10000E+01 volume  0.38036E-02 ppm1      7.091 ppm2      0.786 CV     1
 OR { 1660}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 54   and name HB2 ))
 ASSI { 1664}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 51   and name HB  ))
      4.400     2.400     1.600 peak  1664 spectrum    1 weight  0.10000E+01 volume  0.62225E-03 ppm1      7.293 ppm2      1.655 CV     1
 OR { 1664}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 64   and name HD3 ))
 ASSI { 1668}
   (  segid "    " and resid 66   and name HD% )
   (  segid "    " and resid 51   and name HD1%)
      3.300     1.400     1.400 peak  1668 spectrum    1 weight  0.10000E+01 volume  0.35489E-02 ppm1      7.294 ppm2      0.777 CV     1
 OR { 1668}
   (  segid "    " and resid 66   and name HD% )
   (  segid "    " and resid 55   and name HG1%)
 OR { 1668}
   (  segid "    " and resid 66   and name HD% )
   (  segid "    " and resid 37   and name HD2%)
 ASSI { 1672}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 67   and name HG2 ))
      3.400     1.400     1.400 peak  1672 spectrum    1 weight  0.10000E+01 volume  0.12572E-02 ppm1      7.293 ppm2      2.402 CV     1
 OR { 1672}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 67   and name HG3 ))
 OR { 1672}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 65   and name HB3 ))
 ASSI { 1673}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 63   and name HB  ))
      4.200     2.200     1.800 peak  1673 spectrum    1 weight  0.10000E+01 volume  0.80367E-03 ppm1      7.293 ppm2      2.208 CV     1
 OR { 1673}
   (  segid "    " and resid 66   and name HD% )
   (( segid "    " and resid 67   and name HB3 ))
 ASSI { 1681}
   (( segid "    " and resid 66   and name HZ  ))
   (  segid "    " and resid 33   and name HG2%)
      2.300     2.300     3.700 peak  1681 spectrum    1 weight  0.10000E+01 volume  0.10783E-02 ppm1      6.931 ppm2      0.939 CV     1
 OR { 1681}
   (( segid "    " and resid 66   and name HZ  ))
   (  segid "    " and resid 33   and name HG1%)
 OR { 1681}
   (( segid "    " and resid 66   and name HZ  ))
   (  segid "    " and resid 50   and name HG2%)
 ASSI { 1682}
   (( segid "    " and resid 66   and name HZ  ))
   (( segid "    " and resid 54   and name HB2 ))
      2.800     1.000     1.000 peak  1682 spectrum    1 weight  0.10000E+01 volume  0.13201E-02 ppm1      6.935 ppm2      0.777 CV     1
 OR { 1682}
   (( segid "    " and resid 66   and name HZ  ))
   (  segid "    " and resid 55   and name HG1%)
 ASSI { 1685}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 49   and name HE21))
      3.200     1.300     1.300 peak  1685 spectrum    1 weight  0.10000E+01 volume  0.11417E-02 ppm1      1.688 ppm2      7.089 CV     1
 OR { 1685}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 45   and name HE  ))
 OR { 1685}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HE  ))
 OR { 1685}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 49   and name HE21))
 ASSI { 1687}
   (( segid "    " and resid 57   and name HB3 ))
   (( segid "    " and resid 57   and name H   ))
      2.800     1.000     1.000 peak  1687 spectrum    1 weight  0.10000E+01 volume  0.25788E-02 ppm1      1.688 ppm2      7.898 CV     1
 OR { 1687}
   (( segid "    " and resid 90   and name HG3 ))
   (( segid "    " and resid 90   and name H   ))
 ASSI { 1699}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 45   and name HG2 ))
      2.500     0.800     0.800 peak  1699 spectrum    1 weight  0.10000E+01 volume  0.68980E-02 ppm1      1.690 ppm2      1.479 CV     1
 OR { 1699}
   (( segid "    " and resid 90   and name HG3 ))
   (( segid "    " and resid 90   and name HB3 ))
 OR { 1699}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HG2 ))
 ASSI { 1703}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 47   and name HD2 ))
      3.800     1.800     1.800 peak  1703 spectrum    1 weight  0.10000E+01 volume  0.10290E-02 ppm1      1.687 ppm2      3.221 CV     1
 OR { 1703}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 47   and name HD3 ))
 OR { 1703}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 52   and name HB2 ))
 OR { 1703}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 52   and name HB2 ))
 OR { 1703}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 47   and name HD3 ))
 ASSI { 1705}
   (( segid "    " and resid 90   and name HG3 ))
   (( segid "    " and resid 87   and name HA  ))
      4.300     2.400     1.700 peak  1705 spectrum    1 weight  0.10000E+01 volume  0.56135E-03 ppm1      1.688 ppm2      4.244 CV     1
 OR { 1705}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 49   and name HA  ))
 OR { 1705}
   (( segid "    " and resid 45   and name HB3 ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI { 1713}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 88   and name HD% )
      3.500     1.500     1.500 peak  1713 spectrum    1 weight  0.10000E+01 volume  0.70385E-03 ppm1      3.747 ppm2      7.038 CV     1
 OR { 1713}
   (( segid "    " and resid 90   and name HA  ))
   (  segid "    " and resid 91   and name HD% )
 ASSI { 1715}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HE21))
      4.100     2.100     1.900 peak  1715 spectrum    1 weight  0.10000E+01 volume  0.80003E-03 ppm1      2.208 ppm2      7.047 CV     1
 OR { 1715}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 49   and name HE21))
 OR { 1715}
   (( segid "    " and resid 89   and name HB3 ))
   (  segid "    " and resid 88   and name HD% )
 ASSI { 1716}
   (( segid "    " and resid 19   and name HG2 ))
   (  segid "    " and resid 22   and name HD1%)
      3.800     1.800     1.800 peak  1716 spectrum    1 weight  0.10000E+01 volume  0.13528E-02 ppm1      2.511 ppm2      0.937 CV     1
 OR { 1716}
   (( segid "    " and resid 19   and name HG2 ))
   (  segid "    " and resid 40   and name HD1%)
 OR { 1716}
   (( segid "    " and resid 89   and name HG3 ))
   (  segid "    " and resid 114  and name HG2%)
 OR { 1716}
   (( segid "    " and resid 19   and name HG2 ))
   (  segid "    " and resid 22   and name HD2%)
 OR { 1716}
   (( segid "    " and resid 19   and name HG2 ))
   (  segid "    " and resid 36   and name HG2%)
 OR { 1716}
   (( segid "    " and resid 89   and name HG3 ))
   (  segid "    " and resid 98   and name HD1%)
 OR { 1716}
   (( segid "    " and resid 89   and name HG3 ))
   (  segid "    " and resid 130  and name HD2%)
 ASSI { 1718}
   (( segid "    " and resid 89   and name HG3 ))
   (  segid "    " and resid 123  and name HD2%)
      4.200     2.200     1.800 peak  1718 spectrum    1 weight  0.10000E+01 volume  0.54903E-03 ppm1      2.517 ppm2      0.634 CV     1
 OR { 1718}
   (( segid "    " and resid 19   and name HG2 ))
   (  segid "    " and resid 20   and name HD2%)
 ASSI { 1719}
   (( segid "    " and resid 89   and name HG2 ))
   (  segid "    " and resid 123  and name HD2%)
      2.900     1.100     1.100 peak  1719 spectrum    1 weight  0.10000E+01 volume  0.13919E-02 ppm1      2.382 ppm2      0.643 CV     1
 OR { 1719}
   (( segid "    " and resid 19   and name HG3 ))
   (  segid "    " and resid 20   and name HD2%)
 ASSI { 1720}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 89   and name HG2 ))
      1.500     0.300     0.700 peak  1720 spectrum    1 weight  0.10000E+01 volume  0.27542E-01 ppm1      2.517 ppm2      2.398 CV     1
 OR { 1720}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 19   and name HG3 ))
 ASSI { 1721}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 19   and name HB3 ))
      2.300     0.700     0.700 peak  1721 spectrum    1 weight  0.10000E+01 volume  0.71117E-02 ppm1      2.511 ppm2      2.197 CV     1
 OR { 1721}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 89   and name HB3 ))
 ASSI { 1723}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 86   and name HG2 ))
      4.100     2.100     1.900 peak  1723 spectrum    1 weight  0.10000E+01 volume  0.75216E-03 ppm1      2.519 ppm2      1.798 CV     1
 OR { 1723}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 90   and name HB2 ))
 ASSI { 1724}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 90   and name HG3 ))
      4.100     2.100     1.900 peak  1724 spectrum    1 weight  0.10000E+01 volume  0.79471E-03 ppm1      2.519 ppm2      1.662 CV     1
 OR { 1724}
   (( segid "    " and resid 89   and name HG3 ))
   (( segid "    " and resid 121  and name HB2 ))
 ASSI { 1725}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 47   and name HB2 ))
      3.500     1.500     1.500 peak  1725 spectrum    1 weight  0.10000E+01 volume  0.17984E-02 ppm1      2.397 ppm2      1.831 CV     1
 OR { 1725}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 37   and name HB3 ))
 OR { 1725}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 47   and name HB3 ))
 OR { 1725}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 86   and name HG2 ))
 ASSI { 1726}
   (( segid "    " and resid 19   and name HG3 ))
   (  segid "    " and resid 23   and name HB% )
      3.400     1.400     1.400 peak  1726 spectrum    1 weight  0.10000E+01 volume  0.18729E-02 ppm1      2.372 ppm2      1.449 CV     1
 OR { 1726}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 105  and name HG13))
 OR { 1726}
   (( segid "    " and resid 34   and name HG2 ))
   (  segid "    " and resid 35   and name HB% )
 OR { 1726}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 51   and name HG12))
 OR { 1726}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 121  and name HB3 ))
 OR { 1726}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 90   and name HB3 ))
 ASSI { 1727}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 89   and name HG3 ))
      1.300     0.200     0.900 peak  1727 spectrum    1 weight  0.10000E+01 volume  0.68622E-01 ppm1      2.371 ppm2      2.468 CV     1
 OR { 1727}
   (( segid "    " and resid 19   and name HG3 ))
   (( segid "    " and resid 19   and name HG2 ))
 OR { 1727}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 83   and name HG3 ))
 ASSI { 1729}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 88   and name HB3 ))
      3.900     1.900     1.900 peak  1729 spectrum    1 weight  0.10000E+01 volume  0.90589E-03 ppm1      2.397 ppm2      3.210 CV     1
 OR { 1729}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 86   and name HD3 ))
 ASSI { 1734}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HA  ))
      2.500     0.800     0.800 peak  1734 spectrum    1 weight  0.10000E+01 volume  0.40251E-02 ppm1      2.374 ppm2      4.022 CV     1
 OR { 1734}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 80   and name HA  ))
 OR { 1734}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 83   and name HA  ))
 ASSI { 1740}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 85   and name HE21))
      5.000     3.100     1.000 peak  1740 spectrum    1 weight  0.10000E+01 volume  0.39454E-03 ppm1      2.397 ppm2      6.837 CV     1
 OR { 1740}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 124  and name H   ))
 ASSI { 1743}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 86   and name H   ))
      4.700     2.800     1.300 peak  1743 spectrum    1 weight  0.10000E+01 volume  0.58437E-03 ppm1      2.396 ppm2      8.362 CV     1
 OR { 1743}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 86   and name H   ))
 OR { 1743}
   (( segid "    " and resid 19   and name HG3 ))
   (( segid "    " and resid 18   and name H   ))
 ASSI { 1744}
   (( segid "    " and resid 19   and name HG3 ))
   (( segid "    " and resid 18   and name H   ))
      4.800     2.900     1.200 peak  1744 spectrum    1 weight  0.10000E+01 volume  0.77015E-03 ppm1      2.377 ppm2      8.316 CV     1
 OR { 1744}
   (( segid "    " and resid 19   and name HG3 ))
   (( segid "    " and resid 16   and name HE1 ))
 ASSI { 1746}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name H   ))
      3.300     1.300     1.300 peak  1746 spectrum    1 weight  0.10000E+01 volume  0.37846E-02 ppm1      2.373 ppm2      7.984 CV     1
 OR { 1746}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 84   and name H   ))
 OR { 1746}
   (( segid "    " and resid 19   and name HG3 ))
   (( segid "    " and resid 19   and name H   ))
 ASSI { 1747}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 88   and name H   ))
      5.100     3.200     0.900 peak  1747 spectrum    1 weight  0.10000E+01 volume  0.58741E-03 ppm1      2.391 ppm2      8.896 CV     1
 OR { 1747}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 31   and name H   ))
 ASSI { 1748}
   (( segid "    " and resid 19   and name HG3 ))
   (( segid "    " and resid 20   and name H   ))
      3.400     1.500     1.500 peak  1748 spectrum    1 weight  0.10000E+01 volume  0.13825E-02 ppm1      2.372 ppm2      8.664 CV     1
 OR { 1748}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 87   and name H   ))
 ASSI { 1751}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name H   ))
      2.500     0.800     0.800 peak  1751 spectrum    1 weight  0.10000E+01 volume  0.32405E-02 ppm1      2.188 ppm2      8.160 CV     1
 OR { 1751}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 50   and name H   ))
 OR { 1751}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 50   and name H   ))
 OR { 1751}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 89   and name H   ))
 ASSI { 1752}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 89   and name HA  ))
      2.700     0.900     0.900 peak  1752 spectrum    1 weight  0.10000E+01 volume  0.22938E-02 ppm1      2.182 ppm2      3.748 CV     1
 OR { 1752}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 50   and name HA  ))
 ASSI { 1760}
   (( segid "    " and resid 53   and name HB2 ))
   (  segid "    " and resid 36   and name HG2%)
      3.300     1.400     1.400 peak  1760 spectrum    1 weight  0.10000E+01 volume  0.36886E-02 ppm1      2.174 ppm2      0.957 CV     1
 OR { 1760}
   (( segid "    " and resid 89   and name HB3 ))
   (  segid "    " and resid 97   and name HG2%)
 OR { 1760}
   (( segid "    " and resid 53   and name HB2 ))
   (  segid "    " and resid 33   and name HG2%)
 OR { 1760}
   (( segid "    " and resid 53   and name HB2 ))
   (  segid "    " and resid 36   and name HD1%)
 OR { 1760}
   (( segid "    " and resid 49   and name HB3 ))
   (  segid "    " and resid 40   and name HD2%)
 OR { 1760}
   (( segid "    " and resid 49   and name HB3 ))
   (  segid "    " and resid 36   and name HG2%)
 OR { 1760}
   (( segid "    " and resid 49   and name HB3 ))
   (  segid "    " and resid 40   and name HD1%)
 OR { 1760}
   (( segid "    " and resid 49   and name HB3 ))
   (  segid "    " and resid 33   and name HG2%)
 OR { 1760}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 33   and name HG2%)
 OR { 1760}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 40   and name HD2%)
 OR { 1760}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 36   and name HG2%)
 OR { 1760}
   (( segid "    " and resid 53   and name HB2 ))
   (  segid "    " and resid 59   and name HD2%)
 ASSI { 1772}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 88   and name HA  ))
      3.800     1.800     1.800 peak  1772 spectrum    1 weight  0.10000E+01 volume  0.68208E-03 ppm1      7.039 ppm2      3.942 CV     1
 OR { 1772}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 123  and name HA  ))
 ASSI { 1777}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 92   and name HD2 ))
      4.200     2.200     1.800 peak  1777 spectrum    1 weight  0.10000E+01 volume  0.39090E-03 ppm1      7.202 ppm2      2.922 CV     1
 OR { 1777}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 88   and name HB2 ))
 ASSI { 1783}
   (  segid "    " and resid 88   and name HD% )
   (  segid "    " and resid 97   and name HG2%)
      2.600     0.800     0.800 peak  1783 spectrum    1 weight  0.10000E+01 volume  0.34426E-02 ppm1      7.043 ppm2      1.021 CV     1
 OR { 1783}
   (  segid "    " and resid 88   and name HD% )
   (  segid "    " and resid 97   and name HG1%)
 OR { 1783}
   (  segid "    " and resid 88   and name HD% )
   (  segid "    " and resid 101  and name HD1%)
 ASSI { 1784}
   (  segid "    " and resid 88   and name HD% )
   (  segid "    " and resid 118  and name HD2%)
      2.700     0.900     0.900 peak  1784 spectrum    1 weight  0.10000E+01 volume  0.18876E-02 ppm1      7.042 ppm2      0.796 CV     1
 OR { 1784}
   (  segid "    " and resid 88   and name HD% )
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 1785}
   (  segid "    " and resid 88   and name HE% )
   (  segid "    " and resid 97   and name HG1%)
      3.000     1.100     1.100 peak  1785 spectrum    1 weight  0.10000E+01 volume  0.20075E-02 ppm1      7.200 ppm2      1.019 CV     1
 OR { 1785}
   (  segid "    " and resid 88   and name HE% )
   (  segid "    " and resid 97   and name HG2%)
 OR { 1785}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 123  and name HB2 ))
 ASSI { 1786}
   (  segid "    " and resid 88   and name HE% )
   (  segid "    " and resid 123  and name HD1%)
      3.200     1.300     1.300 peak  1786 spectrum    1 weight  0.10000E+01 volume  0.20289E-02 ppm1      7.206 ppm2      0.800 CV     1
 OR { 1786}
   (  segid "    " and resid 88   and name HE% )
   (  segid "    " and resid 118  and name HD2%)
 ASSI { 1788}
   (  segid "    " and resid 88   and name HE% )
   (  segid "    " and resid 124  and name HG1%)
      4.100     2.100     1.900 peak  1788 spectrum    1 weight  0.10000E+01 volume  0.80689E-03 ppm1      7.205 ppm2      0.514 CV     1
 OR { 1788}
   (  segid "    " and resid 88   and name HE% )
   (  segid "    " and resid 118  and name HD1%)
 ASSI { 1789}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 92   and name HB2 ))
      4.400     2.400     1.600 peak  1789 spectrum    1 weight  0.10000E+01 volume  0.42256E-03 ppm1      7.201 ppm2      1.508 CV     1
 OR { 1789}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 118  and name HB3 ))
 OR { 1789}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 92   and name HG3 ))
 ASSI { 1790}
   (( segid "    " and resid 88   and name HB3 ))
   (  segid "    " and resid 118  and name HD2%)
      3.800     1.800     1.800 peak  1790 spectrum    1 weight  0.10000E+01 volume  0.35066E-03 ppm1      3.184 ppm2      0.780 CV     1
 OR { 1790}
   (( segid "    " and resid 88   and name HB3 ))
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 1794}
   (( segid "    " and resid 88   and name HB2 ))
   (  segid "    " and resid 84   and name HD2%)
      4.100     2.100     1.900 peak  1794 spectrum    1 weight  0.10000E+01 volume  0.63719E-03 ppm1      2.964 ppm2      0.640 CV     1
 OR { 1794}
   (( segid "    " and resid 88   and name HB2 ))
   (  segid "    " and resid 123  and name HD2%)
 OR { 1794}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 123  and name HB3 ))
 ASSI { 1795}
   (( segid "    " and resid 88   and name HB2 ))
   (  segid "    " and resid 118  and name HD2%)
      3.300     1.400     1.400 peak  1795 spectrum    1 weight  0.10000E+01 volume  0.90606E-03 ppm1      2.966 ppm2      0.774 CV     1
 OR { 1795}
   (( segid "    " and resid 88   and name HB2 ))
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 1796}
   (( segid "    " and resid 88   and name HB2 ))
   (  segid "    " and resid 101  and name HD1%)
      2.900     1.100     1.100 peak  1796 spectrum    1 weight  0.10000E+01 volume  0.14176E-02 ppm1      2.957 ppm2      0.982 CV     1
 OR { 1796}
   (( segid "    " and resid 88   and name HB2 ))
   (  segid "    " and resid 97   and name HG2%)
 ASSI { 1797}
   (( segid "    " and resid 88   and name HB3 ))
   (  segid "    " and resid 101  and name HD1%)
      4.400     2.500     1.600 peak  1797 spectrum    1 weight  0.10000E+01 volume  0.77339E-03 ppm1      3.176 ppm2      1.007 CV     1
 OR { 1797}
   (( segid "    " and resid 88   and name HB3 ))
   (  segid "    " and resid 97   and name HG2%)
 OR { 1797}
   (( segid "    " and resid 88   and name HB3 ))
   (  segid "    " and resid 97   and name HG1%)
 ASSI { 1802}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 97   and name HB  ))
      4.500     2.600     1.500 peak  1802 spectrum    1 weight  0.10000E+01 volume  0.83556E-03 ppm1      3.946 ppm2      2.217 CV     1
 OR { 1802}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI { 1803}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 84   and name HD2%)
      4.700     2.800     1.300 peak  1803 spectrum    1 weight  0.10000E+01 volume  0.57420E-03 ppm1      3.938 ppm2      0.635 CV     1
 OR { 1803}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 123  and name HD2%)
 OR { 1803}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 123  and name HB3 ))
 ASSI { 1806}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HB3 ))
      2.800     1.000     1.000 peak  1806 spectrum    1 weight  0.10000E+01 volume  0.49255E-02 ppm1      3.967 ppm2      1.698 CV     1
 OR { 1806}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HG  ))
 ASSI { 1813}
   (( segid "    " and resid 20   and name HB3 ))
   (  segid "    " and resid 36   and name HG2%)
      3.200     1.300     1.300 peak  1813 spectrum    1 weight  0.10000E+01 volume  0.16163E-02 ppm1      2.061 ppm2      0.985 CV     1
 OR { 1813}
   (( segid "    " and resid 20   and name HB3 ))
   (  segid "    " and resid 36   and name HD1%)
 OR { 1813}
   (( segid "    " and resid 20   and name HB3 ))
   (  segid "    " and resid 32   and name HG2%)
 ASSI { 1814}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 20   and name HA  ))
      3.400     1.400     1.400 peak  1814 spectrum    1 weight  0.10000E+01 volume  0.79107E-03 ppm1      2.048 ppm2      3.965 CV     1
 OR { 1814}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI { 1815}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HA  ))
      3.400     1.500     1.500 peak  1815 spectrum    1 weight  0.10000E+01 volume  0.61107E-03 ppm1      1.142 ppm2      3.963 CV     1
 OR { 1815}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI { 1820}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 19   and name HG3 ))
      4.400     2.400     1.600 peak  1820 spectrum    1 weight  0.10000E+01 volume  0.65423E-03 ppm1      2.057 ppm2      2.395 CV     1
 OR { 1820}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 32   and name HB  ))
 ASSI { 1821}
   (( segid "    " and resid 64   and name HD2 ))
   (( segid "    " and resid 64   and name H   ))
      3.500     1.500     1.500 peak  1821 spectrum    1 weight  0.10000E+01 volume  0.17772E-02 ppm1      1.691 ppm2      8.326 CV     1
 OR { 1821}
   (( segid "    " and resid 64   and name HD3 ))
   (( segid "    " and resid 64   and name H   ))
 OR { 1821}
   (( segid "    " and resid 48   and name HD3 ))
   (( segid "    " and resid 48   and name H   ))
 OR { 1821}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 48   and name H   ))
 ASSI { 1827}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 20   and name HB3 ))
      2.500     0.800     0.800 peak  1827 spectrum    1 weight  0.10000E+01 volume  0.42458E-02 ppm1      0.668 ppm2      2.058 CV     1
 OR { 1827}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 36   and name HG13))
 ASSI { 1829}
   (  segid "    " and resid 20   and name HD1%)
   (  segid "    " and resid 23   and name HB% )
      2.600     0.800     0.800 peak  1829 spectrum    1 weight  0.10000E+01 volume  0.58389E-02 ppm1      0.668 ppm2      1.433 CV     1
 OR { 1829}
   (  segid "    " and resid 20   and name HD1%)
   (  segid "    " and resid 35   and name HB% )
 ASSI { 1833}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 19   and name HG3 ))
      3.700     1.700     1.700 peak  1833 spectrum    1 weight  0.10000E+01 volume  0.15602E-02 ppm1      0.667 ppm2      2.356 CV     1
 OR { 1833}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 32   and name HB  ))
 ASSI { 1837}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 16   and name HE1 ))
      4.700     2.800     1.300 peak  1837 spectrum    1 weight  0.10000E+01 volume  0.62996E-03 ppm1      0.668 ppm2      8.313 CV     1
 OR { 1837}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 18   and name H   ))
 ASSI { 1839}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 19   and name H   ))
      4.300     2.300     1.700 peak  1839 spectrum    1 weight  0.10000E+01 volume  0.10376E-02 ppm1      0.668 ppm2      7.992 CV     1
 OR { 1839}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 33   and name H   ))
 OR { 1839}
   (  segid "    " and resid 20   and name HD1%)
   (( segid "    " and resid 34   and name H   ))
 ASSI { 1844}
   (( segid "    " and resid 82   and name HG  ))
   (( segid "    " and resid 82   and name H   ))
      3.800     1.800     1.800 peak  1844 spectrum    1 weight  0.10000E+01 volume  0.35141E-02 ppm1      1.808 ppm2      8.137 CV     1
 OR { 1844}
   (( segid "    " and resid 82   and name HG  ))
   (( segid "    " and resid 83   and name H   ))
 ASSI { 1845}
   (( segid "    " and resid 111  and name HD3 ))
   (  segid "    " and resid 131  and name HD% )
      4.100     2.100     1.900 peak  1845 spectrum    1 weight  0.10000E+01 volume  0.79739E-03 ppm1      3.209 ppm2      7.113 CV     1
 OR { 1845}
   (( segid "    " and resid 127  and name HD2 ))
   (  segid "    " and resid 131  and name HD% )
 OR { 1845}
   (( segid "    " and resid 127  and name HD3 ))
   (  segid "    " and resid 131  and name HD% )
 OR { 1845}
   (( segid "    " and resid 128  and name HD3 ))
   (  segid "    " and resid 131  and name HD% )
 ASSI { 1846}
   (( segid "    " and resid 127  and name HD2 ))
   (( segid "    " and resid 116  and name H   ))
      4.600     2.700     1.400 peak  1846 spectrum    1 weight  0.10000E+01 volume  0.35017E-03 ppm1      3.203 ppm2      8.137 CV     1
 OR { 1846}
   (( segid "    " and resid 4    and name HD3 ))
   (( segid "    " and resid 5    and name H   ))
 OR { 1846}
   (( segid "    " and resid 4    and name HD2 ))
   (( segid "    " and resid 5    and name H   ))
 OR { 1846}
   (( segid "    " and resid 5    and name HD3 ))
   (( segid "    " and resid 5    and name H   ))
 ASSI { 1849}
   (( segid "    " and resid 130  and name HG  ))
   (  segid "    " and resid 131  and name HD% )
      4.300     2.300     1.700 peak  1849 spectrum    1 weight  0.10000E+01 volume  0.63457E-03 ppm1      1.663 ppm2      7.103 CV     1
 OR { 1849}
   (( segid "    " and resid 98   and name HG  ))
   (  segid "    " and resid 131  and name HD% )
 OR { 1849}
   (( segid "    " and resid 37   and name HG  ))
   (  segid "    " and resid 66   and name HE% )
 OR { 1849}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 45   and name HE  ))
 OR { 1849}
   (( segid "    " and resid 98   and name HG  ))
   (( segid "    " and resid 76   and name HZ2 ))
 ASSI { 1851}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 38   and name H   ))
      3.800     1.800     1.800 peak  1851 spectrum    1 weight  0.10000E+01 volume  0.75093E-03 ppm1      1.667 ppm2      7.585 CV     1
 OR { 1851}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 39   and name H   ))
 ASSI { 1852}
   (( segid "    " and resid 98   and name HG  ))
   (( segid "    " and resid 114  and name H   ))
      3.500     1.500     1.500 peak  1852 spectrum    1 weight  0.10000E+01 volume  0.14737E-02 ppm1      1.666 ppm2      8.116 CV     1
 OR { 1852}
   (( segid "    " and resid 86   and name HG3 ))
   (( segid "    " and resid 85   and name H   ))
 ASSI { 1855}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 13   and name H   ))
      3.700     1.700     1.700 peak  1855 spectrum    1 weight  0.10000E+01 volume  0.10563E-02 ppm1      4.140 ppm2      8.019 CV     1
 OR { 1855}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 16   and name H   ))
 ASSI { 1857}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 89   and name H   ))
      3.400     1.400     1.400 peak  1857 spectrum    1 weight  0.10000E+01 volume  0.11878E-02 ppm1      4.131 ppm2      8.170 CV     1
 OR { 1857}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 85   and name H   ))
 ASSI { 1865}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HG3 ))
      3.000     1.200     1.200 peak  1865 spectrum    1 weight  0.10000E+01 volume  0.21383E-02 ppm1      4.133 ppm2      1.669 CV     1
 OR { 1865}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 90   and name HG3 ))
 ASSI { 1867}
   (( segid "    " and resid 86   and name HB3 ))
   (( segid "    " and resid 86   and name HG3 ))
      2.300     0.700     0.700 peak  1867 spectrum    1 weight  0.10000E+01 volume  0.68724E-02 ppm1      2.009 ppm2      1.668 CV     1
 OR { 1867}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HG3 ))
 OR { 1867}
   (( segid "    " and resid 86   and name HB3 ))
   (( segid "    " and resid 90   and name HG3 ))
 ASSI { 1873}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 85   and name HB3 ))
      3.400     1.500     1.500 peak  1873 spectrum    1 weight  0.10000E+01 volume  0.31393E-02 ppm1      1.804 ppm2      2.207 CV     1
 OR { 1873}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI { 1875}
   (( segid "    " and resid 82   and name HG  ))
   (( segid "    " and resid 85   and name HG2 ))
      4.300     2.300     1.700 peak  1875 spectrum    1 weight  0.10000E+01 volume  0.10422E-02 ppm1      1.812 ppm2      2.480 CV     1
 OR { 1875}
   (( segid "    " and resid 82   and name HG  ))
   (( segid "    " and resid 83   and name HG3 ))
 ASSI { 1878}
   (( segid "    " and resid 98   and name HG  ))
   (  segid "    " and resid 98   and name HD1%)
      1.800     0.400     0.400 peak  1878 spectrum    1 weight  0.10000E+01 volume  0.21607E-01 ppm1      1.669 ppm2      0.851 CV     1
 OR { 1878}
   (( segid "    " and resid 98   and name HG  ))
   (  segid "    " and resid 98   and name HD2%)
 OR { 1878}
   (( segid "    " and resid 37   and name HG  ))
   (  segid "    " and resid 37   and name HD1%)
 OR { 1878}
   (( segid "    " and resid 37   and name HG  ))
   (  segid "    " and resid 37   and name HD2%)
 ASSI { 1879}
   (( segid "    " and resid 130  and name HG  ))
   (  segid "    " and resid 119  and name HD1%)
      3.100     1.200     1.200 peak  1879 spectrum    1 weight  0.10000E+01 volume  0.68053E-02 ppm1      1.688 ppm2      0.640 CV     1
 OR { 1879}
   (( segid "    " and resid 98   and name HG  ))
   (  segid "    " and resid 84   and name HD2%)
 OR { 1879}
   (( segid "    " and resid 54   and name HG  ))
   (  segid "    " and resid 51   and name HG2%)
 OR { 1879}
   (( segid "    " and resid 37   and name HG  ))
   (  segid "    " and resid 51   and name HG2%)
 ASSI { 1880}
   (( segid "    " and resid 86   and name HG2 ))
   (( segid "    " and resid 86   and name HG3 ))
      1.400     0.200     0.800 peak  1880 spectrum    1 weight  0.10000E+01 volume  0.41166E-01 ppm1      1.802 ppm2      1.670 CV     1
 OR { 1880}
   (( segid "    " and resid 82   and name HG  ))
   (( segid "    " and resid 82   and name HB3 ))
 ASSI { 1889}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name H   ))
      3.100     1.200     1.200 peak  1889 spectrum    1 weight  0.10000E+01 volume  0.12072E-02 ppm1      2.222 ppm2      7.715 CV     1
 OR { 1889}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 46   and name H   ))
 OR { 1889}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 49   and name H   ))
 ASSI { 1897}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 85   and name HE22))
      3.600     1.600     1.600 peak  1897 spectrum    1 weight  0.10000E+01 volume  0.19470E-02 ppm1      2.310 ppm2      7.230 CV     1
 OR { 1897}
   (( segid "    " and resid 85   and name HG3 ))
   (  segid "    " and resid 88   and name HE% )
 ASSI { 1898}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 123  and name HD2%)
      3.200     1.300     1.300 peak  1898 spectrum    1 weight  0.10000E+01 volume  0.32422E-02 ppm1      3.846 ppm2      0.637 CV     1
 OR { 1898}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 51   and name HG2%)
 OR { 1898}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 84   and name HD2%)
 ASSI { 1899}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 85   and name HG2 ))
      3.400     1.400     1.400 peak  1899 spectrum    1 weight  0.10000E+01 volume  0.21612E-02 ppm1      3.843 ppm2      2.490 CV     1
 OR { 1899}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 89   and name HG3 ))
 ASSI { 1901}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 88   and name HB2 ))
      4.200     2.200     1.800 peak  1901 spectrum    1 weight  0.10000E+01 volume  0.11882E-02 ppm1      3.855 ppm2      2.985 CV     1
 OR { 1901}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 51   and name HA  ))
 OR { 1901}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HE2 ))
 ASSI { 1902}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 52   and name HB2 ))
      4.100     2.100     1.900 peak  1902 spectrum    1 weight  0.10000E+01 volume  0.60749E-03 ppm1      3.849 ppm2      3.268 CV     1
 OR { 1902}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 86   and name HD2 ))
 ASSI { 1903}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name H   ))
      2.500     0.800     0.800 peak  1903 spectrum    1 weight  0.10000E+01 volume  0.46453E-02 ppm1      3.824 ppm2      8.067 CV     1
 OR { 1903}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name H   ))
 ASSI { 1904}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 88   and name HD% )
      4.000     2.000     2.000 peak  1904 spectrum    1 weight  0.10000E+01 volume  0.62643E-03 ppm1      3.853 ppm2      7.056 CV     1
 OR { 1904}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 52   and name HD2 ))
 ASSI { 1913}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 86   and name HG2 ))
      4.100     2.100     1.900 peak  1913 spectrum    1 weight  0.10000E+01 volume  0.74510E-03 ppm1      2.483 ppm2      1.787 CV     1
 OR { 1913}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 82   and name HG  ))
 ASSI { 1914}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 86   and name HG3 ))
      3.700     1.700     1.700 peak  1914 spectrum    1 weight  0.10000E+01 volume  0.82281E-03 ppm1      2.479 ppm2      1.691 CV     1
 OR { 1914}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 82   and name HB3 ))
 ASSI { 1915}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 121  and name HB3 ))
      4.700     2.800     1.300 peak  1915 spectrum    1 weight  0.10000E+01 volume  0.63291E-03 ppm1      2.487 ppm2      1.451 CV     1
 OR { 1915}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 84   and name HG  ))
 ASSI { 1916}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 89   and name HB2 ))
      3.400     1.400     1.400 peak  1916 spectrum    1 weight  0.10000E+01 volume  0.27154E-02 ppm1      2.315 ppm2      2.023 CV     1
 OR { 1916}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 86   and name HB2 ))
 OR { 1916}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 86   and name HB3 ))
 ASSI { 1918}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 86   and name HG2 ))
      4.300     2.300     1.700 peak  1918 spectrum    1 weight  0.10000E+01 volume  0.10779E-02 ppm1      2.309 ppm2      1.814 CV     1
 OR { 1918}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 82   and name HG  ))
 OR { 1918}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI { 1919}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 86   and name HG3 ))
      4.300     2.300     1.700 peak  1919 spectrum    1 weight  0.10000E+01 volume  0.82296E-03 ppm1      2.312 ppm2      1.681 CV     1
 OR { 1919}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 82   and name HB3 ))
 ASSI { 1920}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 121  and name HB3 ))
      4.700     2.700     1.300 peak  1920 spectrum    1 weight  0.10000E+01 volume  0.49579E-03 ppm1      2.313 ppm2      1.454 CV     1
 OR { 1920}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 84   and name HG  ))
 ASSI { 1924}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 88   and name HB3 ))
      4.900     3.000     1.100 peak  1924 spectrum    1 weight  0.10000E+01 volume  0.50132E-03 ppm1      2.489 ppm2      3.189 CV     1
 OR { 1924}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 86   and name HD2 ))
 ASSI { 1929}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 86   and name HA  ))
      4.000     2.000     2.000 peak  1929 spectrum    1 weight  0.10000E+01 volume  0.71449E-03 ppm1      2.306 ppm2      4.135 CV     1
 OR { 1929}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 71   and name HB  ))
 OR { 1929}
   (( segid "    " and resid 85   and name HG3 ))
   (( segid "    " and resid 121  and name HA  ))
 ASSI { 1935}
   (( segid "    " and resid 85   and name HB3 ))
   (( segid "    " and resid 86   and name HG2 ))
      3.700     1.700     1.700 peak  1935 spectrum    1 weight  0.10000E+01 volume  0.26001E-02 ppm1      2.221 ppm2      1.841 CV     1
 OR { 1935}
   (( segid "    " and resid 85   and name HB3 ))
   (( segid "    " and resid 82   and name HG  ))
 ASSI { 1939}
   (( segid "    " and resid 85   and name HB2 ))
   (  segid "    " and resid 73   and name HD1%)
      3.100     1.200     1.200 peak  1939 spectrum    1 weight  0.10000E+01 volume  0.22748E-02 ppm1      2.226 ppm2      0.778 CV     1
 OR { 1939}
   (( segid "    " and resid 85   and name HB2 ))
   (  segid "    " and resid 123  and name HD1%)
 OR { 1939}
   (( segid "    " and resid 85   and name HB3 ))
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 1940}
   (( segid "    " and resid 85   and name HB2 ))
   (  segid "    " and resid 123  and name HD2%)
      3.600     1.700     1.700 peak  1940 spectrum    1 weight  0.10000E+01 volume  0.20314E-02 ppm1      2.241 ppm2      0.628 CV     1
 OR { 1940}
   (( segid "    " and resid 85   and name HB3 ))
   (  segid "    " and resid 123  and name HD2%)
 OR { 1940}
   (( segid "    " and resid 85   and name HB2 ))
   (  segid "    " and resid 121  and name HD2%)
 OR { 1940}
   (( segid "    " and resid 85   and name HB2 ))
   (  segid "    " and resid 84   and name HD2%)
 OR { 1940}
   (( segid "    " and resid 85   and name HB3 ))
   (  segid "    " and resid 84   and name HD2%)
 OR { 1940}
   (( segid "    " and resid 85   and name HB3 ))
   (  segid "    " and resid 121  and name HD2%)
 ASSI { 1942}
   (  segid "    " and resid 84   and name HD1%)
   (  segid "    " and resid 118  and name HD1%)
      2.500     0.800     0.800 peak  1942 spectrum    1 weight  0.10000E+01 volume  0.79194E-02 ppm1      1.088 ppm2      0.537 CV     1
 OR { 1942}
   (  segid "    " and resid 115  and name HG1%)
   (  segid "    " and resid 124  and name HG1%)
 ASSI { 1945}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 19   and name H   ))
      4.700     2.700     1.300 peak  1945 spectrum    1 weight  0.10000E+01 volume  0.74112E-03 ppm1      1.069 ppm2      7.983 CV     1
 OR { 1945}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 16   and name H   ))
 OR { 1945}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 43   and name H   ))
 OR { 1945}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 33   and name H   ))
 ASSI { 1946}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 74   and name H   ))
      3.900     1.900     1.900 peak  1946 spectrum    1 weight  0.10000E+01 volume  0.12859E-02 ppm1      1.094 ppm2      8.383 CV     1
 OR { 1946}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 118  and name H   ))
 OR { 1946}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 86   and name H   ))
 OR { 1946}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 118  and name H   ))
 ASSI { 1947}
   (( segid "    " and resid 118  and name HB2 ))
   (  segid "    " and resid 118  and name HD1%)
      3.300     1.400     1.400 peak  1947 spectrum    1 weight  0.10000E+01 volume  0.12114E-02 ppm1      2.031 ppm2      0.515 CV     1
 OR { 1947}
   (( segid "    " and resid 118  and name HB2 ))
   (  segid "    " and resid 124  and name HG1%)
 ASSI { 1948}
   (( segid "    " and resid 84   and name HB3 ))
   (  segid "    " and resid 84   and name HD2%)
      3.300     1.400     1.400 peak  1948 spectrum    1 weight  0.10000E+01 volume  0.14953E-02 ppm1      2.038 ppm2      0.607 CV     1
 OR { 1948}
   (( segid "    " and resid 118  and name HB2 ))
   (  segid "    " and resid 119  and name HD1%)
 OR { 1948}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 123  and name HB3 ))
 ASSI { 1949}
   (( segid "    " and resid 118  and name HB2 ))
   (  segid "    " and resid 130  and name HD1%)
      3.500     1.500     1.500 peak  1949 spectrum    1 weight  0.10000E+01 volume  0.20609E-02 ppm1      2.034 ppm2      0.980 CV     1
 OR { 1949}
   (( segid "    " and resid 118  and name HB2 ))
   (  segid "    " and resid 114  and name HG2%)
 OR { 1949}
   (( segid "    " and resid 84   and name HB3 ))
   (  segid "    " and resid 114  and name HG2%)
 OR { 1949}
   (( segid "    " and resid 118  and name HB2 ))
   (  segid "    " and resid 115  and name HG2%)
 OR { 1949}
   (( segid "    " and resid 84   and name HB3 ))
   (  segid "    " and resid 114  and name HD1%)
 OR { 1949}
   (( segid "    " and resid 84   and name HB3 ))
   (  segid "    " and resid 101  and name HG2%)
 ASSI { 1954}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 84   and name HA  ))
      4.300     2.300     1.700 peak  1954 spectrum    1 weight  0.10000E+01 volume  0.31195E-03 ppm1      2.037 ppm2      4.138 CV     1
 OR { 1954}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 119  and name HA  ))
 ASSI { 1955}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 14   and name HA  ))
      2.600     0.800     0.800 peak  1955 spectrum    1 weight  0.10000E+01 volume  0.21071E-02 ppm1      1.787 ppm2      3.974 CV     1
 OR { 1955}
   (( segid "    " and resid 98   and name HB3 ))
   (( segid "    " and resid 98   and name HA  ))
 OR { 1955}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI { 1956}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 81   and name HA  ))
      4.200     2.200     1.800 peak  1956 spectrum    1 weight  0.10000E+01 volume  0.31721E-03 ppm1      2.041 ppm2      3.963 CV     1
 OR { 1956}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 117  and name HA  ))
 OR { 1956}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 80   and name HA  ))
 OR { 1956}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 123  and name HA  ))
 ASSI { 1958}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 85   and name H   ))
      3.200     1.300     1.300 peak  1958 spectrum    1 weight  0.10000E+01 volume  0.67011E-03 ppm1      2.028 ppm2      8.121 CV     1
 OR { 1958}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 83   and name H   ))
 ASSI { 1959}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 84   and name H   ))
      3.500     1.600     1.600 peak  1959 spectrum    1 weight  0.10000E+01 volume  0.72880E-03 ppm1      1.788 ppm2      8.014 CV     1
 OR { 1959}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 16   and name H   ))
 ASSI { 1960}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 18   and name H   ))
      4.100     2.100     1.900 peak  1960 spectrum    1 weight  0.10000E+01 volume  0.75467E-03 ppm1      1.783 ppm2      8.301 CV     1
 OR { 1960}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 15   and name H   ))
 ASSI { 1961}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 76   and name HZ3 ))
      4.600     2.600     1.400 peak  1961 spectrum    1 weight  0.10000E+01 volume  0.53568E-03 ppm1      4.136 ppm2      7.081 CV     1
 OR { 1961}
   (( segid "    " and resid 129  and name HA  ))
   (  segid "    " and resid 131  and name HD% )
 OR { 1961}
   (( segid "    " and resid 64   and name HA  ))
   (  segid "    " and resid 66   and name HE% )
 OR { 1961}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 76   and name HZ2 ))
 ASSI { 1962}
   (( segid "    " and resid 83   and name HA  ))
   (  segid "    " and resid 82   and name HD1%)
      2.500     0.800     0.800 peak  1962 spectrum    1 weight  0.10000E+01 volume  0.80044E-02 ppm1      4.023 ppm2      0.949 CV     1
 OR { 1962}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 22   and name HD1%)
 OR { 1962}
   (( segid "    " and resid 83   and name HA  ))
   (  segid "    " and resid 82   and name HD2%)
 ASSI { 1963}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 76   and name HE1 ))
      4.400     2.400     1.600 peak  1963 spectrum    1 weight  0.10000E+01 volume  0.71197E-03 ppm1      4.044 ppm2      0.640 CV     1
 OR { 1963}
   (( segid "    " and resid 102  and name HA  ))
   (  segid "    " and resid 84   and name HD2%)
 OR { 1963}
   (( segid "    " and resid 80   and name HA  ))
   (  segid "    " and resid 84   and name HD2%)
 ASSI { 1964}
   (( segid "    " and resid 53   and name HA  ))
   (  segid "    " and resid 57   and name HE% )
      3.200     1.300     1.300 peak  1964 spectrum    1 weight  0.10000E+01 volume  0.49433E-02 ppm1      4.024 ppm2      2.010 CV     1
 OR { 1964}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HB3 ))
 OR { 1964}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 55   and name HB  ))
 OR { 1964}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 57   and name HE% )
 ASSI { 1966}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 56   and name HB2 ))
      2.100     0.600     0.600 peak  1966 spectrum    1 weight  0.10000E+01 volume  0.52027E-02 ppm1      4.018 ppm2      1.710 CV     1
 OR { 1966}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 18   and name HG3 ))
 ASSI { 1967}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HG2 ))
      2.500     0.800     0.800 peak  1967 spectrum    1 weight  0.10000E+01 volume  0.36724E-02 ppm1      4.026 ppm2      2.462 CV     1
 OR { 1967}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HG3 ))
 OR { 1967}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HG2 ))
 ASSI { 1969}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name H   ))
      2.500     0.800     0.800 peak  1969 spectrum    1 weight  0.10000E+01 volume  0.48191E-02 ppm1      4.023 ppm2      8.102 CV     1
 OR { 1969}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name H   ))
 OR { 1969}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 56   and name H   ))
 ASSI { 1970}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name H   ))
      3.200     1.300     1.300 peak  1970 spectrum    1 weight  0.10000E+01 volume  0.15588E-02 ppm1      4.018 ppm2      7.859 CV     1
 OR { 1970}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 57   and name H   ))
 OR { 1970}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 23   and name H   ))
 ASSI { 1971}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name H   ))
      2.500     0.800     0.800 peak  1971 spectrum    1 weight  0.10000E+01 volume  0.41249E-02 ppm1      4.021 ppm2      7.990 CV     1
 OR { 1971}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name H   ))
 OR { 1971}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 84   and name H   ))
 ASSI { 1972}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name H   ))
      3.300     1.300     1.300 peak  1972 spectrum    1 weight  0.10000E+01 volume  0.14729E-02 ppm1      4.027 ppm2      8.666 CV     1
 OR { 1972}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 87   and name H   ))
 ASSI { 1976}
   (( segid "    " and resid 33   and name HB  ))
   (( segid "    " and resid 37   and name HB3 ))
      4.500     2.500     1.500 peak  1976 spectrum    1 weight  0.10000E+01 volume  0.93887E-03 ppm1      2.373 ppm2      1.857 CV     1
 OR { 1976}
   (( segid "    " and resid 33   and name HB  ))
   (( segid "    " and resid 47   and name HB2 ))
 OR { 1976}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 82   and name HG  ))
 OR { 1976}
   (( segid "    " and resid 33   and name HB  ))
   (( segid "    " and resid 47   and name HB3 ))
 ASSI { 1981}
   (( segid "    " and resid 19   and name HG2 ))
   (  segid "    " and resid 23   and name HB% )
      3.800     1.800     1.800 peak  1981 spectrum    1 weight  0.10000E+01 volume  0.16647E-02 ppm1      2.461 ppm2      1.440 CV     1
 OR { 1981}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 105  and name HG13))
 OR { 1981}
   (( segid "    " and resid 34   and name HG2 ))
   (  segid "    " and resid 35   and name HB% )
 ASSI { 1983}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 37   and name HG  ))
      3.700     1.700     1.700 peak  1983 spectrum    1 weight  0.10000E+01 volume  0.16039E-02 ppm1      2.463 ppm2      1.655 CV     1
 OR { 1983}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 18   and name HG2 ))
 OR { 1983}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 82   and name HB3 ))
 OR { 1983}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 86   and name HG3 ))
 ASSI { 1984}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 47   and name HG2 ))
      3.700     1.700     1.700 peak  1984 spectrum    1 weight  0.10000E+01 volume  0.20905E-02 ppm1      2.463 ppm2      1.595 CV     1
 OR { 1984}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 18   and name HG2 ))
 OR { 1984}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 37   and name HB2 ))
 OR { 1984}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 105  and name HG12))
 ASSI { 1985}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 47   and name HG2 ))
      3.800     1.800     1.800 peak  1985 spectrum    1 weight  0.10000E+01 volume  0.21741E-02 ppm1      2.379 ppm2      1.582 CV     1
 OR { 1985}
   (( segid "    " and resid 19   and name HG3 ))
   (( segid "    " and resid 18   and name HG2 ))
 OR { 1985}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 37   and name HB2 ))
 OR { 1985}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 105  and name HG12))
 OR { 1985}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 121  and name HB2 ))
 OR { 1985}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 118  and name HB3 ))
 ASSI { 1987}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HA  ))
      2.500     0.800     0.800 peak  1987 spectrum    1 weight  0.10000E+01 volume  0.43461E-02 ppm1      2.464 ppm2      4.022 CV     1
 OR { 1987}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 83   and name HA  ))
 OR { 1987}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 80   and name HA  ))
 ASSI { 1988}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name H   ))
      3.200     1.200     1.200 peak  1988 spectrum    1 weight  0.10000E+01 volume  0.43717E-02 ppm1      2.465 ppm2      7.986 CV     1
 OR { 1988}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 19   and name H   ))
 OR { 1988}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 84   and name H   ))
 ASSI { 1990}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 18   and name H   ))
      5.100     3.300     0.900 peak  1990 spectrum    1 weight  0.10000E+01 volume  0.53926E-03 ppm1      2.463 ppm2      8.318 CV     1
 OR { 1990}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 16   and name HE1 ))
 ASSI { 1992}
   (( segid "    " and resid 82   and name HB3 ))
   (( segid "    " and resid 82   and name H   ))
      2.600     0.900     0.900 peak  1992 spectrum    1 weight  0.10000E+01 volume  0.27575E-02 ppm1      1.695 ppm2      8.135 CV     1
 OR { 1992}
   (( segid "    " and resid 82   and name HB3 ))
   (( segid "    " and resid 83   and name H   ))
 ASSI { 1993}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name H   ))
      2.800     1.000     1.000 peak  1993 spectrum    1 weight  0.10000E+01 volume  0.28006E-02 ppm1      4.217 ppm2      8.134 CV     1
 OR { 1993}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 85   and name H   ))
 OR { 1993}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 83   and name H   ))
 ASSI { 1995}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name H   ))
      2.800     1.000     1.000 peak  1995 spectrum    1 weight  0.10000E+01 volume  0.28255E-02 ppm1      1.917 ppm2      8.134 CV     1
 OR { 1995}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 83   and name H   ))
 ASSI { 1996}
   (( segid "    " and resid 130  and name HB3 ))
   (( segid "    " and resid 98   and name H   ))
      3.900     1.900     1.900 peak  1996 spectrum    1 weight  0.10000E+01 volume  0.49807E-03 ppm1      1.691 ppm2      8.615 CV     1
 OR { 1996}
   (( segid "    " and resid 82   and name HB3 ))
   (( segid "    " and resid 81   and name H   ))
 ASSI { 1998}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 42   and name H   ))
      2.900     1.000     1.000 peak  1998 spectrum    1 weight  0.10000E+01 volume  0.47624E-02 ppm1      0.979 ppm2      8.135 CV     1
 OR { 1998}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 83   and name H   ))
 OR { 1998}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 82   and name H   ))
 ASSI { 1999}
   (  segid "    " and resid 75   and name HD1%)
   (( segid "    " and resid 75   and name H   ))
      4.000     2.000     2.000 peak  1999 spectrum    1 weight  0.10000E+01 volume  0.12072E-02 ppm1      0.979 ppm2      8.363 CV     1
 OR { 1999}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 86   and name H   ))
 OR { 1999}
   (  segid "    " and resid 138  and name HD2%)
   (( segid "    " and resid 139  and name H   ))
 ASSI { 2000}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 87   and name H   ))
      3.800     1.800     1.800 peak  2000 spectrum    1 weight  0.10000E+01 volume  0.10607E-02 ppm1      0.971 ppm2      8.655 CV     1
 OR { 2000}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 81   and name H   ))
 ASSI { 2004}
   (  segid "    " and resid 138  and name HD2%)
   (( segid "    " and resid 138  and name HG  ))
      2.100     0.500     0.500 peak  2004 spectrum    1 weight  0.10000E+01 volume  0.12942E-01 ppm1      0.978 ppm2      1.694 CV     1
 OR { 2004}
   (  segid "    " and resid 75   and name HD1%)
   (( segid "    " and resid 75   and name HB3 ))
 OR { 2004}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 86   and name HG3 ))
 OR { 2004}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 82   and name HB3 ))
 ASSI { 2005}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 86   and name HG2 ))
      2.000     0.500     0.500 peak  2005 spectrum    1 weight  0.10000E+01 volume  0.18753E-01 ppm1      0.978 ppm2      1.813 CV     1
 OR { 2005}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 82   and name HG  ))
 ASSI { 2006}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 85   and name HB3 ))
      3.100     1.200     1.200 peak  2006 spectrum    1 weight  0.10000E+01 volume  0.47544E-02 ppm1      0.977 ppm2      2.245 CV     1
 OR { 2006}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 17   and name HB3 ))
 OR { 2006}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 83   and name HB3 ))
 OR { 2006}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 85   and name HB2 ))
 ASSI { 2007}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 79   and name HB3 ))
      2.700     2.700     3.300 peak  2007 spectrum    1 weight  0.10000E+01 volume  0.10796E-02 ppm1      0.978 ppm2      2.709 CV     1
 OR { 2007}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 80   and name HG2 ))
 ASSI { 2008}
   (( segid "    " and resid 130  and name HB3 ))
   (  segid "    " and resid 130  and name HD1%)
      2.100     0.600     0.600 peak  2008 spectrum    1 weight  0.10000E+01 volume  0.12513E-01 ppm1      1.690 ppm2      0.959 CV     1
 OR { 2008}
   (( segid "    " and resid 82   and name HB3 ))
   (  segid "    " and resid 82   and name HD2%)
 OR { 2008}
   (( segid "    " and resid 130  and name HB3 ))
   (  segid "    " and resid 130  and name HD2%)
 OR { 2008}
   (( segid "    " and resid 82   and name HB3 ))
   (  segid "    " and resid 82   and name HD1%)
 ASSI { 2011}
   (( segid "    " and resid 54   and name HB3 ))
   (  segid "    " and resid 60   and name HB% )
      2.900     1.100     1.100 peak  2011 spectrum    1 weight  0.10000E+01 volume  0.11817E-02 ppm1      1.925 ppm2      1.245 CV     1
 OR { 2011}
   (( segid "    " and resid 54   and name HB3 ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 2013}
   (( segid "    " and resid 54   and name HB3 ))
   (  segid "    " and resid 59   and name HD1%)
      3.500     1.500     1.500 peak  2013 spectrum    1 weight  0.10000E+01 volume  0.27792E-02 ppm1      1.930 ppm2      0.802 CV     1
 OR { 2013}
   (( segid "    " and resid 54   and name HB3 ))
   (  segid "    " and resid 55   and name HG1%)
 OR { 2013}
   (( segid "    " and resid 54   and name HB3 ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI { 2018}
   (( segid "    " and resid 54   and name HB3 ))
   (( segid "    " and resid 60   and name H   ))
      4.200     2.200     1.800 peak  2018 spectrum    1 weight  0.10000E+01 volume  0.30816E-03 ppm1      1.933 ppm2      7.071 CV     1
 OR { 2018}
   (( segid "    " and resid 54   and name HB3 ))
   (  segid "    " and resid 66   and name HE% )
 ASSI { 2026}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 82   and name HG  ))
      3.900     1.900     1.900 peak  2026 spectrum    1 weight  0.10000E+01 volume  0.14214E-02 ppm1      4.537 ppm2      1.816 CV     1
 OR { 2026}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 64   and name HB2 ))
 OR { 2026}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 81   and name HB2 ))
 ASSI { 2027}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 82   and name HB3 ))
      3.100     1.200     1.200 peak  2027 spectrum    1 weight  0.10000E+01 volume  0.13499E-02 ppm1      4.541 ppm2      1.702 CV     1
 OR { 2027}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 64   and name HB3 ))
 ASSI { 2031}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 82   and name H   ))
      3.800     1.800     1.800 peak  2031 spectrum    1 weight  0.10000E+01 volume  0.66578E-03 ppm1      4.538 ppm2      8.141 CV     1
 OR { 2031}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 83   and name H   ))
 ASSI { 2032}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 76   and name H   ))
      4.100     2.100     1.900 peak  2032 spectrum    1 weight  0.10000E+01 volume  0.52823E-03 ppm1      7.360 ppm2      8.655 CV     1
 OR { 2032}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 77   and name H   ))
 ASSI { 2035}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 76   and name HE1 ))
      4.400     2.500     1.600 peak  2035 spectrum    1 weight  0.10000E+01 volume  0.63692E-03 ppm1      3.152 ppm2      0.671 CV     1
 OR { 2035}
   (( segid "    " and resid 52   and name HB3 ))
   (  segid "    " and resid 51   and name HG2%)
 ASSI { 2040}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 63   and name H   ))
      4.800     2.900     1.200 peak  2040 spectrum    1 weight  0.10000E+01 volume  0.20524E-03 ppm1      7.087 ppm2      8.644 CV     1
 OR { 2040}
   (  segid "    " and resid 66   and name HE% )
   (( segid "    " and resid 61   and name H   ))
 ASSI { 2045}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 73   and name H   ))
      4.500     2.600     1.500 peak  2045 spectrum    1 weight  0.10000E+01 volume  0.10932E-02 ppm1      3.065 ppm2      8.165 CV     1
 OR { 2045}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 120  and name H   ))
 ASSI { 2047}
   (( segid "    " and resid 76   and name HB2 ))
   (  segid "    " and resid 74   and name HG2%)
      3.400     1.400     1.400 peak  2047 spectrum    1 weight  0.10000E+01 volume  0.15784E-02 ppm1      3.148 ppm2      0.927 CV     1
 OR { 2047}
   (( segid "    " and resid 52   and name HB3 ))
   (  segid "    " and resid 50   and name HG2%)
 OR { 2047}
   (( segid "    " and resid 52   and name HB3 ))
   (  segid "    " and resid 63   and name HG2%)
 OR { 2047}
   (( segid "    " and resid 52   and name HB3 ))
   (  segid "    " and resid 63   and name HG1%)
 OR { 2047}
   (( segid "    " and resid 76   and name HB2 ))
   (  segid "    " and resid 114  and name HD1%)
 OR { 2047}
   (( segid "    " and resid 52   and name HB3 ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI { 2048}
   (( segid "    " and resid 52   and name HB3 ))
   (  segid "    " and resid 55   and name HG2%)
      3.600     1.700     1.700 peak  2048 spectrum    1 weight  0.10000E+01 volume  0.14365E-02 ppm1      3.150 ppm2      0.823 CV     1
 OR { 2048}
   (( segid "    " and resid 76   and name HB2 ))
   (  segid "    " and resid 74   and name HG1%)
 OR { 2048}
   (( segid "    " and resid 76   and name HB2 ))
   (  segid "    " and resid 73   and name HG2%)
 OR { 2048}
   (( segid "    " and resid 76   and name HB2 ))
   (  segid "    " and resid 73   and name HD1%)
 OR { 2048}
   (( segid "    " and resid 52   and name HB3 ))
   (  segid "    " and resid 55   and name HG1%)
 ASSI { 2049}
   (( segid "    " and resid 76   and name HB3 ))
   (  segid "    " and resid 74   and name HG1%)
      3.500     1.500     1.500 peak  2049 spectrum    1 weight  0.10000E+01 volume  0.12311E-02 ppm1      3.060 ppm2      0.910 CV     1
 OR { 2049}
   (( segid "    " and resid 76   and name HB3 ))
   (  segid "    " and resid 74   and name HG2%)
 OR { 2049}
   (( segid "    " and resid 72   and name HB2 ))
   (  segid "    " and resid 74   and name HG1%)
 ASSI { 2051}
   (( segid "    " and resid 76   and name HZ2 ))
   (  segid "    " and resid 105  and name HD1%)
      3.900     1.900     1.900 peak  2051 spectrum    1 weight  0.10000E+01 volume  0.59728E-03 ppm1      7.105 ppm2      1.059 CV     1
 OR { 2051}
   (( segid "    " and resid 76   and name HZ2 ))
   (  segid "    " and resid 84   and name HD1%)
 ASSI { 2052}
   (( segid "    " and resid 76   and name HZ2 ))
   (  segid "    " and resid 74   and name HG2%)
      3.600     1.600     1.600 peak  2052 spectrum    1 weight  0.10000E+01 volume  0.11090E-02 ppm1      7.107 ppm2      0.951 CV     1
 OR { 2052}
   (( segid "    " and resid 76   and name HZ2 ))
   (  segid "    " and resid 114  and name HD1%)
 OR { 2052}
   (( segid "    " and resid 76   and name HZ2 ))
   (  segid "    " and resid 114  and name HG2%)
 ASSI { 2053}
   (( segid "    " and resid 76   and name HB2 ))
   (  segid "    " and resid 107  and name HB% )
      4.500     2.500     1.500 peak  2053 spectrum    1 weight  0.10000E+01 volume  0.45178E-03 ppm1      3.136 ppm2      1.162 CV     1
 OR { 2053}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 73   and name HG12))
 OR { 2053}
   (( segid "    " and resid 72   and name HB3 ))
   (  segid "    " and resid 71   and name HG2%)
 ASSI { 2054}
   (( segid "    " and resid 76   and name HB3 ))
   (  segid "    " and resid 107  and name HB% )
      4.300     2.300     1.700 peak  2054 spectrum    1 weight  0.10000E+01 volume  0.54233E-03 ppm1      3.059 ppm2      1.148 CV     1
 OR { 2054}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 73   and name HG12))
 OR { 2054}
   (( segid "    " and resid 72   and name HB2 ))
   (  segid "    " and resid 71   and name HG2%)
 ASSI { 2055}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 56   and name HB2 ))
      4.000     2.000     2.000 peak  2055 spectrum    1 weight  0.10000E+01 volume  0.90998E-03 ppm1      3.151 ppm2      1.704 CV     1
 OR { 2055}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 54   and name HG  ))
 OR { 2055}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 119  and name HB2 ))
 ASSI { 2056}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 48   and name HG3 ))
      4.300     2.300     1.700 peak  2056 spectrum    1 weight  0.10000E+01 volume  0.54810E-03 ppm1      3.151 ppm2      1.525 CV     1
 OR { 2056}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 121  and name HG  ))
 OR { 2056}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 117  and name HB3 ))
 OR { 2056}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 51   and name HG12))
 OR { 2056}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 119  and name HB3 ))
 ASSI { 2057}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 48   and name HG2 ))
      4.300     2.400     1.700 peak  2057 spectrum    1 weight  0.10000E+01 volume  0.57848E-03 ppm1      3.151 ppm2      1.369 CV     1
 OR { 2057}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 73   and name HG13))
 OR { 2057}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 117  and name HB2 ))
 OR { 2057}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 73   and name HG13))
 ASSI { 2058}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 56   and name HG2 ))
      4.700     2.800     1.300 peak  2058 spectrum    1 weight  0.10000E+01 volume  0.67222E-03 ppm1      3.149 ppm2      2.217 CV     1
 OR { 2058}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 53   and name HB2 ))
 ASSI { 2060}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 81   and name HB3 ))
      4.000     2.000     2.000 peak  2060 spectrum    1 weight  0.10000E+01 volume  0.65119E-03 ppm1      3.153 ppm2      1.993 CV     1
 OR { 2060}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 84   and name HB3 ))
 OR { 2060}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 55   and name HB  ))
 OR { 2060}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 74   and name HB  ))
 ASSI { 2061}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 121  and name HG  ))
      4.800     2.800     1.200 peak  2061 spectrum    1 weight  0.10000E+01 volume  0.45513E-03 ppm1      3.048 ppm2      1.546 CV     1
 OR { 2061}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 117  and name HB3 ))
 OR { 2061}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 105  and name HG12))
 ASSI { 2063}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 117  and name HB2 ))
      5.000     3.200     1.000 peak  2063 spectrum    1 weight  0.10000E+01 volume  0.41524E-03 ppm1      3.056 ppm2      1.373 CV     1
 OR { 2063}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 73   and name HG13))
 OR { 2063}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 73   and name HG13))
 ASSI { 2064}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 83   and name HB3 ))
      5.600     4.000     0.400 peak  2064 spectrum    1 weight  0.10000E+01 volume  0.17921E-03 ppm1      3.061 ppm2      2.247 CV     1
 OR { 2064}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 85   and name HB2 ))
 OR { 2064}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 85   and name HB2 ))
 OR { 2064}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 87   and name HB2 ))
 OR { 2064}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 85   and name HB3 ))
 ASSI { 2065}
   (( segid "    " and resid 76   and name HD1 ))
   (  segid "    " and resid 107  and name HB% )
      5.400     3.600     0.600 peak  2065 spectrum    1 weight  0.10000E+01 volume  0.15149E-03 ppm1      7.351 ppm2      1.169 CV     1
 OR { 2065}
   (( segid "    " and resid 76   and name HD1 ))
   (  segid "    " and resid 77   and name HG2%)
 ASSI { 2066}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 73   and name HB  ))
      4.800     2.800     1.200 peak  2066 spectrum    1 weight  0.10000E+01 volume  0.26483E-03 ppm1      7.358 ppm2      1.808 CV     1
 OR { 2066}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 81   and name HB2 ))
 OR { 2066}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 109  and name HB2 ))
 OR { 2066}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI { 2067}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 75   and name HB2 ))
      2.900     2.900     3.100 peak  2067 spectrum    1 weight  0.10000E+01 volume  0.82704E-03 ppm1      7.359 ppm2      1.576 CV     1
 OR { 2067}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 75   and name HG  ))
 OR { 2067}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 105  and name HG12))
 OR { 2067}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 117  and name HB3 ))
 ASSI { 2068}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 74   and name HB  ))
      5.300     3.500     0.700 peak  2068 spectrum    1 weight  0.10000E+01 volume  0.17210E-03 ppm1      7.350 ppm2      2.023 CV     1
 OR { 2068}
   (( segid "    " and resid 76   and name HD1 ))
   (( segid "    " and resid 84   and name HB3 ))
 ASSI { 2070}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 105  and name HG12))
      4.600     2.600     1.400 peak  2070 spectrum    1 weight  0.10000E+01 volume  0.40925E-03 ppm1      7.110 ppm2      1.579 CV     1
 OR { 2070}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 117  and name HB3 ))
 ASSI { 2071}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 109  and name HB3 ))
      4.000     2.000     2.000 peak  2071 spectrum    1 weight  0.10000E+01 volume  0.55574E-03 ppm1      7.105 ppm2      1.458 CV     1
 OR { 2071}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 109  and name HG3 ))
 OR { 2071}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 84   and name HG  ))
 ASSI { 2076}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 114  and name HB  ))
      5.400     3.600     0.600 peak  2076 spectrum    1 weight  0.10000E+01 volume  0.23074E-03 ppm1      7.106 ppm2      2.238 CV     1
 OR { 2076}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 113  and name HB3 ))
 OR { 2076}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 113  and name HB2 ))
 OR { 2076}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI { 2082}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 111  and name HA  ))
      5.400     3.700     0.600 peak  2082 spectrum    1 weight  0.10000E+01 volume  0.20180E-03 ppm1      7.105 ppm2      4.002 CV     1
 OR { 2082}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 80   and name HA  ))
 OR { 2082}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 102  and name HA  ))
 OR { 2082}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 110  and name HB3 ))
 OR { 2082}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 117  and name HA  ))
 ASSI { 2084}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 50   and name HA  ))
      5.300     3.500     0.700 peak  2084 spectrum    1 weight  0.10000E+01 volume  0.31811E-03 ppm1      3.149 ppm2      3.791 CV     1
 OR { 2084}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 56   and name HA  ))
 ASSI { 2086}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 49   and name HA  ))
      4.200     2.200     1.800 peak  2086 spectrum    1 weight  0.10000E+01 volume  0.10340E-02 ppm1      3.149 ppm2      4.195 CV     1
 OR { 2086}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 121  and name HA  ))
 ASSI { 2087}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 52   and name HA  ))
      2.800     1.000     1.000 peak  2087 spectrum    1 weight  0.10000E+01 volume  0.27809E-02 ppm1      3.150 ppm2      4.021 CV     1
 OR { 2087}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 53   and name HA  ))
 OR { 2087}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 120  and name HA  ))
 ASSI { 2088}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 117  and name HA  ))
      5.100     3.200     0.900 peak  2088 spectrum    1 weight  0.10000E+01 volume  0.24832E-03 ppm1      3.058 ppm2      4.002 CV     1
 OR { 2088}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 80   and name HA  ))
 OR { 2088}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 78   and name HA2 ))
 ASSI { 2089}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 73   and name HA  ))
      5.100     3.200     0.900 peak  2089 spectrum    1 weight  0.10000E+01 volume  0.41473E-03 ppm1      3.063 ppm2      4.152 CV     1
 OR { 2089}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 121  and name HA  ))
 OR { 2089}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 71   and name HB  ))
 ASSI { 2091}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 72   and name HD2 ))
      3.000     1.100     1.100 peak  2091 spectrum    1 weight  0.10000E+01 volume  0.18160E-02 ppm1      3.146 ppm2      7.017 CV     1
 OR { 2091}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 76   and name HZ3 ))
 ASSI { 2092}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 72   and name HD2 ))
      3.800     1.800     1.800 peak  2092 spectrum    1 weight  0.10000E+01 volume  0.13012E-02 ppm1      3.062 ppm2      7.005 CV     1
 OR { 2092}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 76   and name HZ3 ))
 ASSI { 2094}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 80   and name HE21))
      5.000     3.100     1.000 peak  2094 spectrum    1 weight  0.10000E+01 volume  0.17941E-03 ppm1      3.152 ppm2      7.481 CV     1
 OR { 2094}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 55   and name H   ))
 ASSI { 2095}
   (( segid "    " and resid 52   and name HB3 ))
   (( segid "    " and resid 52   and name H   ))
      3.300     1.300     1.300 peak  2095 spectrum    1 weight  0.10000E+01 volume  0.41735E-02 ppm1      3.150 ppm2      8.209 CV     1
 OR { 2095}
   (( segid "    " and resid 72   and name HB3 ))
   (( segid "    " and resid 73   and name H   ))
 ASSI { 2096}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 76   and name H   ))
      4.900     3.000     1.100 peak  2096 spectrum    1 weight  0.10000E+01 volume  0.10982E-03 ppm1      3.147 ppm2      8.640 CV     1
 OR { 2096}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 77   and name H   ))
 ASSI { 2097}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 77   and name H   ))
      4.400     2.400     1.600 peak  2097 spectrum    1 weight  0.10000E+01 volume  0.24068E-03 ppm1      3.074 ppm2      8.646 CV     1
 OR { 2097}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 76   and name H   ))
 ASSI { 2098}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 74   and name H   ))
      5.200     3.400     0.800 peak  2098 spectrum    1 weight  0.10000E+01 volume  0.14287E-03 ppm1      3.062 ppm2      8.379 CV     1
 OR { 2098}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 74   and name H   ))
 OR { 2098}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 118  and name H   ))
 ASSI { 2099}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 77   and name H   ))
      3.200     1.300     1.300 peak  2099 spectrum    1 weight  0.10000E+01 volume  0.88656E-03 ppm1      4.945 ppm2      8.658 CV     1
 OR { 2099}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 76   and name H   ))
 ASSI { 2102}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 41   and name H   ))
      2.900     1.000     1.000 peak  2102 spectrum    1 weight  0.10000E+01 volume  0.15631E-02 ppm1      4.455 ppm2      8.398 CV     1
 OR { 2102}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name H   ))
 ASSI { 2108}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 45   and name HD3 ))
      3.200     1.300     1.300 peak  2108 spectrum    1 weight  0.10000E+01 volume  0.16807E-02 ppm1      0.944 ppm2      2.830 CV     1
 OR { 2108}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 41   and name HB2 ))
 OR { 2108}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 41   and name HB3 ))
 ASSI { 2109}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 25   and name HE3 ))
      3.900     1.900     1.900 peak  2109 spectrum    1 weight  0.10000E+01 volume  0.22748E-02 ppm1      0.944 ppm2      3.021 CV     1
 OR { 2109}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 21   and name HB2 ))
 OR { 2109}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 21   and name HB3 ))
 ASSI { 2112}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 39   and name HB3 ))
      4.100     2.100     1.900 peak  2112 spectrum    1 weight  0.10000E+01 volume  0.10656E-02 ppm1      4.463 ppm2      2.822 CV     1
 OR { 2112}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 41   and name HB2 ))
 OR { 2112}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 41   and name HB3 ))
 ASSI { 2115}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HB3 ))
      2.500     0.800     0.800 peak  2115 spectrum    1 weight  0.10000E+01 volume  0.63749E-02 ppm1      4.455 ppm2      1.558 CV     1
 OR { 2115}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HB2 ))
 ASSI { 2117}
   (( segid "    " and resid 75   and name HA  ))
   (  segid "    " and resid 75   and name HD1%)
      2.500     0.800     0.800 peak  2117 spectrum    1 weight  0.10000E+01 volume  0.13122E-01 ppm1      4.457 ppm2      0.913 CV     1
 OR { 2117}
   (( segid "    " and resid 40   and name HA  ))
   (  segid "    " and resid 40   and name HD2%)
 OR { 2117}
   (( segid "    " and resid 75   and name HA  ))
   (  segid "    " and resid 75   and name HD2%)
 ASSI { 2118}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 75   and name H   ))
      2.300     0.700     0.700 peak  2118 spectrum    1 weight  0.10000E+01 volume  0.53176E-02 ppm1      4.094 ppm2      8.389 CV     1
 OR { 2118}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name H   ))
 ASSI { 2119}
   (( segid "    " and resid 74   and name HB  ))
   (( segid "    " and resid 74   and name H   ))
      2.800     1.000     1.000 peak  2119 spectrum    1 weight  0.10000E+01 volume  0.36039E-02 ppm1      2.027 ppm2      8.388 CV     1
 OR { 2119}
   (( segid "    " and resid 74   and name HB  ))
   (( segid "    " and resid 75   and name H   ))
 ASSI { 2120}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 74   and name H   ))
      2.400     0.700     0.700 peak  2120 spectrum    1 weight  0.10000E+01 volume  0.69165E-02 ppm1      0.916 ppm2      8.388 CV     1
 OR { 2120}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 75   and name H   ))
 ASSI { 2122}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 76   and name HE1 ))
      2.500     0.800     0.800 peak  2122 spectrum    1 weight  0.10000E+01 volume  0.98389E-02 ppm1      0.873 ppm2      0.687 CV     1
 OR { 2122}
   (  segid "    " and resid 74   and name HG1%)
   (  segid "    " and resid 121  and name HD1%)
 ASSI { 2124}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 109  and name HB2 ))
      3.400     1.400     1.400 peak  2124 spectrum    1 weight  0.10000E+01 volume  0.26957E-02 ppm1      0.887 ppm2      1.761 CV     1
 OR { 2124}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 73   and name HB  ))
 ASSI { 2126}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 74   and name HB  ))
      1.800     0.400     0.400 peak  2126 spectrum    1 weight  0.10000E+01 volume  0.27217E-01 ppm1      0.877 ppm2      2.036 CV     1
 OR { 2126}
   (  segid "    " and resid 27   and name HG2%)
   (( segid "    " and resid 30   and name HB2 ))
 ASSI { 2129}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 75   and name HG  ))
      3.500     1.500     1.500 peak  2129 spectrum    1 weight  0.10000E+01 volume  0.33708E-02 ppm1      0.872 ppm2      1.586 CV     1
 OR { 2129}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 117  and name HB3 ))
 ASSI { 2130}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 109  and name HB3 ))
      2.900     1.000     1.000 peak  2130 spectrum    1 weight  0.10000E+01 volume  0.38727E-02 ppm1      0.879 ppm2      1.435 CV     1
 OR { 2130}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 109  and name HG3 ))
 OR { 2130}
   (  segid "    " and resid 27   and name HG2%)
   (  segid "    " and resid 35   and name HB% )
 ASSI { 2131}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 117  and name HD2 ))
      2.700     0.900     0.900 peak  2131 spectrum    1 weight  0.10000E+01 volume  0.79941E-02 ppm1      0.875 ppm2      1.126 CV     1
 OR { 2131}
   (  segid "    " and resid 74   and name HG1%)
   (  segid "    " and resid 84   and name HD1%)
 OR { 2131}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 73   and name HG12))
 ASSI { 2133}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 74   and name HA  ))
      2.700     0.900     0.900 peak  2133 spectrum    1 weight  0.10000E+01 volume  0.94820E-02 ppm1      0.873 ppm2      4.096 CV     1
 OR { 2133}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 73   and name HA  ))
 ASSI { 2135}
   (  segid "    " and resid 27   and name HG2%)
   (( segid "    " and resid 30   and name HE21))
      3.100     1.200     1.200 peak  2135 spectrum    1 weight  0.10000E+01 volume  0.23876E-02 ppm1      0.885 ppm2      7.031 CV     1
 OR { 2135}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 76   and name HZ3 ))
 ASSI { 2139}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 114  and name H   ))
      4.000     2.000     2.000 peak  2139 spectrum    1 weight  0.10000E+01 volume  0.88547E-03 ppm1      0.879 ppm2      8.118 CV     1
 OR { 2139}
   (  segid "    " and resid 27   and name HG2%)
   (( segid "    " and resid 24   and name HD21))
 OR { 2139}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 73   and name H   ))
 OR { 2139}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 116  and name H   ))
 ASSI { 2141}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 76   and name HZ3 ))
      3.600     1.600     1.600 peak  2141 spectrum    1 weight  0.10000E+01 volume  0.16291E-02 ppm1      0.917 ppm2      7.006 CV     1
 OR { 2141}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 72   and name HD2 ))
 ASSI { 2151}
   (( segid "    " and resid 74   and name HB  ))
   (( segid "    " and resid 75   and name HG  ))
      3.900     1.900     1.900 peak  2151 spectrum    1 weight  0.10000E+01 volume  0.16333E-02 ppm1      2.025 ppm2      1.590 CV     1
 OR { 2151}
   (( segid "    " and resid 74   and name HB  ))
   (( segid "    " and resid 117  and name HB3 ))
 OR { 2151}
   (( segid "    " and resid 74   and name HB  ))
   (( segid "    " and resid 75   and name HB2 ))
 ASSI { 2153}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 109  and name HB2 ))
      3.100     1.200     1.200 peak  2153 spectrum    1 weight  0.10000E+01 volume  0.34622E-02 ppm1      0.916 ppm2      1.786 CV     1
 OR { 2153}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 73   and name HB  ))
 ASSI { 2156}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 109  and name HG2 ))
      3.200     1.300     1.300 peak  2156 spectrum    1 weight  0.10000E+01 volume  0.33120E-02 ppm1      0.917 ppm2      1.328 CV     1
 OR { 2156}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 117  and name HB2 ))
 ASSI { 2158}
   (  segid "    " and resid 74   and name HG2%)
   (( segid "    " and resid 117  and name HD2 ))
      2.900     1.000     1.000 peak  2158 spectrum    1 weight  0.10000E+01 volume  0.67789E-02 ppm1      0.915 ppm2      1.164 CV     1
 OR { 2158}
   (  segid "    " and resid 74   and name HG2%)
   (  segid "    " and resid 107  and name HB% )
 ASSI { 2159}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 80   and name HB2 ))
      4.600     2.700     1.400 peak  2159 spectrum    1 weight  0.10000E+01 volume  0.54588E-03 ppm1      0.813 ppm2      2.431 CV     1
 OR { 2159}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 83   and name HB2 ))
 OR { 2159}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 109  and name HD3 ))
 OR { 2159}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 89   and name HG2 ))
 ASSI { 2161}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 84   and name HB3 ))
      3.200     1.300     1.300 peak  2161 spectrum    1 weight  0.10000E+01 volume  0.10040E-02 ppm1      0.809 ppm2      2.021 CV     1
 OR { 2161}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 74   and name HB  ))
 ASSI { 2162}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 73   and name HB  ))
      2.400     0.700     0.700 peak  2162 spectrum    1 weight  0.10000E+01 volume  0.93642E-02 ppm1      0.809 ppm2      1.778 CV     1
 OR { 2162}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 81   and name HB2 ))
 ASSI { 2165}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 109  and name HD3 ))
      4.200     2.200     1.800 peak  2165 spectrum    1 weight  0.10000E+01 volume  0.99988E-03 ppm1      0.828 ppm2      2.417 CV     1
 OR { 2165}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 80   and name HB2 ))
 OR { 2165}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 83   and name HB2 ))
 ASSI { 2166}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 85   and name HB2 ))
      3.800     1.800     1.800 peak  2166 spectrum    1 weight  0.10000E+01 volume  0.14889E-02 ppm1      0.831 ppm2      2.262 CV     1
 OR { 2166}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 114  and name HB  ))
 OR { 2166}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 85   and name HB3 ))
 OR { 2166}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 113  and name HB3 ))
 OR { 2166}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 85   and name HG3 ))
 ASSI { 2167}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 84   and name HB3 ))
      3.000     1.100     1.100 peak  2167 spectrum    1 weight  0.10000E+01 volume  0.22892E-02 ppm1      0.832 ppm2      2.016 CV     1
 OR { 2167}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 74   and name HB  ))
 ASSI { 2169}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 117  and name HB3 ))
      2.900     1.100     1.100 peak  2169 spectrum    1 weight  0.10000E+01 volume  0.42843E-02 ppm1      0.830 ppm2      1.582 CV     1
 OR { 2169}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 121  and name HG  ))
 ASSI { 2172}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 73   and name HG12))
      2.100     0.500     0.500 peak  2172 spectrum    1 weight  0.10000E+01 volume  0.15298E-01 ppm1      0.830 ppm2      1.141 CV     1
 OR { 2172}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 117  and name HD2 ))
 ASSI { 2175}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HG12))
      2.500     0.800     0.800 peak  2175 spectrum    1 weight  0.10000E+01 volume  0.23686E-02 ppm1      4.142 ppm2      1.139 CV     1
 OR { 2175}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 117  and name HD2 ))
 ASSI { 2176}
   (( segid "    " and resid 73   and name HA  ))
   (  segid "    " and resid 73   and name HG2%)
      2.200     0.600     0.600 peak  2176 spectrum    1 weight  0.10000E+01 volume  0.11184E-01 ppm1      4.142 ppm2      0.829 CV     1
 OR { 2176}
   (( segid "    " and resid 73   and name HA  ))
   (  segid "    " and resid 74   and name HG1%)
 ASSI { 2178}
   (( segid "    " and resid 73   and name HG12))
   (( segid "    " and resid 73   and name HA  ))
      2.700     0.900     0.900 peak  2178 spectrum    1 weight  0.10000E+01 volume  0.21875E-02 ppm1      1.136 ppm2      4.144 CV     1
 OR { 2178}
   (( segid "    " and resid 117  and name HD2 ))
   (( segid "    " and resid 73   and name HA  ))
 OR { 2178}
   (( segid "    " and resid 73   and name HG12))
   (( segid "    " and resid 71   and name HB  ))
 ASSI { 2179}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 71   and name HB  ))
      3.000     1.100     1.100 peak  2179 spectrum    1 weight  0.10000E+01 volume  0.47532E-02 ppm1      0.809 ppm2      4.145 CV     1
 OR { 2179}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 73   and name HA  ))
 ASSI { 2180}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 73   and name HA  ))
      2.200     0.600     0.600 peak  2180 spectrum    1 weight  0.10000E+01 volume  0.84038E-02 ppm1      0.830 ppm2      4.141 CV     1
 OR { 2180}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 74   and name HA  ))
 ASSI { 2182}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 85   and name H   ))
      3.500     1.500     1.500 peak  2182 spectrum    1 weight  0.10000E+01 volume  0.16666E-02 ppm1      0.808 ppm2      8.165 CV     1
 OR { 2182}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 82   and name H   ))
 OR { 2182}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 73   and name H   ))
 ASSI { 2184}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 73   and name H   ))
      3.500     1.600     1.600 peak  2184 spectrum    1 weight  0.10000E+01 volume  0.21409E-02 ppm1      0.829 ppm2      8.162 CV     1
 OR { 2184}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 85   and name H   ))
 OR { 2184}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 121  and name H   ))
 ASSI { 2185}
   (( segid "    " and resid 73   and name HG12))
   (( segid "    " and resid 73   and name H   ))
      3.300     1.400     1.400 peak  2185 spectrum    1 weight  0.10000E+01 volume  0.14227E-02 ppm1      1.134 ppm2      8.160 CV     1
 OR { 2185}
   (( segid "    " and resid 73   and name HG12))
   (( segid "    " and resid 121  and name H   ))
 ASSI { 2191}
   (( segid "    " and resid 73   and name HB  ))
   (( segid "    " and resid 76   and name H   ))
      4.200     2.200     1.800 peak  2191 spectrum    1 weight  0.10000E+01 volume  0.46504E-03 ppm1      1.771 ppm2      8.645 CV     1
 OR { 2191}
   (( segid "    " and resid 73   and name HB  ))
   (( segid "    " and resid 81   and name H   ))
 ASSI { 2192}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 81   and name H   ))
      5.000     3.100     1.000 peak  2192 spectrum    1 weight  0.10000E+01 volume  0.31436E-03 ppm1      0.825 ppm2      8.659 CV     1
 OR { 2192}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 76   and name H   ))
 ASSI { 2201}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 76   and name HZ3 ))
      4.900     3.000     1.100 peak  2201 spectrum    1 weight  0.10000E+01 volume  0.27534E-03 ppm1      0.812 ppm2      7.010 CV     1
 OR { 2201}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 72   and name HD2 ))
 ASSI { 2208}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 88   and name HB3 ))
      4.300     2.300     1.700 peak  2208 spectrum    1 weight  0.10000E+01 volume  0.50910E-03 ppm1      0.810 ppm2      3.210 CV     1
 OR { 2208}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 86   and name HD2 ))
 ASSI { 2209}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 76   and name HB3 ))
      4.900     3.000     1.100 peak  2209 spectrum    1 weight  0.10000E+01 volume  0.48902E-03 ppm1      0.809 ppm2      3.018 CV     1
 OR { 2209}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 72   and name HB2 ))
 ASSI { 2211}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 80   and name HG2 ))
      5.300     3.600     0.700 peak  2211 spectrum    1 weight  0.10000E+01 volume  0.30297E-03 ppm1      0.808 ppm2      2.693 CV     1
 OR { 2211}
   (  segid "    " and resid 73   and name HD1%)
   (( segid "    " and resid 79   and name HB3 ))
 ASSI { 2216}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 109  and name HD2 ))
      4.700     2.700     1.300 peak  2216 spectrum    1 weight  0.10000E+01 volume  0.41380E-03 ppm1      0.826 ppm2      2.783 CV     1
 OR { 2216}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 80   and name HG3 ))
 ASSI { 2218}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 88   and name HB3 ))
      4.400     2.500     1.600 peak  2218 spectrum    1 weight  0.10000E+01 volume  0.47268E-03 ppm1      0.830 ppm2      3.225 CV     1
 OR { 2218}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 127  and name HD3 ))
 OR { 2218}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 127  and name HD2 ))
 ASSI { 2219}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 76   and name HB2 ))
      4.100     2.100     1.900 peak  2219 spectrum    1 weight  0.10000E+01 volume  0.56933E-03 ppm1      0.828 ppm2      3.164 CV     1
 OR { 2219}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 72   and name HB3 ))
 ASSI { 2220}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 76   and name HB3 ))
      4.600     2.700     1.400 peak  2220 spectrum    1 weight  0.10000E+01 volume  0.50833E-03 ppm1      0.824 ppm2      3.045 CV     1
 OR { 2220}
   (  segid "    " and resid 73   and name HG2%)
   (( segid "    " and resid 72   and name HB2 ))
 ASSI { 2222}
   (( segid "    " and resid 73   and name HB  ))
   (( segid "    " and resid 76   and name HB2 ))
      4.500     2.500     1.500 peak  2222 spectrum    1 weight  0.10000E+01 volume  0.20097E-03 ppm1      1.773 ppm2      3.144 CV     1
 OR { 2222}
   (( segid "    " and resid 73   and name HB  ))
   (( segid "    " and resid 72   and name HB3 ))
 ASSI { 2223}
   (( segid "    " and resid 73   and name HG12))
   (( segid "    " and resid 73   and name HB  ))
      2.800     1.000     1.000 peak  2223 spectrum    1 weight  0.10000E+01 volume  0.44255E-02 ppm1      1.136 ppm2      1.778 CV     1
 OR { 2223}
   (( segid "    " and resid 73   and name HG12))
   (( segid "    " and resid 81   and name HB2 ))
 ASSI { 2225}
   (( segid "    " and resid 73   and name HG12))
   (  segid "    " and resid 73   and name HD1%)
      2.000     0.500     0.500 peak  2225 spectrum    1 weight  0.10000E+01 volume  0.17037E-01 ppm1      1.135 ppm2      0.822 CV     1
 OR { 2225}
   (( segid "    " and resid 73   and name HG12))
   (  segid "    " and resid 73   and name HG2%)
 OR { 2225}
   (( segid "    " and resid 117  and name HD2 ))
   (  segid "    " and resid 74   and name HG1%)
 ASSI { 2226}
   (( segid "    " and resid 73   and name HG12))
   (( segid "    " and resid 72   and name HB3 ))
      4.500     2.500     1.500 peak  2226 spectrum    1 weight  0.10000E+01 volume  0.23052E-03 ppm1      1.132 ppm2      3.114 CV     1
 OR { 2226}
   (( segid "    " and resid 73   and name HG12))
   (( segid "    " and resid 76   and name HB2 ))
 ASSI { 2227}
   (( segid "    " and resid 73   and name HG13))
   (( segid "    " and resid 72   and name HB3 ))
      4.800     2.900     1.200 peak  2227 spectrum    1 weight  0.10000E+01 volume  0.33944E-03 ppm1      1.392 ppm2      3.158 CV     1
 OR { 2227}
   (( segid "    " and resid 73   and name HG13))
   (( segid "    " and resid 76   and name HB2 ))
 ASSI { 2233}
   (( segid "    " and resid 72   and name HD2 ))
   (( segid "    " and resid 73   and name H   ))
      4.400     2.400     1.600 peak  2233 spectrum    1 weight  0.10000E+01 volume  0.31169E-03 ppm1      7.007 ppm2      8.168 CV     1
 OR { 2233}
   (( segid "    " and resid 72   and name HD2 ))
   (( segid "    " and resid 120  and name H   ))
 ASSI { 2234}
   (( segid "    " and resid 72   and name HD2 ))
   (( segid "    " and resid 74   and name H   ))
      5.300     3.500     0.700 peak  2234 spectrum    1 weight  0.10000E+01 volume  0.17369E-03 ppm1      7.003 ppm2      8.400 CV     1
 OR { 2234}
   (( segid "    " and resid 72   and name HD2 ))
   (( segid "    " and resid 118  and name H   ))
 ASSI { 2237}
   (( segid "    " and resid 72   and name HD2 ))
   (( segid "    " and resid 71   and name HA  ))
      5.500     3.800     0.500 peak  2237 spectrum    1 weight  0.10000E+01 volume  0.18656E-03 ppm1      7.006 ppm2      4.330 CV     1
 OR { 2237}
   (( segid "    " and resid 72   and name HD2 ))
   (( segid "    " and resid 113  and name HA  ))
 ASSI { 2238}
   (( segid "    " and resid 72   and name HD2 ))
   (( segid "    " and resid 73   and name HA  ))
      4.000     2.000     2.000 peak  2238 spectrum    1 weight  0.10000E+01 volume  0.43691E-03 ppm1      7.007 ppm2      4.143 CV     1
 OR { 2238}
   (( segid "    " and resid 72   and name HD2 ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI { 2245}
   (( segid "    " and resid 72   and name HE1 ))
   (  segid "    " and resid 75   and name HD1%)
      4.300     2.300     1.700 peak  2245 spectrum    1 weight  0.10000E+01 volume  0.49846E-03 ppm1      7.993 ppm2      0.912 CV     1
 OR { 2245}
   (( segid "    " and resid 72   and name HE1 ))
   (  segid "    " and resid 75   and name HD2%)
 OR { 2245}
   (( segid "    " and resid 72   and name HE1 ))
   (  segid "    " and resid 74   and name HG2%)
 OR { 2245}
   (( segid "    " and resid 72   and name HE1 ))
   (  segid "    " and resid 74   and name HG1%)
 ASSI { 2246}
   (( segid "    " and resid 72   and name HE1 ))
   (  segid "    " and resid 75   and name HD2%)
      4.700     2.800     1.300 peak  2246 spectrum    1 weight  0.10000E+01 volume  0.31811E-03 ppm1      7.994 ppm2      0.842 CV     1
 OR { 2246}
   (( segid "    " and resid 72   and name HE1 ))
   (  segid "    " and resid 74   and name HG1%)
 OR { 2246}
   (( segid "    " and resid 72   and name HE1 ))
   (  segid "    " and resid 73   and name HG2%)
 ASSI { 2247}
   (( segid "    " and resid 72   and name HD2 ))
   (  segid "    " and resid 74   and name HG2%)
      3.700     1.700     1.700 peak  2247 spectrum    1 weight  0.10000E+01 volume  0.20811E-02 ppm1      7.006 ppm2      0.909 CV     1
 OR { 2247}
   (( segid "    " and resid 72   and name HD2 ))
   (  segid "    " and resid 74   and name HG1%)
 OR { 2247}
   (( segid "    " and resid 72   and name HD2 ))
   (  segid "    " and resid 75   and name HD2%)
 ASSI { 2250}
   (( segid "    " and resid 72   and name HD2 ))
   (( segid "    " and resid 73   and name HB  ))
      4.300     2.300     1.700 peak  2250 spectrum    1 weight  0.10000E+01 volume  0.62149E-03 ppm1      7.006 ppm2      1.736 CV     1
 OR { 2250}
   (( segid "    " and resid 72   and name HD2 ))
   (( segid "    " and resid 119  and name HB2 ))
 ASSI { 2254}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 82   and name HD2%)
      3.900     1.900     1.900 peak  2254 spectrum    1 weight  0.10000E+01 volume  0.71699E-03 ppm1      4.322 ppm2      0.903 CV     1
 OR { 2254}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 114  and name HG2%)
 OR { 2254}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 74   and name HG1%)
 OR { 2254}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 130  and name HD2%)
 ASSI { 2255}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 73   and name HD1%)
      4.700     2.700     1.300 peak  2255 spectrum    1 weight  0.10000E+01 volume  0.63520E-03 ppm1      4.317 ppm2      0.836 CV     1
 OR { 2255}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 73   and name HG2%)
 OR { 2255}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 2256}
   (( segid "    " and resid 71   and name HB  ))
   (  segid "    " and resid 82   and name HD2%)
      4.000     2.000     2.000 peak  2256 spectrum    1 weight  0.10000E+01 volume  0.64681E-03 ppm1      4.169 ppm2      0.901 CV     1
 OR { 2256}
   (( segid "    " and resid 71   and name HB  ))
   (  segid "    " and resid 74   and name HG1%)
 ASSI { 2260}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 121  and name HB3 ))
      3.400     1.500     1.500 peak  2260 spectrum    1 weight  0.10000E+01 volume  0.90404E-03 ppm1      4.174 ppm2      1.428 CV     1
 OR { 2260}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 73   and name HG13))
 ASSI { 2261}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 73   and name HG13))
      3.900     1.900     1.900 peak  2261 spectrum    1 weight  0.10000E+01 volume  0.83636E-03 ppm1      4.169 ppm2      1.374 CV     1
 OR { 2261}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 123  and name HG  ))
 ASSI { 2262}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 73   and name HB  ))
      3.000     3.000     3.000 peak  2262 spectrum    1 weight  0.10000E+01 volume  0.75211E-02 ppm1      4.308 ppm2      1.760 CV     1
 OR { 2262}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 81   and name HB2 ))
 ASSI { 2264}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 68   and name HD3 ))
      3.100     3.100     2.900 peak  2264 spectrum    1 weight  0.10000E+01 volume  0.51789E-03 ppm1      4.312 ppm2      3.189 CV     1
 OR { 2264}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 68   and name HD2 ))
 OR { 2264}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 88   and name HB3 ))
 ASSI { 2266}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 121  and name HA  ))
      2.100     0.500     0.500 peak  2266 spectrum    1 weight  0.10000E+01 volume  0.96327E-02 ppm1      4.320 ppm2      4.174 CV     1
 OR { 2266}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HB  ))
 ASSI { 2268}
   (( segid "    " and resid 8    and name HB  ))
   (( segid "    " and resid 7    and name HB2 ))
      4.400     2.400     1.600 peak  2268 spectrum    1 weight  0.10000E+01 volume  0.46694E-03 ppm1      4.178 ppm2      1.707 CV     1
 OR { 2268}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 82   and name HB3 ))
 ASSI { 2271}
   (  segid "    " and resid 71   and name HG2%)
   (( segid "    " and resid 70   and name HA2 ))
      3.700     1.700     1.700 peak  2271 spectrum    1 weight  0.10000E+01 volume  0.19669E-02 ppm1      1.165 ppm2      4.037 CV     1
 OR { 2271}
   (  segid "    " and resid 71   and name HG2%)
   (( segid "    " and resid 70   and name HA3 ))
 OR { 2271}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 80   and name HA  ))
 OR { 2271}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 78   and name HA3 ))
 ASSI { 2272}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 47   and name HD3 ))
      3.400     1.500     1.500 peak  2272 spectrum    1 weight  0.10000E+01 volume  0.12753E-02 ppm1      1.166 ppm2      3.206 CV     1
 OR { 2272}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 52   and name HB2 ))
 ASSI { 2274}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name H   ))
      3.500     1.500     1.500 peak  2274 spectrum    1 weight  0.10000E+01 volume  0.68459E-03 ppm1      4.321 ppm2      8.100 CV     1
 OR { 2274}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 121  and name H   ))
 ASSI { 2276}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 49   and name HE21))
      4.100     2.100     1.900 peak  2276 spectrum    1 weight  0.10000E+01 volume  0.65910E-03 ppm1      1.168 ppm2      7.021 CV     1
 OR { 2276}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 52   and name HD2 ))
 ASSI { 2278}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 53   and name HE1 ))
      4.700     2.800     1.300 peak  2278 spectrum    1 weight  0.10000E+01 volume  0.39367E-03 ppm1      1.169 ppm2      7.989 CV     1
 OR { 2278}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 84   and name H   ))
 OR { 2278}
   (  segid "    " and resid 71   and name HG2%)
   (( segid "    " and resid 84   and name H   ))
 ASSI { 2281}
   (( segid "    " and resid 122  and name HA2 ))
   (  segid "    " and resid 123  and name HD1%)
      3.900     1.900     1.900 peak  2281 spectrum    1 weight  0.10000E+01 volume  0.13452E-02 ppm1      4.020 ppm2      0.823 CV     1
 OR { 2281}
   (( segid "    " and resid 122  and name HA2 ))
   (  segid "    " and resid 124  and name HG2%)
 OR { 2281}
   (( segid "    " and resid 122  and name HA2 ))
   (  segid "    " and resid 119  and name HD2%)
 OR { 2281}
   (( segid "    " and resid 70   and name HA2 ))
   (  segid "    " and resid 73   and name HD1%)
 ASSI { 2283}
   (( segid "    " and resid 70   and name HA2 ))
   (( segid "    " and resid 69   and name HB3 ))
      3.000     1.200     1.200 peak  2283 spectrum    1 weight  0.10000E+01 volume  0.13350E-02 ppm1      4.018 ppm2      1.869 CV     1
 OR { 2283}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 118  and name HG  ))
 OR { 2283}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 124  and name HB  ))
 ASSI { 2284}
   (( segid "    " and resid 70   and name HA3 ))
   (( segid "    " and resid 64   and name HD2 ))
      3.000     1.100     1.100 peak  2284 spectrum    1 weight  0.10000E+01 volume  0.90623E-03 ppm1      4.018 ppm2      1.707 CV     1
 OR { 2284}
   (( segid "    " and resid 70   and name HA3 ))
   (( segid "    " and resid 64   and name HD3 ))
 OR { 2284}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 119  and name HB2 ))
 OR { 2284}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 127  and name HG2 ))
 ASSI { 2285}
   (( segid "    " and resid 70   and name HA3 ))
   (( segid "    " and resid 64   and name HG2 ))
      3.700     1.700     1.700 peak  2285 spectrum    1 weight  0.10000E+01 volume  0.93815E-03 ppm1      4.018 ppm2      1.472 CV     1
 OR { 2285}
   (( segid "    " and resid 70   and name HA2 ))
   (( segid "    " and resid 64   and name HG2 ))
 OR { 2285}
   (( segid "    " and resid 70   and name HA3 ))
   (  segid "    " and resid 120  and name HB% )
 OR { 2285}
   (( segid "    " and resid 122  and name HA2 ))
   (  segid "    " and resid 125  and name HB% )
 OR { 2285}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 121  and name HB3 ))
 OR { 2285}
   (( segid "    " and resid 70   and name HA2 ))
   (  segid "    " and resid 120  and name HB% )
 ASSI { 2286}
   (( segid "    " and resid 70   and name HA2 ))
   (( segid "    " and resid 69   and name HB3 ))
      3.000     1.100     1.100 peak  2286 spectrum    1 weight  0.10000E+01 volume  0.10898E-02 ppm1      4.019 ppm2      1.800 CV     1
 OR { 2286}
   (( segid "    " and resid 70   and name HA2 ))
   (( segid "    " and resid 69   and name HB2 ))
 OR { 2286}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 119  and name HB2 ))
 ASSI { 2288}
   (( segid "    " and resid 70   and name HA3 ))
   (( segid "    " and resid 63   and name HB  ))
      3.200     3.200     2.800 peak  2288 spectrum    1 weight  0.10000E+01 volume  0.64805E-03 ppm1      4.021 ppm2      2.229 CV     1
 OR { 2288}
   (( segid "    " and resid 70   and name HA2 ))
   (( segid "    " and resid 63   and name HB  ))
 OR { 2288}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 85   and name HB2 ))
 OR { 2288}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 126  and name HG3 ))
 OR { 2288}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 115  and name HB  ))
 OR { 2288}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 126  and name HB2 ))
 OR { 2288}
   (( segid "    " and resid 70   and name HA2 ))
   (( segid "    " and resid 85   and name HB2 ))
 OR { 2288}
   (( segid "    " and resid 70   and name HA3 ))
   (( segid "    " and resid 85   and name HB2 ))
 OR { 2288}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 85   and name HB3 ))
 ASSI { 2289}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 118  and name HB2 ))
      4.500     2.600     1.500 peak  2289 spectrum    1 weight  0.10000E+01 volume  0.58425E-03 ppm1      4.020 ppm2      1.989 CV     1
 OR { 2289}
   (( segid "    " and resid 122  and name HA2 ))
   (( segid "    " and resid 126  and name HB3 ))
 ASSI { 2294}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HB3 ))
      2.400     0.700     0.700 peak  2294 spectrum    1 weight  0.10000E+01 volume  0.13344E-01 ppm1      4.405 ppm2      2.413 CV     1
 OR { 2294}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HG3 ))
 OR { 2294}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HG2 ))
 ASSI { 2297}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 55   and name HG1%)
      4.200     2.200     1.800 peak  2297 spectrum    1 weight  0.10000E+01 volume  0.12937E-02 ppm1      4.405 ppm2      0.789 CV     1
 OR { 2297}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 51   and name HD1%)
 OR { 2297}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 54   and name HB2 ))
 ASSI { 2299}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 90   and name HB3 ))
      4.100     2.100     1.900 peak  2299 spectrum    1 weight  0.10000E+01 volume  0.21531E-02 ppm1      2.173 ppm2      1.435 CV     1
 OR { 2299}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 64   and name HG3 ))
 OR { 2299}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 64   and name HG2 ))
 ASSI { 2301}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 90   and name HG3 ))
      2.800     1.000     1.000 peak  2301 spectrum    1 weight  0.10000E+01 volume  0.54487E-02 ppm1      2.050 ppm2      1.704 CV     1
 OR { 2301}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 68   and name HG3 ))
 OR { 2301}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 68   and name HG2 ))
 ASSI { 2304}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 92   and name HD3 ))
      3.600     1.600     1.600 peak  2304 spectrum    1 weight  0.10000E+01 volume  0.75614E-03 ppm1      2.171 ppm2      3.006 CV     1
 OR { 2304}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 48   and name HE3 ))
 ASSI { 2306}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 66   and name HD% )
      4.900     2.900     1.100 peak  2306 spectrum    1 weight  0.10000E+01 volume  0.60053E-03 ppm1      4.406 ppm2      7.299 CV     1
 OR { 2306}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 66   and name HD% )
 ASSI { 2308}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 67   and name HE21))
      4.400     2.400     1.600 peak  2308 spectrum    1 weight  0.10000E+01 volume  0.67052E-03 ppm1      2.170 ppm2      7.532 CV     1
 OR { 2308}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 66   and name H   ))
 ASSI { 2309}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 67   and name HE21))
      4.200     2.200     1.800 peak  2309 spectrum    1 weight  0.10000E+01 volume  0.75031E-03 ppm1      2.054 ppm2      7.539 CV     1
 OR { 2309}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 66   and name H   ))
 ASSI { 2310}
   (( segid "    " and resid 67   and name HB2 ))
   (  segid "    " and resid 66   and name HE% )
      2.600     2.600     3.400 peak  2310 spectrum    1 weight  0.10000E+01 volume  0.53018E-03 ppm1      2.046 ppm2      7.063 CV     1
 OR { 2310}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 52   and name HD2 ))
 ASSI { 2312}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 67   and name HE22))
      4.200     2.200     1.800 peak  2312 spectrum    1 weight  0.10000E+01 volume  0.55321E-03 ppm1      2.175 ppm2      6.948 CV     1
 OR { 2312}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 9    and name HZ2 ))
 OR { 2312}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 9    and name HZ2 ))
 ASSI { 2321}
   (( segid "    " and resid 14   and name HG2 ))
   (( segid "    " and resid 9    and name HE3 ))
      3.700     1.700     1.700 peak  2321 spectrum    1 weight  0.10000E+01 volume  0.12360E-02 ppm1      2.884 ppm2      7.090 CV     1
 OR { 2321}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 66   and name HE% )
 ASSI { 2327}
   (( segid "    " and resid 66   and name HB3 ))
   (  segid "    " and resid 32   and name HG1%)
      4.700     2.700     1.300 peak  2327 spectrum    1 weight  0.10000E+01 volume  0.38036E-03 ppm1      3.365 ppm2      1.280 CV     1
 OR { 2327}
   (( segid "    " and resid 66   and name HB3 ))
   (  segid "    " and resid 60   and name HB% )
 ASSI { 2331}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 32   and name HG1%)
      4.800     2.900     1.200 peak  2331 spectrum    1 weight  0.10000E+01 volume  0.54800E-03 ppm1      2.908 ppm2      1.283 CV     1
 OR { 2331}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 114  and name HG12))
 ASSI { 2333}
   (( segid "    " and resid 14   and name HG2 ))
   (  segid "    " and resid 17   and name HD2%)
      3.000     1.100     1.100 peak  2333 spectrum    1 weight  0.10000E+01 volume  0.19871E-02 ppm1      2.891 ppm2      0.762 CV     1
 OR { 2333}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 51   and name HD1%)
 ASSI { 2339}
   (( segid "    " and resid 79   and name HA  ))
   (  segid "    " and resid 82   and name HD1%)
      3.400     1.400     1.400 peak  2339 spectrum    1 weight  0.10000E+01 volume  0.46103E-02 ppm1      4.577 ppm2      0.954 CV     1
 OR { 2339}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 63   and name HG1%)
 ASSI { 2343}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB2 ))
      2.900     1.100     1.100 peak  2343 spectrum    1 weight  0.10000E+01 volume  0.36163E-02 ppm1      4.586 ppm2      3.997 CV     1
 OR { 2343}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 63   and name HA  ))
 OR { 2343}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 55   and name HA  ))
 OR { 2343}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 78   and name HA3 ))
 ASSI { 2348}
   (( segid "    " and resid 65   and name HB3 ))
   (  segid "    " and resid 63   and name HG1%)
      4.400     2.400     1.600 peak  2348 spectrum    1 weight  0.10000E+01 volume  0.89365E-03 ppm1      2.417 ppm2      0.952 CV     1
 OR { 2348}
   (( segid "    " and resid 65   and name HB3 ))
   (  segid "    " and resid 33   and name HG1%)
 OR { 2348}
   (( segid "    " and resid 65   and name HB3 ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI { 2354}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 63   and name HA  ))
      4.700     2.800     1.300 peak  2354 spectrum    1 weight  0.10000E+01 volume  0.22950E-03 ppm1      2.408 ppm2      3.978 CV     1
 OR { 2354}
   (( segid "    " and resid 65   and name HB3 ))
   (( segid "    " and resid 55   and name HA  ))
 ASSI { 2361}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 49   and name H   ))
      4.100     2.100     1.900 peak  2361 spectrum    1 weight  0.10000E+01 volume  0.49250E-03 ppm1      2.978 ppm2      7.691 CV     1
 OR { 2361}
   (( segid "    " and resid 48   and name HE3 ))
   (( segid "    " and resid 49   and name H   ))
 OR { 2361}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 46   and name H   ))
 ASSI { 2362}
   (( segid "    " and resid 64   and name HA  ))
   (  segid "    " and resid 63   and name HG1%)
      2.800     1.000     1.000 peak  2362 spectrum    1 weight  0.10000E+01 volume  0.56068E-02 ppm1      4.107 ppm2      0.960 CV     1
 OR { 2362}
   (( segid "    " and resid 64   and name HA  ))
   (  segid "    " and resid 63   and name HG2%)
 OR { 2362}
   (( segid "    " and resid 84   and name HA  ))
   (  segid "    " and resid 101  and name HG2%)
 OR { 2362}
   (( segid "    " and resid 84   and name HA  ))
   (  segid "    " and resid 114  and name HG2%)
 OR { 2362}
   (( segid "    " and resid 129  and name HA  ))
   (  segid "    " and resid 130  and name HD1%)
 ASSI { 2363}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HG3 ))
      2.300     0.700     0.700 peak  2363 spectrum    1 weight  0.10000E+01 volume  0.97907E-02 ppm1      4.109 ppm2      1.440 CV     1
 OR { 2363}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HG3 ))
 OR { 2363}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HG2 ))
 OR { 2363}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HG2 ))
 ASSI { 2364}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HB2 ))
      2.200     0.600     0.600 peak  2364 spectrum    1 weight  0.10000E+01 volume  0.11254E-01 ppm1      4.111 ppm2      1.819 CV     1
 OR { 2364}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HB2 ))
 OR { 2364}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB2 ))
 OR { 2364}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HB3 ))
 ASSI { 2373}
   (( segid "    " and resid 64   and name HG3 ))
   (  segid "    " and resid 63   and name HG1%)
      2.600     0.800     0.800 peak  2373 spectrum    1 weight  0.10000E+01 volume  0.55358E-02 ppm1      1.460 ppm2      0.964 CV     1
 OR { 2373}
   (( segid "    " and resid 64   and name HG2 ))
   (  segid "    " and resid 63   and name HG1%)
 OR { 2373}
   (( segid "    " and resid 64   and name HG3 ))
   (  segid "    " and resid 63   and name HG2%)
 OR { 2373}
   (( segid "    " and resid 136  and name HG3 ))
   (  segid "    " and resid 138  and name HD2%)
 OR { 2373}
   (( segid "    " and resid 64   and name HG2 ))
   (  segid "    " and resid 63   and name HG2%)
 ASSI { 2378}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 48   and name HA  ))
      4.300     2.300     1.700 peak  2378 spectrum    1 weight  0.10000E+01 volume  0.17159E-02 ppm1      2.973 ppm2      3.861 CV     1
 OR { 2378}
   (( segid "    " and resid 48   and name HE3 ))
   (( segid "    " and resid 48   and name HA  ))
 OR { 2378}
   (( segid "    " and resid 25   and name HE2 ))
   (( segid "    " and resid 25   and name HA  ))
 OR { 2378}
   (( segid "    " and resid 25   and name HE3 ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI { 2379}
   (( segid "    " and resid 48   and name HE3 ))
   (( segid "    " and resid 52   and name HD2 ))
      4.200     2.200     1.800 peak  2379 spectrum    1 weight  0.10000E+01 volume  0.54664E-03 ppm1      2.973 ppm2      7.064 CV     1
 OR { 2379}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 52   and name HD2 ))
 OR { 2379}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 49   and name HE21))
 ASSI { 2381}
   (( segid "    " and resid 48   and name HD3 ))
   (( segid "    " and resid 49   and name H   ))
      4.300     2.400     1.700 peak  2381 spectrum    1 weight  0.10000E+01 volume  0.79754E-03 ppm1      1.693 ppm2      7.711 CV     1
 OR { 2381}
   (( segid "    " and resid 64   and name HD2 ))
   (( segid "    " and resid 65   and name H   ))
 OR { 2381}
   (( segid "    " and resid 64   and name HD3 ))
   (( segid "    " and resid 65   and name H   ))
 OR { 2381}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 49   and name H   ))
 ASSI { 2394}
   (( segid "    " and resid 32   and name HA  ))
   (  segid "    " and resid 35   and name HB% )
      2.500     0.800     0.800 peak  2394 spectrum    1 weight  0.10000E+01 volume  0.53669E-02 ppm1      3.964 ppm2      1.418 CV     1
 OR { 2394}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 64   and name HG2 ))
 OR { 2394}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 64   and name HG3 ))
 ASSI { 2399}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 64   and name HD2 ))
      2.800     1.000     1.000 peak  2399 spectrum    1 weight  0.10000E+01 volume  0.47464E-02 ppm1      0.963 ppm2      1.674 CV     1
 OR { 2399}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 68   and name HG3 ))
 OR { 2399}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 64   and name HD3 ))
 OR { 2399}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 68   and name HG2 ))
 ASSI { 2400}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 63   and name HB  ))
      2.000     0.500     0.500 peak  2400 spectrum    1 weight  0.10000E+01 volume  0.19459E-01 ppm1      0.963 ppm2      2.212 CV     1
 OR { 2400}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 67   and name HB3 ))
 ASSI { 2402}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 51   and name HA  ))
      3.700     1.700     1.700 peak  2402 spectrum    1 weight  0.10000E+01 volume  0.21923E-02 ppm1      0.964 ppm2      2.978 CV     1
 OR { 2402}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 64   and name HE3 ))
 OR { 2402}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 64   and name HE2 ))
 ASSI { 2408}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 62   and name HA  ))
      4.700     2.800     1.300 peak  2408 spectrum    1 weight  0.10000E+01 volume  0.96100E-03 ppm1      0.965 ppm2      4.577 CV     1
 OR { 2408}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 66   and name HA  ))
 ASSI { 2409}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 67   and name HE22))
      4.300     2.300     1.700 peak  2409 spectrum    1 weight  0.10000E+01 volume  0.80205E-03 ppm1      0.964 ppm2      6.949 CV     1
 OR { 2409}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 66   and name HZ  ))
 ASSI { 2410}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 52   and name HD2 ))
      3.900     1.900     1.900 peak  2410 spectrum    1 weight  0.10000E+01 volume  0.18301E-02 ppm1      0.964 ppm2      7.071 CV     1
 OR { 2410}
   (  segid "    " and resid 63   and name HG2%)
   (  segid "    " and resid 66   and name HE% )
 ASSI { 2417}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 60   and name H   ))
      2.700     0.900     0.900 peak  2417 spectrum    1 weight  0.10000E+01 volume  0.29508E-02 ppm1      3.966 ppm2      7.066 CV     1
 OR { 2417}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 30   and name HE21))
 ASSI { 2419}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 65   and name H   ))
      3.700     1.700     1.700 peak  2419 spectrum    1 weight  0.10000E+01 volume  0.10028E-02 ppm1      3.964 ppm2      7.748 CV     1
 OR { 2419}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 30   and name HE22))
 ASSI { 2420}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name H   ))
      3.200     1.300     1.300 peak  2420 spectrum    1 weight  0.10000E+01 volume  0.16410E-02 ppm1      3.965 ppm2      8.086 CV     1
 OR { 2420}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 36   and name H   ))
 OR { 2420}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 24   and name HD21))
 ASSI { 2421}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 33   and name H   ))
      3.200     1.300     1.300 peak  2421 spectrum    1 weight  0.10000E+01 volume  0.16672E-02 ppm1      3.963 ppm2      7.978 CV     1
 OR { 2421}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 34   and name H   ))
 ASSI { 2425}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 63   and name HB  ))
      4.300     2.400     1.700 peak  2425 spectrum    1 weight  0.10000E+01 volume  0.83827E-03 ppm1      4.581 ppm2      2.196 CV     1
 OR { 2425}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 83   and name HB3 ))
 ASSI { 2429}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 64   and name HE2 ))
      4.400     2.400     1.600 peak  2429 spectrum    1 weight  0.10000E+01 volume  0.50718E-03 ppm1      3.999 ppm2      2.970 CV     1
 OR { 2429}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 64   and name HE3 ))
 OR { 2429}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 51   and name HA  ))
 ASSI { 2441}
   (( segid "    " and resid 61   and name HB2 ))
   (  segid "    " and resid 55   and name HG1%)
      4.600     2.600     1.400 peak  2441 spectrum    1 weight  0.10000E+01 volume  0.90129E-03 ppm1      2.692 ppm2      0.808 CV     1
 OR { 2441}
   (( segid "    " and resid 61   and name HB3 ))
   (  segid "    " and resid 55   and name HG1%)
 OR { 2441}
   (( segid "    " and resid 31   and name HB2 ))
   (  segid "    " and resid 37   and name HD1%)
 OR { 2441}
   (( segid "    " and resid 31   and name HB2 ))
   (  segid "    " and resid 37   and name HD2%)
 ASSI { 2444}
   (( segid "    " and resid 31   and name HB2 ))
   (  segid "    " and resid 35   and name HB% )
      4.400     2.400     1.600 peak  2444 spectrum    1 weight  0.10000E+01 volume  0.65367E-03 ppm1      2.704 ppm2      1.443 CV     1
 OR { 2444}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 64   and name HG3 ))
 OR { 2444}
   (( segid "    " and resid 61   and name HB3 ))
   (( segid "    " and resid 64   and name HG3 ))
 ASSI { 2445}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 64   and name HB2 ))
      4.100     2.100     1.900 peak  2445 spectrum    1 weight  0.10000E+01 volume  0.57230E-03 ppm1      2.708 ppm2      1.812 CV     1
 OR { 2445}
   (( segid "    " and resid 61   and name HB3 ))
   (( segid "    " and resid 64   and name HB2 ))
 OR { 2445}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 30   and name HB3 ))
 ASSI { 2446}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 64   and name HB3 ))
      4.400     2.500     1.600 peak  2446 spectrum    1 weight  0.10000E+01 volume  0.69740E-03 ppm1      2.705 ppm2      1.731 CV     1
 OR { 2446}
   (( segid "    " and resid 61   and name HB3 ))
   (( segid "    " and resid 64   and name HB3 ))
 OR { 2446}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 47   and name HG3 ))
 ASSI { 2447}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 37   and name HG  ))
      4.500     2.600     1.500 peak  2447 spectrum    1 weight  0.10000E+01 volume  0.65990E-03 ppm1      2.709 ppm2      1.684 CV     1
 OR { 2447}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 64   and name HD3 ))
 OR { 2447}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 64   and name HD2 ))
 OR { 2447}
   (( segid "    " and resid 61   and name HB3 ))
   (( segid "    " and resid 64   and name HD3 ))
 OR { 2447}
   (( segid "    " and resid 61   and name HB3 ))
   (( segid "    " and resid 64   and name HD2 ))
 ASSI { 2448}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 30   and name HG2 ))
      3.600     1.600     1.600 peak  2448 spectrum    1 weight  0.10000E+01 volume  0.12652E-02 ppm1      2.676 ppm2      2.145 CV     1
 OR { 2448}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 36   and name HB  ))
 ASSI { 2449}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 65   and name HB3 ))
      4.400     2.400     1.600 peak  2449 spectrum    1 weight  0.10000E+01 volume  0.12437E-02 ppm1      2.688 ppm2      2.425 CV     1
 OR { 2449}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 34   and name HG2 ))
 ASSI { 2450}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 34   and name HA  ))
      4.400     2.400     1.600 peak  2450 spectrum    1 weight  0.10000E+01 volume  0.58836E-03 ppm1      2.700 ppm2      3.996 CV     1
 OR { 2450}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 62   and name HB2 ))
 OR { 2450}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 32   and name HA  ))
 OR { 2450}
   (( segid "    " and resid 61   and name HB3 ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI { 2455}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 55   and name HA  ))
      3.900     1.900     1.900 peak  2455 spectrum    1 weight  0.10000E+01 volume  0.48703E-03 ppm1      4.532 ppm2      3.956 CV     1
 OR { 2455}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI { 2457}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 60   and name H   ))
      4.300     2.400     1.700 peak  2457 spectrum    1 weight  0.10000E+01 volume  0.45789E-03 ppm1      4.535 ppm2      7.060 CV     1
 OR { 2457}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 66   and name HE% )
 ASSI { 2458}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 30   and name HE21))
      5.100     3.200     0.900 peak  2458 spectrum    1 weight  0.10000E+01 volume  0.35121E-03 ppm1      2.701 ppm2      7.072 CV     1
 OR { 2458}
   (( segid "    " and resid 61   and name HB3 ))
   (  segid "    " and resid 66   and name HE% )
 OR { 2458}
   (( segid "    " and resid 61   and name HB2 ))
   (  segid "    " and resid 66   and name HE% )
 OR { 2458}
   (( segid "    " and resid 61   and name HB3 ))
   (( segid "    " and resid 60   and name H   ))
 OR { 2458}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 60   and name H   ))
 ASSI { 2462}
   (( segid "    " and resid 60   and name HA  ))
   (  segid "    " and resid 33   and name HG2%)
      3.600     1.600     1.600 peak  2462 spectrum    1 weight  0.10000E+01 volume  0.71416E-03 ppm1      4.531 ppm2      0.940 CV     1
 OR { 2462}
   (( segid "    " and resid 60   and name HA  ))
   (  segid "    " and resid 33   and name HG1%)
 OR { 2462}
   (( segid "    " and resid 60   and name HA  ))
   (  segid "    " and resid 63   and name HG1%)
 OR { 2462}
   (( segid "    " and resid 60   and name HA  ))
   (  segid "    " and resid 63   and name HG2%)
 ASSI { 2468}
   (  segid "    " and resid 60   and name HB% )
   (  segid "    " and resid 55   and name HG1%)
      2.100     0.500     0.500 peak  2468 spectrum    1 weight  0.10000E+01 volume  0.17537E-01 ppm1      1.234 ppm2      0.784 CV     1
 OR { 2468}
   (  segid "    " and resid 60   and name HB% )
   (( segid "    " and resid 54   and name HB2 ))
 ASSI { 2471}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 40   and name HG  ))
      2.600     0.800     0.800 peak  2471 spectrum    1 weight  0.10000E+01 volume  0.65642E-02 ppm1      1.241 ppm2      1.903 CV     1
 OR { 2471}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 40   and name HB2 ))
 OR { 2471}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 43   and name HB  ))
 ASSI { 2474}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 7    and name HB3 ))
      2.700     2.700     3.300 peak  2474 spectrum    1 weight  0.10000E+01 volume  0.24569E-02 ppm1      1.244 ppm2      2.212 CV     1
 OR { 2474}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 44   and name HB3 ))
 OR { 2474}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 49   and name HB3 ))
 OR { 2474}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 53   and name HB2 ))
 OR { 2474}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 50   and name HB  ))
 OR { 2474}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 49   and name HB2 ))
 ASSI { 2481}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 8    and name HB  ))
      1.900     0.400     0.400 peak  2481 spectrum    1 weight  0.10000E+01 volume  0.31684E-01 ppm1      1.245 ppm2      4.206 CV     1
 OR { 2481}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 42   and name HB  ))
 OR { 2481}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 8    and name HA  ))
 ASSI { 2484}
   (  segid "    " and resid 60   and name HB% )
   (( segid "    " and resid 60   and name H   ))
      2.300     0.700     0.700 peak  2484 spectrum    1 weight  0.10000E+01 volume  0.11012E-01 ppm1      1.234 ppm2      7.074 CV     1
 OR { 2484}
   (  segid "    " and resid 60   and name HB% )
   (  segid "    " and resid 66   and name HE% )
 ASSI { 2486}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 16   and name HE1 ))
      3.800     1.800     1.800 peak  2486 spectrum    1 weight  0.10000E+01 volume  0.14503E-02 ppm1      1.234 ppm2      8.292 CV     1
 OR { 2486}
   (  segid "    " and resid 60   and name HB% )
   (( segid "    " and resid 54   and name H   ))
 ASSI { 2496}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name H   ))
      3.100     1.200     1.200 peak  2496 spectrum    1 weight  0.10000E+01 volume  0.18315E-02 ppm1      4.533 ppm2      7.062 CV     1
 OR { 2496}
   (( segid "    " and resid 60   and name HA  ))
   (  segid "    " and resid 66   and name HE% )
 ASSI { 2497}
   (( segid "    " and resid 59   and name HA  ))
   (  segid "    " and resid 54   and name HD2%)
      4.800     2.900     1.200 peak  2497 spectrum    1 weight  0.10000E+01 volume  0.66387E-03 ppm1      4.200 ppm2      0.397 CV     1
 OR { 2497}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 2503}
   (( segid "    " and resid 59   and name HA  ))
   (  segid "    " and resid 59   and name HD1%)
      3.500     1.500     1.500 peak  2503 spectrum    1 weight  0.10000E+01 volume  0.42734E-02 ppm1      4.197 ppm2      0.834 CV     1
 OR { 2503}
   (( segid "    " and resid 35   and name HA  ))
   (  segid "    " and resid 37   and name HD1%)
 OR { 2503}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 59   and name HD1%)
 OR { 2503}
   (( segid "    " and resid 121  and name HA  ))
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 2505}
   (( segid "    " and resid 35   and name HA  ))
   (  segid "    " and resid 35   and name HB% )
      2.000     0.500     0.500 peak  2505 spectrum    1 weight  0.10000E+01 volume  0.14665E-01 ppm1      4.189 ppm2      1.421 CV     1
 OR { 2505}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 121  and name HB3 ))
 ASSI { 2506}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HB2 ))
      2.600     0.800     0.800 peak  2506 spectrum    1 weight  0.10000E+01 volume  0.70491E-02 ppm1      4.191 ppm2      1.282 CV     1
 OR { 2506}
   (( segid "    " and resid 35   and name HA  ))
   (  segid "    " and resid 38   and name HB% )
 ASSI { 2507}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 18   and name HB3 ))
      3.300     1.400     1.400 peak  2507 spectrum    1 weight  0.10000E+01 volume  0.31017E-02 ppm1      4.200 ppm2      2.099 CV     1
 OR { 2507}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 30   and name HG2 ))
 OR { 2507}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 36   and name HG13))
 OR { 2507}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 36   and name HB  ))
 OR { 2507}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 18   and name HB3 ))
 ASSI { 2508}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 57   and name HE% )
      3.700     1.700     1.700 peak  2508 spectrum    1 weight  0.10000E+01 volume  0.20791E-02 ppm1      4.202 ppm2      1.992 CV     1
 OR { 2508}
   (( segid "    " and resid 59   and name HA  ))
   (  segid "    " and resid 57   and name HE% )
 OR { 2508}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 57   and name HG2 ))
 ASSI { 2509}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 14   and name HB2 ))
      3.400     1.400     1.400 peak  2509 spectrum    1 weight  0.10000E+01 volume  0.14137E-02 ppm1      4.203 ppm2      2.404 CV     1
 OR { 2509}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 34   and name HG2 ))
 OR { 2509}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 19   and name HG3 ))
 OR { 2509}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 13   and name HB2 ))
 ASSI { 2514}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 54   and name HB3 ))
      3.800     1.800     1.800 peak  2514 spectrum    1 weight  0.10000E+01 volume  0.31444E-03 ppm1      1.267 ppm2      1.977 CV     1
 OR { 2514}
   (( segid "    " and resid 59   and name HB2 ))
   (  segid "    " and resid 57   and name HE% )
 ASSI { 2515}
   (  segid "    " and resid 59   and name HD1%)
   (  segid "    " and resid 59   and name HD2%)
      1.700     0.300     0.500 peak  2515 spectrum    1 weight  0.10000E+01 volume  0.60226E-01 ppm1      0.822 ppm2      0.936 CV     1
 OR { 2515}
   (  segid "    " and resid 37   and name HD2%)
   (  segid "    " and resid 33   and name HG2%)
 OR { 2515}
   (  segid "    " and resid 37   and name HD2%)
   (  segid "    " and resid 33   and name HG1%)
 OR { 2515}
   (  segid "    " and resid 59   and name HD1%)
   (  segid "    " and resid 22   and name HD2%)
 OR { 2515}
   (  segid "    " and resid 37   and name HD2%)
   (  segid "    " and resid 50   and name HG2%)
 ASSI { 2517}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 37   and name HG  ))
      1.800     0.400     0.400 peak  2517 spectrum    1 weight  0.10000E+01 volume  0.22023E-01 ppm1      0.823 ppm2      1.668 CV     1
 OR { 2517}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 57   and name HB3 ))
 OR { 2517}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 18   and name HG3 ))
 ASSI { 2518}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 18   and name HB2 ))
      1.900     0.400     0.400 peak  2518 spectrum    1 weight  0.10000E+01 volume  0.15097E-01 ppm1      0.820 ppm2      1.856 CV     1
 OR { 2518}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 47   and name HB2 ))
 OR { 2518}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 37   and name HB3 ))
 OR { 2518}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 47   and name HB3 ))
 ASSI { 2519}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 34   and name HG2 ))
      3.100     1.200     1.200 peak  2519 spectrum    1 weight  0.10000E+01 volume  0.23615E-02 ppm1      0.821 ppm2      2.391 CV     1
 OR { 2519}
   (  segid "    " and resid 119  and name HD2%)
   (( segid "    " and resid 129  and name HG2 ))
 OR { 2519}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 67   and name HG2 ))
 OR { 2519}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 67   and name HG3 ))
 ASSI { 2521}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 18   and name HB3 ))
      2.100     0.600     0.600 peak  2521 spectrum    1 weight  0.10000E+01 volume  0.71921E-02 ppm1      0.824 ppm2      2.108 CV     1
 OR { 2521}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 22   and name HG  ))
 ASSI { 2528}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 16   and name H   ))
      3.300     1.300     1.300 peak  2528 spectrum    1 weight  0.10000E+01 volume  0.20409E-02 ppm1      4.199 ppm2      7.981 CV     1
 OR { 2528}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 19   and name H   ))
 ASSI { 2529}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name H   ))
      2.700     0.900     0.900 peak  2529 spectrum    1 weight  0.10000E+01 volume  0.33624E-02 ppm1      4.190 ppm2      7.870 CV     1
 OR { 2529}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 122  and name H   ))
 ASSI { 2530}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name H   ))
      2.800     1.000     1.000 peak  2530 spectrum    1 weight  0.10000E+01 volume  0.33405E-02 ppm1      4.204 ppm2      8.282 CV     1
 OR { 2530}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 18   and name H   ))
 ASSI { 2535}
   (  segid "    " and resid 37   and name HD2%)
   (  segid "    " and resid 66   and name HE% )
      3.500     1.500     1.500 peak  2535 spectrum    1 weight  0.10000E+01 volume  0.15111E-02 ppm1      0.825 ppm2      7.064 CV     1
 OR { 2535}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 52   and name HD2 ))
 ASSI { 2537}
   (  segid "    " and resid 119  and name HD2%)
   (( segid "    " and resid 126  and name H   ))
      3.600     1.600     1.600 peak  2537 spectrum    1 weight  0.10000E+01 volume  0.24961E-02 ppm1      0.825 ppm2      7.661 CV     1
 OR { 2537}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 59   and name H   ))
 ASSI { 2538}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 34   and name H   ))
      3.200     1.300     1.300 peak  2538 spectrum    1 weight  0.10000E+01 volume  0.21606E-02 ppm1      0.823 ppm2      7.986 CV     1
 OR { 2538}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 33   and name H   ))
 ASSI { 2539}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 18   and name H   ))
      3.500     1.500     1.500 peak  2539 spectrum    1 weight  0.10000E+01 volume  0.22566E-02 ppm1      0.825 ppm2      8.305 CV     1
 OR { 2539}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 48   and name H   ))
 ASSI { 2540}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 37   and name H   ))
      3.300     1.300     1.300 peak  2540 spectrum    1 weight  0.10000E+01 volume  0.38087E-02 ppm1      0.822 ppm2      8.583 CV     1
 OR { 2540}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 22   and name H   ))
 ASSI { 2541}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 21   and name H   ))
      4.100     2.100     1.900 peak  2541 spectrum    1 weight  0.10000E+01 volume  0.12610E-02 ppm1      0.822 ppm2      8.976 CV     1
 OR { 2541}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 47   and name H   ))
 ASSI { 2545}
   (( segid "    " and resid 58   and name HA3 ))
   (  segid "    " and resid 59   and name HD1%)
      4.700     2.800     1.300 peak  2545 spectrum    1 weight  0.10000E+01 volume  0.77576E-03 ppm1      4.080 ppm2      0.832 CV     1
 OR { 2545}
   (( segid "    " and resid 58   and name HA3 ))
   (  segid "    " and resid 55   and name HG2%)
 OR { 2545}
   (( segid "    " and resid 58   and name HA3 ))
   (  segid "    " and resid 55   and name HG1%)
 ASSI { 2547}
   (( segid "    " and resid 58   and name HA2 ))
   (  segid "    " and resid 55   and name HG2%)
      4.600     2.700     1.400 peak  2547 spectrum    1 weight  0.10000E+01 volume  0.53926E-03 ppm1      3.902 ppm2      0.824 CV     1
 OR { 2547}
   (( segid "    " and resid 58   and name HA2 ))
   (  segid "    " and resid 55   and name HG1%)
 OR { 2547}
   (( segid "    " and resid 58   and name HA2 ))
   (  segid "    " and resid 59   and name HD1%)
 ASSI { 2557}
   (( segid "    " and resid 55   and name HB  ))
   (( segid "    " and resid 62   and name H   ))
      3.700     1.700     1.700 peak  2557 spectrum    1 weight  0.10000E+01 volume  0.13688E-02 ppm1      1.987 ppm2      7.866 CV     1
 OR { 2557}
   (( segid "    " and resid 57   and name HG2 ))
   (( segid "    " and resid 57   and name H   ))
 ASSI { 2558}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 101  and name HA  ))
      4.400     2.400     1.600 peak  2558 spectrum    1 weight  0.10000E+01 volume  0.85480E-03 ppm1      3.952 ppm2      3.662 CV     1
 OR { 2558}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 36   and name HA  ))
 ASSI { 2559}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 101  and name HA  ))
      4.300     2.300     1.700 peak  2559 spectrum    1 weight  0.10000E+01 volume  0.95793E-03 ppm1      3.977 ppm2      3.661 CV     1
 OR { 2559}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 36   and name HA  ))
 OR { 2559}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 54   and name HA  ))
 ASSI { 2566}
   (( segid "    " and resid 57   and name HG2 ))
   (  segid "    " and resid 54   and name HD2%)
      5.300     3.500     0.700 peak  2566 spectrum    1 weight  0.10000E+01 volume  0.37539E-03 ppm1      1.986 ppm2      0.409 CV     1
 OR { 2566}
   (( segid "    " and resid 55   and name HB  ))
   (  segid "    " and resid 54   and name HD1%)
 ASSI { 2568}
   (( segid "    " and resid 55   and name HB  ))
   (  segid "    " and resid 60   and name HB% )
      4.100     2.100     1.900 peak  2568 spectrum    1 weight  0.10000E+01 volume  0.68143E-03 ppm1      1.991 ppm2      1.240 CV     1
 OR { 2568}
   (( segid "    " and resid 57   and name HG2 ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 2569}
   (( segid "    " and resid 55   and name HB  ))
   (( segid "    " and resid 55   and name HA  ))
      2.800     1.000     1.000 peak  2569 spectrum    1 weight  0.10000E+01 volume  0.37704E-02 ppm1      1.995 ppm2      3.981 CV     1
 OR { 2569}
   (( segid "    " and resid 57   and name HG2 ))
   (( segid "    " and resid 57   and name HA  ))
 OR { 2569}
   (( segid "    " and resid 11   and name HB3 ))
   (( segid "    " and resid 11   and name HD3 ))
 OR { 2569}
   (( segid "    " and resid 11   and name HB3 ))
   (( segid "    " and resid 11   and name HD2 ))
 ASSI { 2571}
   (( segid "    " and resid 55   and name HB  ))
   (( segid "    " and resid 56   and name H   ))
      3.400     1.400     1.400 peak  2571 spectrum    1 weight  0.10000E+01 volume  0.20024E-02 ppm1      1.999 ppm2      8.072 CV     1
 OR { 2571}
   (( segid "    " and resid 57   and name HG2 ))
   (( segid "    " and resid 56   and name H   ))
 ASSI { 2572}
   (( segid "    " and resid 11   and name HB3 ))
   (( segid "    " and resid 15   and name H   ))
      4.400     2.500     1.600 peak  2572 spectrum    1 weight  0.10000E+01 volume  0.66731E-03 ppm1      2.008 ppm2      8.288 CV     1
 OR { 2572}
   (( segid "    " and resid 55   and name HB  ))
   (( segid "    " and resid 54   and name H   ))
 OR { 2572}
   (( segid "    " and resid 55   and name HB  ))
   (( segid "    " and resid 64   and name H   ))
 ASSI { 2573}
   (( segid "    " and resid 55   and name HB  ))
   (( segid "    " and resid 61   and name H   ))
      5.200     3.300     0.800 peak  2573 spectrum    1 weight  0.10000E+01 volume  0.18369E-03 ppm1      1.992 ppm2      8.636 CV     1
 OR { 2573}
   (( segid "    " and resid 55   and name HB  ))
   (( segid "    " and resid 63   and name H   ))
 ASSI { 2575}
   (( segid "    " and resid 57   and name HG2 ))
   (( segid "    " and resid 59   and name H   ))
      4.100     2.100     1.900 peak  2575 spectrum    1 weight  0.10000E+01 volume  0.40436E-03 ppm1      1.986 ppm2      7.676 CV     1
 OR { 2575}
   (( segid "    " and resid 55   and name HB  ))
   (( segid "    " and resid 59   and name H   ))
 ASSI { 2577}
   (( segid "    " and resid 57   and name HG3 ))
   (( segid "    " and resid 57   and name H   ))
      3.800     1.800     1.800 peak  2577 spectrum    1 weight  0.10000E+01 volume  0.15161E-02 ppm1      2.156 ppm2      7.862 CV     1
 OR { 2577}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 94   and name H   ))
 OR { 2577}
   (( segid "    " and resid 97   and name HB  ))
   (( segid "    " and resid 92   and name H   ))
 ASSI { 2580}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 57   and name HB3 ))
      2.100     0.500     0.500 peak  2580 spectrum    1 weight  0.10000E+01 volume  0.85567E-02 ppm1      1.987 ppm2      1.682 CV     1
 OR { 2580}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 18   and name HG3 ))
 ASSI { 2586}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 14   and name HB2 ))
      2.000     2.000     4.000 peak  2586 spectrum    1 weight  0.10000E+01 volume  0.38337E-02 ppm1      1.987 ppm2      2.394 CV     1
 OR { 2586}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 65   and name HB3 ))
 ASSI { 2594}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 60   and name H   ))
      4.800     2.900     1.200 peak  2594 spectrum    1 weight  0.10000E+01 volume  0.56305E-03 ppm1      1.988 ppm2      7.066 CV     1
 OR { 2594}
   (  segid "    " and resid 57   and name HE% )
   (  segid "    " and resid 66   and name HE% )
 ASSI { 2598}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 18   and name H   ))
      2.700     0.900     0.900 peak  2598 spectrum    1 weight  0.10000E+01 volume  0.35474E-02 ppm1      1.987 ppm2      8.300 CV     1
 OR { 2598}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 54   and name H   ))
 ASSI { 2599}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 19   and name H   ))
      2.400     2.400     3.600 peak  2599 spectrum    1 weight  0.10000E+01 volume  0.15428E-02 ppm1      1.987 ppm2      7.977 CV     1
 OR { 2599}
   (  segid "    " and resid 57   and name HE% )
   (( segid "    " and resid 33   and name H   ))
 ASSI { 2613}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HG2 ))
      2.600     0.800     0.800 peak  2613 spectrum    1 weight  0.10000E+01 volume  0.72161E-02 ppm1      1.717 ppm2      2.217 CV     1
 OR { 2613}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 115  and name HB  ))
 OR { 2613}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 53   and name HB2 ))
 ASSI { 2617}
   (( segid "    " and resid 30   and name HG2 ))
   (  segid "    " and resid 32   and name HG1%)
      4.300     2.300     1.700 peak  2617 spectrum    1 weight  0.10000E+01 volume  0.59408E-03 ppm1      2.142 ppm2      1.296 CV     1
 OR { 2617}
   (( segid "    " and resid 30   and name HG2 ))
   (  segid "    " and resid 38   and name HB% )
 OR { 2617}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 2620}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 56   and name HB3 ))
      2.200     0.600     0.600 peak  2620 spectrum    1 weight  0.10000E+01 volume  0.12457E-01 ppm1      2.219 ppm2      1.853 CV     1
 OR { 2620}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 30   and name HB3 ))
 ASSI { 2621}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 30   and name HB3 ))
      2.200     0.600     0.600 peak  2621 spectrum    1 weight  0.10000E+01 volume  0.97784E-02 ppm1      2.132 ppm2      1.853 CV     1
 OR { 2621}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 56   and name HB3 ))
 ASSI { 2622}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 56   and name HG3 ))
      1.200     0.200     1.000 peak  2622 spectrum    1 weight  0.10000E+01 volume  0.95177E-01 ppm1      2.221 ppm2      2.134 CV     1
 OR { 2622}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 30   and name HG2 ))
 ASSI { 2624}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 31   and name HB3 ))
      5.100     3.300     0.900 peak  2624 spectrum    1 weight  0.10000E+01 volume  0.67923E-03 ppm1      2.214 ppm2      2.871 CV     1
 OR { 2624}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 53   and name HB3 ))
 ASSI { 2625}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 31   and name HB3 ))
      4.600     2.700     1.400 peak  2625 spectrum    1 weight  0.10000E+01 volume  0.58980E-03 ppm1      2.131 ppm2      2.869 CV     1
 OR { 2625}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 53   and name HB3 ))
 ASSI { 2628}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 53   and name HA  ))
      3.900     1.900     1.900 peak  2628 spectrum    1 weight  0.10000E+01 volume  0.28321E-02 ppm1      2.221 ppm2      3.997 CV     1
 OR { 2628}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 52   and name HA  ))
 ASSI { 2630}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 52   and name HA  ))
      3.100     1.200     1.200 peak  2630 spectrum    1 weight  0.10000E+01 volume  0.21909E-02 ppm1      2.127 ppm2      3.999 CV     1
 OR { 2630}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 53   and name HA  ))
 OR { 2630}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 32   and name HA  ))
 ASSI { 2632}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 54   and name HA  ))
      3.900     1.900     1.900 peak  2632 spectrum    1 weight  0.10000E+01 volume  0.68707E-03 ppm1      2.123 ppm2      3.704 CV     1
 OR { 2632}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 36   and name HA  ))
 ASSI { 2638}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 30   and name H   ))
      4.000     2.000     2.000 peak  2638 spectrum    1 weight  0.10000E+01 volume  0.17047E-02 ppm1      2.216 ppm2      7.477 CV     1
 OR { 2638}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 55   and name H   ))
 ASSI { 2640}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 55   and name H   ))
      3.600     1.600     1.600 peak  2640 spectrum    1 weight  0.10000E+01 volume  0.14739E-02 ppm1      2.140 ppm2      7.474 CV     1
 OR { 2640}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 30   and name H   ))
 ASSI { 2644}
   (( segid "    " and resid 56   and name HG2 ))
   (( segid "    " and resid 57   and name H   ))
      4.000     2.000     2.000 peak  2644 spectrum    1 weight  0.10000E+01 volume  0.20414E-02 ppm1      2.220 ppm2      7.860 CV     1
 OR { 2644}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 35   and name H   ))
 ASSI { 2646}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 35   and name H   ))
      3.600     1.700     1.700 peak  2646 spectrum    1 weight  0.10000E+01 volume  0.17312E-02 ppm1      2.128 ppm2      7.859 CV     1
 OR { 2646}
   (( segid "    " and resid 56   and name HG3 ))
   (( segid "    " and resid 57   and name H   ))
 ASSI { 2656}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 54   and name HD2%)
      4.900     3.000     1.100 peak  2656 spectrum    1 weight  0.10000E+01 volume  0.56003E-03 ppm1      3.962 ppm2      0.408 CV     1
 OR { 2656}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 54   and name HD1%)
 OR { 2656}
   (( segid "    " and resid 32   and name HA  ))
   (  segid "    " and resid 54   and name HD1%)
 ASSI { 2658}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 56   and name HB2 ))
      3.900     1.900     1.900 peak  2658 spectrum    1 weight  0.10000E+01 volume  0.20939E-02 ppm1      0.823 ppm2      1.710 CV     1
 OR { 2658}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 54   and name HG  ))
 OR { 2658}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 57   and name HB3 ))
 ASSI { 2659}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 55   and name HB  ))
      2.000     0.500     0.500 peak  2659 spectrum    1 weight  0.10000E+01 volume  0.12740E-01 ppm1      0.820 ppm2      2.006 CV     1
 OR { 2659}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 74   and name HB  ))
 ASSI { 2660}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 63   and name HB  ))
      3.400     1.400     1.400 peak  2660 spectrum    1 weight  0.10000E+01 volume  0.29398E-02 ppm1      0.819 ppm2      2.204 CV     1
 OR { 2660}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 56   and name HG2 ))
 ASSI { 2663}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 52   and name HB2 ))
      4.800     2.900     1.200 peak  2663 spectrum    1 weight  0.10000E+01 volume  0.40781E-03 ppm1      0.821 ppm2      3.238 CV     1
 OR { 2663}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 127  and name HD3 ))
 ASSI { 2665}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 55   and name HA  ))
      2.400     0.700     0.700 peak  2665 spectrum    1 weight  0.10000E+01 volume  0.98798E-02 ppm1      0.820 ppm2      3.971 CV     1
 OR { 2665}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 52   and name HA  ))
 OR { 2665}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 62   and name HB2 ))
 ASSI { 2667}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 62   and name HA  ))
      3.000     1.100     1.100 peak  2667 spectrum    1 weight  0.10000E+01 volume  0.15688E-02 ppm1      0.819 ppm2      4.572 CV     1
 OR { 2667}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 60   and name HA  ))
 ASSI { 2670}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 63   and name H   ))
      3.200     1.300     1.300 peak  2670 spectrum    1 weight  0.10000E+01 volume  0.16407E-02 ppm1      0.821 ppm2      8.647 CV     1
 OR { 2670}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 61   and name H   ))
 ASSI { 2673}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 62   and name H   ))
      3.100     1.200     1.200 peak  2673 spectrum    1 weight  0.10000E+01 volume  0.19459E-02 ppm1      0.819 ppm2      7.867 CV     1
 OR { 2673}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 57   and name H   ))
 ASSI { 2674}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 65   and name H   ))
      4.100     2.100     1.900 peak  2674 spectrum    1 weight  0.10000E+01 volume  0.80287E-03 ppm1      0.819 ppm2      7.669 CV     1
 OR { 2674}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 59   and name H   ))
 ASSI { 2676}
   (  segid "    " and resid 55   and name HG1%)
   (  segid "    " and resid 66   and name HE% )
      2.900     1.100     1.100 peak  2676 spectrum    1 weight  0.10000E+01 volume  0.20044E-02 ppm1      0.820 ppm2      7.068 CV     1
 OR { 2676}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 60   and name H   ))
 ASSI { 2679}
   (( segid "    " and resid 118  and name HA  ))
   (  segid "    " and resid 123  and name HD2%)
      3.500     1.500     1.500 peak  2679 spectrum    1 weight  0.10000E+01 volume  0.28053E-02 ppm1      3.657 ppm2      0.622 CV     1
 OR { 2679}
   (( segid "    " and resid 118  and name HA  ))
   (  segid "    " and resid 121  and name HD2%)
 OR { 2679}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 123  and name HB3 ))
 OR { 2679}
   (( segid "    " and resid 118  and name HA  ))
   (  segid "    " and resid 119  and name HD1%)
 ASSI { 2681}
   (( segid "    " and resid 118  and name HA  ))
   (  segid "    " and resid 121  and name HD1%)
      2.800     1.000     1.000 peak  2681 spectrum    1 weight  0.10000E+01 volume  0.41326E-02 ppm1      3.675 ppm2      0.761 CV     1
 OR { 2681}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HB2 ))
 OR { 2681}
   (( segid "    " and resid 118  and name HA  ))
   (  segid "    " and resid 118  and name HD2%)
 OR { 2681}
   (( segid "    " and resid 118  and name HA  ))
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 2683}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 57   and name HB2 ))
      3.600     1.600     1.600 peak  2683 spectrum    1 weight  0.10000E+01 volume  0.14484E-02 ppm1      3.677 ppm2      2.115 CV     1
 OR { 2683}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 57   and name HG3 ))
 OR { 2683}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 18   and name HB3 ))
 ASSI { 2684}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HB3 ))
      2.700     0.900     0.900 peak  2684 spectrum    1 weight  0.10000E+01 volume  0.25940E-02 ppm1      3.676 ppm2      1.962 CV     1
 OR { 2684}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 57   and name HE% )
 OR { 2684}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB2 ))
 ASSI { 2685}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 57   and name HB3 ))
      2.700     0.900     0.900 peak  2685 spectrum    1 weight  0.10000E+01 volume  0.22570E-02 ppm1      3.680 ppm2      1.720 CV     1
 OR { 2685}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HG  ))
 ASSI { 2688}
   (( segid "    " and resid 54   and name HB2 ))
   (  segid "    " and resid 60   and name HB% )
      3.800     1.800     1.800 peak  2688 spectrum    1 weight  0.10000E+01 volume  0.73021E-03 ppm1      0.732 ppm2      1.243 CV     1
 OR { 2688}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 2696}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 53   and name HB2 ))
      3.600     1.600     1.600 peak  2696 spectrum    1 weight  0.10000E+01 volume  0.13098E-02 ppm1      0.437 ppm2      2.163 CV     1
 OR { 2696}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 17   and name HB3 ))
 OR { 2696}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 57   and name HB2 ))
 OR { 2696}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 57   and name HG3 ))
 ASSI { 2699}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 17   and name HG  ))
      3.600     1.600     1.600 peak  2699 spectrum    1 weight  0.10000E+01 volume  0.21134E-02 ppm1      0.437 ppm2      1.482 CV     1
 OR { 2699}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 51   and name HG12))
 OR { 2699}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 59   and name HG  ))
 ASSI { 2700}
   (  segid "    " and resid 54   and name HD1%)
   (  segid "    " and resid 32   and name HG1%)
      3.100     1.200     1.200 peak  2700 spectrum    1 weight  0.10000E+01 volume  0.30022E-02 ppm1      0.437 ppm2      1.255 CV     1
 OR { 2700}
   (  segid "    " and resid 54   and name HD1%)
   (  segid "    " and resid 60   and name HB% )
 OR { 2700}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 2701}
   (  segid "    " and resid 54   and name HD1%)
   (  segid "    " and resid 33   and name HG2%)
      2.100     0.600     0.600 peak  2701 spectrum    1 weight  0.10000E+01 volume  0.11121E-01 ppm1      0.437 ppm2      0.937 CV     1
 OR { 2701}
   (  segid "    " and resid 54   and name HD1%)
   (  segid "    " and resid 50   and name HG2%)
 OR { 2701}
   (  segid "    " and resid 54   and name HD1%)
   (  segid "    " and resid 36   and name HG2%)
 OR { 2701}
   (  segid "    " and resid 54   and name HD1%)
   (  segid "    " and resid 33   and name HG1%)
 ASSI { 2702}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 54   and name HB2 ))
      2.300     0.600     0.600 peak  2702 spectrum    1 weight  0.10000E+01 volume  0.73483E-02 ppm1      0.437 ppm2      0.751 CV     1
 OR { 2702}
   (  segid "    " and resid 54   and name HD1%)
   (  segid "    " and resid 17   and name HD2%)
 ASSI { 2704}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 55   and name HA  ))
      4.000     2.000     2.000 peak  2704 spectrum    1 weight  0.10000E+01 volume  0.99454E-03 ppm1      0.438 ppm2      3.983 CV     1
 OR { 2704}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 52   and name HA  ))
 OR { 2704}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 63   and name HA  ))
 ASSI { 2706}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 53   and name HB2 ))
      3.700     1.700     1.700 peak  2706 spectrum    1 weight  0.10000E+01 volume  0.18467E-02 ppm1      0.383 ppm2      2.158 CV     1
 OR { 2706}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 57   and name HB2 ))
 OR { 2706}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 57   and name HG3 ))
 ASSI { 2707}
   (  segid "    " and resid 54   and name HD2%)
   (  segid "    " and resid 57   and name HE% )
      2.500     0.800     0.800 peak  2707 spectrum    1 weight  0.10000E+01 volume  0.37895E-02 ppm1      0.382 ppm2      1.969 CV     1
 OR { 2707}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 54   and name HB3 ))
 ASSI { 2708}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 54   and name HG  ))
      2.300     0.700     0.700 peak  2708 spectrum    1 weight  0.10000E+01 volume  0.48861E-02 ppm1      0.382 ppm2      1.724 CV     1
 OR { 2708}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 57   and name HB3 ))
 ASSI { 2709}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 17   and name HG  ))
      2.300     0.700     0.700 peak  2709 spectrum    1 weight  0.10000E+01 volume  0.46478E-02 ppm1      0.383 ppm2      1.477 CV     1
 OR { 2709}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 59   and name HG  ))
 ASSI { 2710}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 59   and name HB2 ))
      2.700     0.900     0.900 peak  2710 spectrum    1 weight  0.10000E+01 volume  0.30674E-02 ppm1      0.382 ppm2      1.257 CV     1
 OR { 2710}
   (  segid "    " and resid 54   and name HD2%)
   (  segid "    " and resid 60   and name HB% )
 ASSI { 2712}
   (  segid "    " and resid 54   and name HD2%)
   (  segid "    " and resid 36   and name HG2%)
      2.700     0.900     0.900 peak  2712 spectrum    1 weight  0.10000E+01 volume  0.84258E-02 ppm1      0.382 ppm2      0.943 CV     1
 OR { 2712}
   (  segid "    " and resid 54   and name HD2%)
   (  segid "    " and resid 50   and name HG2%)
 OR { 2712}
   (  segid "    " and resid 54   and name HD2%)
   (  segid "    " and resid 59   and name HD2%)
 OR { 2712}
   (  segid "    " and resid 54   and name HD2%)
   (  segid "    " and resid 22   and name HD2%)
 ASSI { 2714}
   (  segid "    " and resid 54   and name HD2%)
   (  segid "    " and resid 17   and name HD2%)
      2.400     0.700     0.700 peak  2714 spectrum    1 weight  0.10000E+01 volume  0.10073E-01 ppm1      0.382 ppm2      0.756 CV     1
 OR { 2714}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 54   and name HB2 ))
 ASSI { 2717}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 53   and name HA  ))
      3.300     1.400     1.400 peak  2717 spectrum    1 weight  0.10000E+01 volume  0.17359E-02 ppm1      0.383 ppm2      3.984 CV     1
 OR { 2717}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 55   and name HA  ))
 OR { 2717}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 57   and name HA  ))
 ASSI { 2724}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 56   and name H   ))
      4.700     2.700     1.300 peak  2724 spectrum    1 weight  0.10000E+01 volume  0.50516E-03 ppm1      0.383 ppm2      8.099 CV     1
 OR { 2724}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 53   and name H   ))
 ASSI { 2727}
   (  segid "    " and resid 54   and name HD2%)
   (  segid "    " and resid 66   and name HE% )
      4.300     2.300     1.700 peak  2727 spectrum    1 weight  0.10000E+01 volume  0.99800E-03 ppm1      0.383 ppm2      7.072 CV     1
 OR { 2727}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 60   and name H   ))
 ASSI { 2728}
   (  segid "    " and resid 54   and name HD2%)
   (  segid "    " and resid 21   and name HD% )
      2.700     0.900     0.900 peak  2728 spectrum    1 weight  0.10000E+01 volume  0.26755E-02 ppm1      0.383 ppm2      6.899 CV     1
 OR { 2728}
   (  segid "    " and resid 54   and name HD2%)
   (( segid "    " and resid 66   and name HZ  ))
 ASSI { 2730}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 33   and name H   ))
      4.800     2.900     1.200 peak  2730 spectrum    1 weight  0.10000E+01 volume  0.29131E-03 ppm1      0.436 ppm2      7.992 CV     1
 OR { 2730}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 34   and name H   ))
 ASSI { 2731}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 57   and name H   ))
      5.200     3.400     0.800 peak  2731 spectrum    1 weight  0.10000E+01 volume  0.23963E-03 ppm1      0.439 ppm2      7.863 CV     1
 OR { 2731}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 62   and name H   ))
 ASSI { 2732}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 55   and name H   ))
      4.800     2.800     1.200 peak  2732 spectrum    1 weight  0.10000E+01 volume  0.69734E-03 ppm1      0.438 ppm2      7.492 CV     1
 OR { 2732}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 66   and name H   ))
 ASSI { 2735}
   (  segid "    " and resid 54   and name HD1%)
   (  segid "    " and resid 21   and name HD% )
      2.500     0.800     0.800 peak  2735 spectrum    1 weight  0.10000E+01 volume  0.39759E-02 ppm1      0.436 ppm2      6.913 CV     1
 OR { 2735}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 66   and name HZ  ))
 ASSI { 2736}
   (( segid "    " and resid 54   and name HG  ))
   (( segid "    " and resid 66   and name HZ  ))
      4.800     2.900     1.200 peak  2736 spectrum    1 weight  0.10000E+01 volume  0.43530E-03 ppm1      1.723 ppm2      6.916 CV     1
 OR { 2736}
   (( segid "    " and resid 54   and name HG  ))
   (  segid "    " and resid 21   and name HD% )
 ASSI { 2737}
   (( segid "    " and resid 20   and name HG  ))
   (( segid "    " and resid 39   and name H   ))
      4.600     2.600     1.400 peak  2737 spectrum    1 weight  0.10000E+01 volume  0.42283E-03 ppm1      1.712 ppm2      7.494 CV     1
 OR { 2737}
   (( segid "    " and resid 54   and name HG  ))
   (( segid "    " and resid 55   and name H   ))
 OR { 2737}
   (( segid "    " and resid 20   and name HG  ))
   (( segid "    " and resid 24   and name HD22))
 ASSI { 2739}
   (( segid "    " and resid 54   and name HB2 ))
   (  segid "    " and resid 66   and name HE% )
      4.600     2.600     1.400 peak  2739 spectrum    1 weight  0.10000E+01 volume  0.24209E-03 ppm1      0.721 ppm2      7.081 CV     1
 OR { 2739}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 60   and name H   ))
 ASSI { 2740}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 21   and name HD% )
      3.400     1.400     1.400 peak  2740 spectrum    1 weight  0.10000E+01 volume  0.58658E-03 ppm1      3.683 ppm2      6.903 CV     1
 OR { 2740}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 21   and name HD% )
 ASSI { 2741}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 60   and name H   ))
      4.500     2.500     1.500 peak  2741 spectrum    1 weight  0.10000E+01 volume  0.50570E-03 ppm1      3.679 ppm2      7.065 CV     1
 OR { 2741}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 66   and name HE% )
 OR { 2741}
   (( segid "    " and resid 118  and name HA  ))
   (  segid "    " and resid 88   and name HD% )
 ASSI { 2742}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 55   and name H   ))
      3.900     1.900     1.900 peak  2742 spectrum    1 weight  0.10000E+01 volume  0.44491E-03 ppm1      3.681 ppm2      7.495 CV     1
 OR { 2742}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 117  and name H   ))
 ASSI { 2744}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 57   and name H   ))
      3.100     1.200     1.200 peak  2744 spectrum    1 weight  0.10000E+01 volume  0.11252E-02 ppm1      3.683 ppm2      7.868 CV     1
 OR { 2744}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 119  and name H   ))
 ASSI { 2745}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 121  and name H   ))
      3.300     1.400     1.400 peak  2745 spectrum    1 weight  0.10000E+01 volume  0.79997E-03 ppm1      3.668 ppm2      8.132 CV     1
 OR { 2745}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 120  and name H   ))
 OR { 2745}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 56   and name H   ))
 ASSI { 2747}
   (( segid "    " and resid 53   and name HA  ))
   (  segid "    " and resid 54   and name HD2%)
      4.600     2.700     1.400 peak  2747 spectrum    1 weight  0.10000E+01 volume  0.56521E-03 ppm1      4.020 ppm2      0.414 CV     1
 OR { 2747}
   (( segid "    " and resid 53   and name HA  ))
   (  segid "    " and resid 54   and name HD1%)
 OR { 2747}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 2750}
   (( segid "    " and resid 83   and name HA  ))
   (  segid "    " and resid 106  and name HG2%)
      4.400     2.500     1.600 peak  2750 spectrum    1 weight  0.10000E+01 volume  0.80956E-03 ppm1      4.024 ppm2      1.319 CV     1
 OR { 2750}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 59   and name HB3 ))
 OR { 2750}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 25   and name HD3 ))
 OR { 2750}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 25   and name HD2 ))
 ASSI { 2753}
   (( segid "    " and resid 53   and name HB3 ))
   (( segid "    " and resid 9    and name HE1 ))
      4.700     2.800     1.300 peak  2753 spectrum    1 weight  0.10000E+01 volume  0.35681E-03 ppm1      2.897 ppm2      9.893 CV     1
 OR { 2753}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 9    and name HE1 ))
 ASSI { 2756}
   (( segid "    " and resid 53   and name HB3 ))
   (  segid "    " and resid 36   and name HG2%)
      5.400     3.600     0.600 peak  2756 spectrum    1 weight  0.10000E+01 volume  0.25966E-03 ppm1      2.890 ppm2      0.974 CV     1
 OR { 2756}
   (( segid "    " and resid 53   and name HB3 ))
   (  segid "    " and resid 36   and name HD1%)
 OR { 2756}
   (( segid "    " and resid 53   and name HB3 ))
   (  segid "    " and resid 33   and name HG2%)
 OR { 2756}
   (( segid "    " and resid 53   and name HB3 ))
   (  segid "    " and resid 59   and name HD2%)
 ASSI { 2760}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 92   and name HG3 ))
      3.900     1.900     1.900 peak  2760 spectrum    1 weight  0.10000E+01 volume  0.18474E-02 ppm1      2.193 ppm2      1.545 CV     1
 OR { 2760}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 45   and name HG2 ))
 OR { 2760}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 45   and name HG2 ))
 OR { 2760}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 50   and name HG12))
 OR { 2760}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 50   and name HG12))
 OR { 2760}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 37   and name HB2 ))
 OR { 2760}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 92   and name HB2 ))
 OR { 2760}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 37   and name HB2 ))
 ASSI { 2763}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 8    and name HA  ))
      5.100     3.200     0.900 peak  2763 spectrum    1 weight  0.10000E+01 volume  0.47892E-03 ppm1      2.883 ppm2      4.235 CV     1
 OR { 2763}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 13   and name HA  ))
 OR { 2763}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 8    and name HA  ))
 OR { 2763}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 13   and name HA  ))
 ASSI { 2767}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 9    and name HD1 ))
      3.700     1.700     1.700 peak  2767 spectrum    1 weight  0.10000E+01 volume  0.80156E-03 ppm1      2.894 ppm2      6.953 CV     1
 OR { 2767}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 9    and name HD1 ))
 OR { 2767}
   (( segid "    " and resid 53   and name HB3 ))
   (( segid "    " and resid 9    and name HZ2 ))
 ASSI { 2770}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 9    and name H   ))
      3.700     1.700     1.700 peak  2770 spectrum    1 weight  0.10000E+01 volume  0.72183E-03 ppm1      2.893 ppm2      8.682 CV     1
 OR { 2770}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 9    and name H   ))
 OR { 2770}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 14   and name H   ))
 ASSI { 2772}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 9    and name HZ2 ))
      5.200     3.400     0.800 peak  2772 spectrum    1 weight  0.10000E+01 volume  0.31302E-03 ppm1      4.023 ppm2      6.936 CV     1
 OR { 2772}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 21   and name HD% )
 ASSI { 2774}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HE22))
      4.700     2.800     1.300 peak  2774 spectrum    1 weight  0.10000E+01 volume  0.50928E-03 ppm1      2.195 ppm2      7.500 CV     1
 OR { 2774}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 49   and name HE22))
 OR { 2774}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 66   and name H   ))
 ASSI { 2775}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 52   and name H   ))
      3.000     1.200     1.200 peak  2775 spectrum    1 weight  0.10000E+01 volume  0.16689E-02 ppm1      7.070 ppm2      8.216 CV     1
 OR { 2775}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 51   and name H   ))
 ASSI { 2776}
   (( segid "    " and resid 9    and name HE3 ))
   (( segid "    " and resid 14   and name H   ))
      4.000     2.000     2.000 peak  2776 spectrum    1 weight  0.10000E+01 volume  0.54995E-03 ppm1      7.074 ppm2      8.709 CV     1
 OR { 2776}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 63   and name H   ))
 ASSI { 2780}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 48   and name HE3 ))
      3.900     1.900     1.900 peak  2780 spectrum    1 weight  0.10000E+01 volume  0.10440E-02 ppm1      7.070 ppm2      2.957 CV     1
 OR { 2780}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 51   and name HA  ))
 ASSI { 2782}
   (( segid "    " and resid 9    and name HE3 ))
   (( segid "    " and resid 13   and name HA  ))
      4.800     2.800     1.200 peak  2782 spectrum    1 weight  0.10000E+01 volume  0.45134E-03 ppm1      7.071 ppm2      4.230 CV     1
 OR { 2782}
   (( segid "    " and resid 9    and name HE3 ))
   (( segid "    " and resid 42   and name HB  ))
 ASSI { 2784}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 63   and name HB  ))
      3.400     1.400     1.400 peak  2784 spectrum    1 weight  0.10000E+01 volume  0.13406E-02 ppm1      7.070 ppm2      2.211 CV     1
 OR { 2784}
   (( segid "    " and resid 9    and name HE3 ))
   (( segid "    " and resid 17   and name HB3 ))
 ASSI { 2785}
   (( segid "    " and resid 9    and name HE3 ))
   (( segid "    " and resid 12   and name HB3 ))
      4.900     3.000     1.100 peak  2785 spectrum    1 weight  0.10000E+01 volume  0.58922E-03 ppm1      7.071 ppm2      2.008 CV     1
 OR { 2785}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 55   and name HB  ))
 OR { 2785}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 67   and name HB2 ))
 ASSI { 2786}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 47   and name HB3 ))
      3.600     1.600     1.600 peak  2786 spectrum    1 weight  0.10000E+01 volume  0.70521E-03 ppm1      7.070 ppm2      1.864 CV     1
 OR { 2786}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 69   and name HB2 ))
 OR { 2786}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 47   and name HB2 ))
 OR { 2786}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 69   and name HB3 ))
 OR { 2786}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 56   and name HB3 ))
 OR { 2786}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 64   and name HB2 ))
 ASSI { 2788}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 48   and name HG3 ))
      3.100     1.200     1.200 peak  2788 spectrum    1 weight  0.10000E+01 volume  0.15301E-02 ppm1      7.071 ppm2      1.515 CV     1
 OR { 2788}
   (( segid "    " and resid 52   and name HD2 ))
   (( segid "    " and resid 51   and name HG12))
 ASSI { 2791}
   (( segid "    " and resid 52   and name HD2 ))
   (  segid "    " and resid 55   and name HG2%)
      3.700     1.800     1.800 peak  2791 spectrum    1 weight  0.10000E+01 volume  0.19386E-02 ppm1      7.070 ppm2      0.777 CV     1
 OR { 2791}
   (( segid "    " and resid 52   and name HD2 ))
   (  segid "    " and resid 55   and name HG1%)
 OR { 2791}
   (( segid "    " and resid 52   and name HD2 ))
   (  segid "    " and resid 51   and name HD1%)
 ASSI { 2794}
   (( segid "    " and resid 52   and name HE1 ))
   (( segid "    " and resid 48   and name HD2 ))
      3.700     1.700     1.700 peak  2794 spectrum    1 weight  0.10000E+01 volume  0.61660E-03 ppm1      7.826 ppm2      1.707 CV     1
 OR { 2794}
   (( segid "    " and resid 52   and name HE1 ))
   (( segid "    " and resid 56   and name HB2 ))
 ASSI { 2795}
   (( segid "    " and resid 52   and name HE1 ))
   (( segid "    " and resid 63   and name HB  ))
      4.600     2.700     1.400 peak  2795 spectrum    1 weight  0.10000E+01 volume  0.45380E-03 ppm1      7.824 ppm2      2.230 CV     1
 OR { 2795}
   (( segid "    " and resid 52   and name HE1 ))
   (( segid "    " and resid 56   and name HG2 ))
 ASSI { 2803}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 55   and name HG2%)
      4.600     2.700     1.400 peak  2803 spectrum    1 weight  0.10000E+01 volume  0.66826E-03 ppm1      3.244 ppm2      0.779 CV     1
 OR { 2803}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 55   and name HG1%)
 OR { 2803}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 51   and name HD1%)
 OR { 2803}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 17   and name HD2%)
 ASSI { 2804}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 50   and name HG2%)
      4.300     2.300     1.700 peak  2804 spectrum    1 weight  0.10000E+01 volume  0.89179E-03 ppm1      3.236 ppm2      0.943 CV     1
 OR { 2804}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 63   and name HG2%)
 OR { 2804}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 33   and name HG2%)
 OR { 2804}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 63   and name HG1%)
 ASSI { 2807}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 53   and name HB2 ))
      4.800     2.900     1.200 peak  2807 spectrum    1 weight  0.10000E+01 volume  0.42200E-03 ppm1      3.236 ppm2      2.213 CV     1
 OR { 2807}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 56   and name HG2 ))
 ASSI { 2808}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 52   and name HA  ))
      2.900     1.100     1.100 peak  2808 spectrum    1 weight  0.10000E+01 volume  0.26293E-02 ppm1      3.240 ppm2      4.019 CV     1
 OR { 2808}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 53   and name HA  ))
 ASSI { 2811}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name H   ))
      2.900     1.100     1.100 peak  2811 spectrum    1 weight  0.10000E+01 volume  0.16475E-02 ppm1      2.976 ppm2      8.215 CV     1
 OR { 2811}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 52   and name H   ))
 ASSI { 2814}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 51   and name HD1%)
      2.800     1.000     1.000 peak  2814 spectrum    1 weight  0.10000E+01 volume  0.28725E-02 ppm1      2.976 ppm2      0.766 CV     1
 OR { 2814}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 54   and name HB2 ))
 ASSI { 2816}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 33   and name HG2%)
      2.900     1.100     1.100 peak  2816 spectrum    1 weight  0.10000E+01 volume  0.24209E-02 ppm1      2.977 ppm2      0.939 CV     1
 OR { 2816}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 50   and name HG2%)
 OR { 2816}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 33   and name HG1%)
 ASSI { 2820}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 50   and name HB  ))
      4.500     2.600     1.500 peak  2820 spectrum    1 weight  0.10000E+01 volume  0.32619E-03 ppm1      2.966 ppm2      2.175 CV     1
 OR { 2820}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 53   and name HB2 ))
 OR { 2820}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 63   and name HB  ))
 OR { 2820}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 67   and name HB3 ))
 ASSI { 2825}
   (( segid "    " and resid 51   and name HB  ))
   (  segid "    " and resid 33   and name HG2%)
      4.600     2.700     1.400 peak  2825 spectrum    1 weight  0.10000E+01 volume  0.58656E-03 ppm1      1.617 ppm2      0.943 CV     1
 OR { 2825}
   (( segid "    " and resid 51   and name HB  ))
   (  segid "    " and resid 63   and name HG2%)
 OR { 2825}
   (( segid "    " and resid 51   and name HB  ))
   (  segid "    " and resid 33   and name HG1%)
 ASSI { 2837}
   (  segid "    " and resid 51   and name HG2%)
   (  segid "    " and resid 55   and name HG1%)
      2.300     0.700     0.700 peak  2837 spectrum    1 weight  0.10000E+01 volume  0.22040E-01 ppm1      0.660 ppm2      0.773 CV     1
 OR { 2837}
   (  segid "    " and resid 51   and name HG2%)
   (  segid "    " and resid 51   and name HD1%)
 ASSI { 2841}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 54   and name HB3 ))
      3.800     1.800     1.800 peak  2841 spectrum    1 weight  0.10000E+01 volume  0.16873E-02 ppm1      0.659 ppm2      1.890 CV     1
 OR { 2841}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 47   and name HB2 ))
 OR { 2841}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 47   and name HB3 ))
 OR { 2841}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 37   and name HB3 ))
 ASSI { 2844}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 48   and name HG2 ))
      3.800     1.800     1.800 peak  2844 spectrum    1 weight  0.10000E+01 volume  0.17327E-02 ppm1      0.659 ppm2      1.314 CV     1
 OR { 2844}
   (  segid "    " and resid 51   and name HG2%)
   (  segid "    " and resid 32   and name HG1%)
 ASSI { 2846}
   (  segid "    " and resid 51   and name HG2%)
   (  segid "    " and resid 63   and name HG2%)
      2.200     0.600     0.600 peak  2846 spectrum    1 weight  0.10000E+01 volume  0.16201E-01 ppm1      0.660 ppm2      0.946 CV     1
 OR { 2846}
   (  segid "    " and resid 51   and name HG2%)
   (  segid "    " and resid 63   and name HG1%)
 OR { 2846}
   (  segid "    " and resid 51   and name HG2%)
   (  segid "    " and resid 33   and name HG2%)
 ASSI { 2852}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 50   and name HA  ))
      4.300     2.300     1.700 peak  2852 spectrum    1 weight  0.10000E+01 volume  0.97935E-03 ppm1      0.660 ppm2      3.772 CV     1
 OR { 2852}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 62   and name HB3 ))
 OR { 2852}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 47   and name HA  ))
 ASSI { 2853}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 62   and name HA  ))
      5.000     3.200     1.000 peak  2853 spectrum    1 weight  0.10000E+01 volume  0.36529E-03 ppm1      0.657 ppm2      4.571 CV     1
 OR { 2853}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 66   and name HA  ))
 ASSI { 2859}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 47   and name HD3 ))
      2.400     2.400     3.600 peak  2859 spectrum    1 weight  0.10000E+01 volume  0.11690E-02 ppm1      0.765 ppm2      3.235 CV     1
 OR { 2859}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 47   and name HD2 ))
 OR { 2859}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 52   and name HB2 ))
 ASSI { 2862}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 50   and name HB  ))
      3.000     1.100     1.100 peak  2862 spectrum    1 weight  0.10000E+01 volume  0.20811E-02 ppm1      0.764 ppm2      2.201 CV     1
 OR { 2862}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 67   and name HB3 ))
 ASSI { 2863}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 47   and name HB2 ))
      3.000     1.100     1.100 peak  2863 spectrum    1 weight  0.10000E+01 volume  0.25177E-02 ppm1      0.765 ppm2      1.863 CV     1
 OR { 2863}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 37   and name HB3 ))
 OR { 2863}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 47   and name HB3 ))
 ASSI { 2868}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 66   and name HE% )
      4.300     2.300     1.700 peak  2868 spectrum    1 weight  0.10000E+01 volume  0.32699E-03 ppm1      2.976 ppm2      7.092 CV     1
 OR { 2868}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 52   and name HD2 ))
 ASSI { 2869}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 52   and name HD2 ))
      4.200     2.200     1.800 peak  2869 spectrum    1 weight  0.10000E+01 volume  0.31702E-03 ppm1      1.618 ppm2      7.069 CV     1
 OR { 2869}
   (( segid "    " and resid 51   and name HB  ))
   (  segid "    " and resid 66   and name HE% )
 ASSI { 2870}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 51   and name H   ))
      2.500     0.800     0.800 peak  2870 spectrum    1 weight  0.10000E+01 volume  0.23310E-02 ppm1      1.622 ppm2      8.214 CV     1
 OR { 2870}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 52   and name H   ))
 ASSI { 2871}
   (( segid "    " and resid 51   and name HG12))
   (( segid "    " and resid 51   and name H   ))
      4.100     2.100     1.900 peak  2871 spectrum    1 weight  0.10000E+01 volume  0.12972E-02 ppm1      1.498 ppm2      8.211 CV     1
 OR { 2871}
   (( segid "    " and resid 51   and name HG12))
   (( segid "    " and resid 52   and name H   ))
 ASSI { 2872}
   (( segid "    " and resid 90   and name HB3 ))
   (  segid "    " and resid 91   and name HD% )
      4.100     2.100     1.900 peak  2872 spectrum    1 weight  0.10000E+01 volume  0.76030E-03 ppm1      1.492 ppm2      7.092 CV     1
 OR { 2872}
   (( segid "    " and resid 51   and name HG12))
   (  segid "    " and resid 66   and name HE% )
 OR { 2872}
   (( segid "    " and resid 51   and name HG12))
   (( segid "    " and resid 52   and name HD2 ))
 ASSI { 2873}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 67   and name H   ))
      4.600     2.600     1.400 peak  2873 spectrum    1 weight  0.10000E+01 volume  0.56799E-03 ppm1      0.658 ppm2      7.844 CV     1
 OR { 2873}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 52   and name HE1 ))
 ASSI { 2874}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 65   and name H   ))
      4.600     2.700     1.400 peak  2874 spectrum    1 weight  0.10000E+01 volume  0.41378E-03 ppm1      0.658 ppm2      7.703 CV     1
 OR { 2874}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 49   and name H   ))
 ASSI { 2875}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 66   and name H   ))
      3.800     1.800     1.800 peak  2875 spectrum    1 weight  0.10000E+01 volume  0.12279E-02 ppm1      0.660 ppm2      7.502 CV     1
 OR { 2875}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 55   and name H   ))
 ASSI { 2878}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 52   and name HD2 ))
      2.500     0.800     0.800 peak  2878 spectrum    1 weight  0.10000E+01 volume  0.34523E-02 ppm1      0.660 ppm2      7.080 CV     1
 OR { 2878}
   (  segid "    " and resid 51   and name HG2%)
   (  segid "    " and resid 66   and name HE% )
 ASSI { 2879}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 66   and name HZ  ))
      3.700     1.800     1.800 peak  2879 spectrum    1 weight  0.10000E+01 volume  0.10523E-02 ppm1      0.659 ppm2      6.942 CV     1
 OR { 2879}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 67   and name HE22))
 ASSI { 2880}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 52   and name H   ))
      2.800     1.000     1.000 peak  2880 spectrum    1 weight  0.10000E+01 volume  0.54632E-02 ppm1      0.660 ppm2      8.216 CV     1
 OR { 2880}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 51   and name H   ))
 ASSI { 2883}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 34   and name H   ))
      4.800     2.900     1.200 peak  2883 spectrum    1 weight  0.10000E+01 volume  0.48724E-03 ppm1      0.762 ppm2      7.985 CV     1
 OR { 2883}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 33   and name H   ))
 ASSI { 2885}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 49   and name H   ))
      3.200     1.300     1.300 peak  2885 spectrum    1 weight  0.10000E+01 volume  0.43820E-03 ppm1      0.767 ppm2      7.721 CV     1
 OR { 2885}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 65   and name H   ))
 ASSI { 2888}
   (  segid "    " and resid 51   and name HD1%)
   (  segid "    " and resid 66   and name HE% )
      4.200     2.200     1.800 peak  2888 spectrum    1 weight  0.10000E+01 volume  0.13952E-02 ppm1      0.765 ppm2      7.081 CV     1
 OR { 2888}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 52   and name HD2 ))
 ASSI { 2897}
   (( segid "    " and resid 51   and name HG13))
   (( segid "    " and resid 51   and name H   ))
      4.100     2.100     1.900 peak  2897 spectrum    1 weight  0.10000E+01 volume  0.73310E-03 ppm1      0.090 ppm2      8.213 CV     1
 OR { 2897}
   (( segid "    " and resid 51   and name HG13))
   (( segid "    " and resid 52   and name H   ))
 ASSI { 2901}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name H   ))
      2.800     1.000     1.000 peak  2901 spectrum    1 weight  0.10000E+01 volume  0.20813E-02 ppm1      3.782 ppm2      8.205 CV     1
 OR { 2901}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 51   and name H   ))
 ASSI { 2906}
   (( segid "    " and resid 50   and name HG12))
   (  segid "    " and resid 50   and name HD1%)
      2.000     0.500     0.500 peak  2906 spectrum    1 weight  0.10000E+01 volume  0.10433E-01 ppm1      1.555 ppm2      0.928 CV     1
 OR { 2906}
   (( segid "    " and resid 50   and name HG13))
   (  segid "    " and resid 50   and name HD1%)
 OR { 2906}
   (( segid "    " and resid 50   and name HG12))
   (  segid "    " and resid 50   and name HG2%)
 OR { 2906}
   (( segid "    " and resid 50   and name HG13))
   (  segid "    " and resid 50   and name HG2%)
 OR { 2906}
   (( segid "    " and resid 127  and name HG3 ))
   (  segid "    " and resid 115  and name HG2%)
 ASSI { 2907}
   (( segid "    " and resid 50   and name HG12))
   (( segid "    " and resid 50   and name HB  ))
      2.800     1.000     1.000 peak  2907 spectrum    1 weight  0.10000E+01 volume  0.26748E-02 ppm1      1.568 ppm2      2.177 CV     1
 OR { 2907}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 50   and name HB  ))
 OR { 2907}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 97   and name HB  ))
 OR { 2907}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 53   and name HB2 ))
 OR { 2907}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 17   and name HB3 ))
 OR { 2907}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 49   and name HB3 ))
 OR { 2907}
   (( segid "    " and resid 127  and name HG3 ))
   (( segid "    " and resid 115  and name HB  ))
 OR { 2907}
   (( segid "    " and resid 103  and name HD3 ))
   (( segid "    " and resid 102  and name HB3 ))
 OR { 2907}
   (( segid "    " and resid 50   and name HG12))
   (( segid "    " and resid 49   and name HB3 ))
 ASSI { 2909}
   (( segid "    " and resid 127  and name HG3 ))
   (( segid "    " and resid 127  and name HD3 ))
      2.500     0.800     0.800 peak  2909 spectrum    1 weight  0.10000E+01 volume  0.30370E-02 ppm1      1.554 ppm2      3.265 CV     1
 OR { 2909}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 47   and name HD3 ))
 OR { 2909}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 47   and name HD2 ))
 ASSI { 2910}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 47   and name HA  ))
      3.200     1.300     1.300 peak  2910 spectrum    1 weight  0.10000E+01 volume  0.27013E-02 ppm1      1.549 ppm2      3.754 CV     1
 OR { 2910}
   (( segid "    " and resid 127  and name HG3 ))
   (( segid "    " and resid 127  and name HA  ))
 OR { 2910}
   (( segid "    " and resid 50   and name HG12))
   (( segid "    " and resid 50   and name HA  ))
 ASSI { 2913}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 50   and name HG13))
      2.200     0.600     0.600 peak  2913 spectrum    1 weight  0.10000E+01 volume  0.84615E-02 ppm1      0.914 ppm2      1.626 CV     1
 OR { 2913}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 37   and name HG  ))
 ASSI { 2914}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 50   and name HB  ))
      2.000     0.500     0.500 peak  2914 spectrum    1 weight  0.10000E+01 volume  0.74471E-02 ppm1      0.915 ppm2      2.180 CV     1
 OR { 2914}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 17   and name HB3 ))
 ASSI { 2915}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 49   and name HG2 ))
      4.400     2.400     1.600 peak  2915 spectrum    1 weight  0.10000E+01 volume  0.63871E-03 ppm1      0.922 ppm2      2.556 CV     1
 OR { 2915}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 89   and name HG3 ))
 ASSI { 2917}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 50   and name HA  ))
      2.500     0.800     0.800 peak  2917 spectrum    1 weight  0.10000E+01 volume  0.47485E-02 ppm1      0.914 ppm2      3.774 CV     1
 OR { 2917}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 47   and name HA  ))
 ASSI { 2921}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 13   and name HG3 ))
      2.300     2.300     3.700 peak  2921 spectrum    1 weight  0.10000E+01 volume  0.10547E-02 ppm1      0.890 ppm2      2.436 CV     1
 OR { 2921}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 13   and name HG2 ))
 OR { 2921}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 14   and name HB2 ))
 OR { 2921}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 34   and name HG2 ))
 OR { 2921}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 13   and name HB3 ))
 OR { 2921}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 13   and name HB2 ))
 ASSI { 2922}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 45   and name HD2 ))
      3.500     1.500     1.500 peak  2922 spectrum    1 weight  0.10000E+01 volume  0.20854E-02 ppm1      0.892 ppm2      2.308 CV     1
 OR { 2922}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 49   and name HG3 ))
 ASSI { 2923}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 50   and name HB  ))
      2.400     0.700     0.700 peak  2923 spectrum    1 weight  0.10000E+01 volume  0.47775E-02 ppm1      0.891 ppm2      2.188 CV     1
 OR { 2923}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 49   and name HB3 ))
 OR { 2923}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 49   and name HB2 ))
 ASSI { 2925}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 50   and name HG13))
      2.000     0.500     0.500 peak  2925 spectrum    1 weight  0.10000E+01 volume  0.12623E-01 ppm1      0.890 ppm2      1.628 CV     1
 OR { 2925}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 2926}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 50   and name HG12))
      2.000     0.500     0.500 peak  2926 spectrum    1 weight  0.10000E+01 volume  0.11792E-01 ppm1      0.890 ppm2      1.566 CV     1
 OR { 2926}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 50   and name HG13))
 OR { 2926}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 37   and name HB2 ))
 ASSI { 2928}
   (  segid "    " and resid 50   and name HD1%)
   (  segid "    " and resid 42   and name HG2%)
      2.100     2.100     3.900 peak  2928 spectrum    1 weight  0.10000E+01 volume  0.21993E-02 ppm1      0.889 ppm2      1.245 CV     1
 OR { 2928}
   (  segid "    " and resid 50   and name HD1%)
   (  segid "    " and resid 46   and name HG2%)
 ASSI { 2929}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 51   and name HA  ))
      2.600     2.600     3.400 peak  2929 spectrum    1 weight  0.10000E+01 volume  0.50368E-03 ppm1      0.892 ppm2      2.977 CV     1
 OR { 2929}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 48   and name HE2 ))
 ASSI { 2938}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 38   and name H   ))
      3.000     3.000     3.000 peak  2938 spectrum    1 weight  0.10000E+01 volume  0.25095E-03 ppm1      0.888 ppm2      7.566 CV     1
 OR { 2938}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 39   and name H   ))
 ASSI { 2942}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 43   and name H   ))
      2.700     2.700     3.300 peak  2942 spectrum    1 weight  0.10000E+01 volume  0.46582E-03 ppm1      0.888 ppm2      7.998 CV     1
 OR { 2942}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 53   and name HE1 ))
 ASSI { 2944}
   (  segid "    " and resid 50   and name HG2%)
   (  segid "    " and resid 66   and name HE% )
      4.800     2.900     1.200 peak  2944 spectrum    1 weight  0.10000E+01 volume  0.38978E-03 ppm1      0.884 ppm2      7.072 CV     1
 OR { 2944}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 45   and name HE  ))
 ASSI { 2945}
   (( segid "    " and resid 50   and name HB  ))
   (( segid "    " and resid 50   and name H   ))
      2.300     0.700     0.700 peak  2945 spectrum    1 weight  0.10000E+01 volume  0.26387E-02 ppm1      2.184 ppm2      8.205 CV     1
 OR { 2945}
   (( segid "    " and resid 50   and name HB  ))
   (( segid "    " and resid 51   and name H   ))
 ASSI { 2947}
   (( segid "    " and resid 50   and name HG12))
   (( segid "    " and resid 50   and name H   ))
      3.800     1.800     1.800 peak  2947 spectrum    1 weight  0.10000E+01 volume  0.13983E-02 ppm1      1.549 ppm2      8.198 CV     1
 OR { 2947}
   (( segid "    " and resid 50   and name HG12))
   (( segid "    " and resid 51   and name H   ))
 ASSI { 2948}
   (( segid "    " and resid 50   and name HG12))
   (( segid "    " and resid 37   and name H   ))
      4.100     2.100     1.900 peak  2948 spectrum    1 weight  0.10000E+01 volume  0.55728E-03 ppm1      1.564 ppm2      8.591 CV     1
 OR { 2948}
   (( segid "    " and resid 127  and name HG3 ))
   (( segid "    " and resid 128  and name H   ))
 OR { 2948}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 37   and name H   ))
 OR { 2948}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 97   and name H   ))
 ASSI { 2950}
   (( segid "    " and resid 127  and name HG3 ))
   (( segid "    " and resid 127  and name H   ))
      3.700     1.700     1.700 peak  2950 spectrum    1 weight  0.10000E+01 volume  0.35971E-03 ppm1      1.558 ppm2      9.023 CV     1
 OR { 2950}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 47   and name H   ))
 ASSI { 2951}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 91   and name H   ))
      4.400     2.400     1.600 peak  2951 spectrum    1 weight  0.10000E+01 volume  0.10452E-02 ppm1      1.562 ppm2      7.763 CV     1
 OR { 2951}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 49   and name H   ))
 OR { 2951}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 49   and name H   ))
 OR { 2951}
   (( segid "    " and resid 127  and name HG3 ))
   (( segid "    " and resid 130  and name H   ))
 OR { 2951}
   (( segid "    " and resid 50   and name HG12))
   (( segid "    " and resid 49   and name H   ))
 ASSI { 2952}
   (( segid "    " and resid 50   and name HG13))
   (( segid "    " and resid 45   and name HE  ))
      4.200     2.200     1.800 peak  2952 spectrum    1 weight  0.10000E+01 volume  0.44270E-03 ppm1      1.564 ppm2      7.120 CV     1
 OR { 2952}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 88   and name HZ  ))
 OR { 2952}
   (( segid "    " and resid 50   and name HG12))
   (( segid "    " and resid 45   and name HE  ))
 OR { 2952}
   (( segid "    " and resid 127  and name HG3 ))
   (  segid "    " and resid 131  and name HD% )
 ASSI { 2953}
   (  segid "    " and resid 50   and name HG2%)
   (  segid "    " and resid 21   and name HD% )
      4.100     2.100     1.900 peak  2953 spectrum    1 weight  0.10000E+01 volume  0.15899E-02 ppm1      0.915 ppm2      6.912 CV     1
 OR { 2953}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 9    and name HZ2 ))
 OR { 2953}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 66   and name HZ  ))
 ASSI { 2954}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 88   and name HD% )
      3.900     1.900     1.900 peak  2954 spectrum    1 weight  0.10000E+01 volume  0.10977E-02 ppm1      0.917 ppm2      7.079 CV     1
 OR { 2954}
   (  segid "    " and resid 50   and name HG2%)
   (  segid "    " and resid 66   and name HE% )
 OR { 2954}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 76   and name HZ2 ))
 OR { 2954}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 45   and name HE  ))
 ASSI { 2956}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 55   and name H   ))
      4.400     2.400     1.600 peak  2956 spectrum    1 weight  0.10000E+01 volume  0.52152E-03 ppm1      0.916 ppm2      7.491 CV     1
 OR { 2956}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 66   and name H   ))
 ASSI { 2957}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 49   and name H   ))
      4.800     2.800     1.200 peak  2957 spectrum    1 weight  0.10000E+01 volume  0.45925E-03 ppm1      0.910 ppm2      7.703 CV     1
 OR { 2957}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 59   and name H   ))
 ASSI { 2958}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 33   and name H   ))
      4.100     2.100     1.900 peak  2958 spectrum    1 weight  0.10000E+01 volume  0.10946E-02 ppm1      0.920 ppm2      7.989 CV     1
 OR { 2958}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 34   and name H   ))
 ASSI { 2959}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 51   and name H   ))
      2.800     1.000     1.000 peak  2959 spectrum    1 weight  0.10000E+01 volume  0.42230E-02 ppm1      0.914 ppm2      8.207 CV     1
 OR { 2959}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 50   and name H   ))
 ASSI { 2968}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 52   and name HB2 ))
      4.200     2.300     1.800 peak  2968 spectrum    1 weight  0.10000E+01 volume  0.73729E-03 ppm1      2.200 ppm2      3.244 CV     1
 OR { 2968}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 52   and name HB2 ))
 OR { 2968}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 88   and name HB3 ))
 OR { 2968}
   (( segid "    " and resid 67   and name HB3 ))
   (( segid "    " and resid 68   and name HD2 ))
 ASSI { 2969}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 52   and name HB3 ))
      4.900     3.000     1.100 peak  2969 spectrum    1 weight  0.10000E+01 volume  0.54277E-03 ppm1      2.208 ppm2      3.167 CV     1
 OR { 2969}
   (( segid "    " and resid 89   and name HB3 ))
   (( segid "    " and resid 88   and name HB3 ))
 OR { 2969}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 52   and name HB3 ))
 ASSI { 2970}
   (( segid "    " and resid 19   and name HB3 ))
   (( segid "    " and resid 19   and name HA  ))
      2.600     0.800     0.800 peak  2970 spectrum    1 weight  0.10000E+01 volume  0.53267E-02 ppm1      2.226 ppm2      4.015 CV     1
 OR { 2970}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name HA  ))
 ASSI { 2978}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 46   and name H   ))
      3.400     1.500     1.500 peak  2978 spectrum    1 weight  0.10000E+01 volume  0.94140E-03 ppm1      2.571 ppm2      7.707 CV     1
 OR { 2978}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 49   and name H   ))
 ASSI { 2979}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 50   and name H   ))
      4.700     2.800     1.300 peak  2979 spectrum    1 weight  0.10000E+01 volume  0.33829E-03 ppm1      2.550 ppm2      8.197 CV     1
 OR { 2979}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 52   and name H   ))
 ASSI { 2981}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name H   ))
      2.300     0.700     0.700 peak  2981 spectrum    1 weight  0.10000E+01 volume  0.47911E-02 ppm1      2.228 ppm2      7.985 CV     1
 OR { 2981}
   (( segid "    " and resid 19   and name HB3 ))
   (( segid "    " and resid 19   and name H   ))
 ASSI { 2982}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 48   and name H   ))
      3.800     1.800     1.800 peak  2982 spectrum    1 weight  0.10000E+01 volume  0.14577E-02 ppm1      2.227 ppm2      8.303 CV     1
 OR { 2982}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 48   and name H   ))
 OR { 2982}
   (( segid "    " and resid 36   and name HG12))
   (( segid "    " and resid 18   and name H   ))
 ASSI { 2985}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 52   and name H   ))
      3.100     1.200     1.200 peak  2985 spectrum    1 weight  0.10000E+01 volume  0.21164E-02 ppm1      4.211 ppm2      8.209 CV     1
 OR { 2985}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 50   and name H   ))
 ASSI { 2987}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HE21))
      4.700     2.800     1.300 peak  2987 spectrum    1 weight  0.10000E+01 volume  0.30708E-03 ppm1      4.207 ppm2      7.067 CV     1
 OR { 2987}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 52   and name HD2 ))
 OR { 2987}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 45   and name HE  ))
 ASSI { 2988}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 51   and name HD1%)
      2.600     0.800     0.800 peak  2988 spectrum    1 weight  0.10000E+01 volume  0.38569E-02 ppm1      3.882 ppm2      0.775 CV     1
 OR { 2988}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 2989}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 32   and name HG1%)
      3.600     1.600     1.600 peak  2989 spectrum    1 weight  0.10000E+01 volume  0.36611E-02 ppm1      3.862 ppm2      1.326 CV     1
 OR { 2989}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HD2 ))
 OR { 2989}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HD3 ))
 ASSI { 2990}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HG3 ))
      2.700     0.900     0.900 peak  2990 spectrum    1 weight  0.10000E+01 volume  0.42755E-02 ppm1      3.886 ppm2      1.515 CV     1
 OR { 2990}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 51   and name HG12))
 ASSI { 2992}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HB3 ))
      2.800     0.900     0.900 peak  2992 spectrum    1 weight  0.10000E+01 volume  0.48588E-02 ppm1      3.886 ppm2      1.867 CV     1
 OR { 2992}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 47   and name HB2 ))
 ASSI { 2995}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 133  and name HG3 ))
      1.900     0.400     0.400 peak  2995 spectrum    1 weight  0.10000E+01 volume  0.31729E-01 ppm1      1.873 ppm2      1.487 CV     1
 OR { 2995}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 69   and name HG3 ))
 OR { 2995}
   (( segid "    " and resid 69   and name HB3 ))
   (( segid "    " and resid 69   and name HG2 ))
 OR { 2995}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 132  and name HG3 ))
 OR { 2995}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 133  and name HG2 ))
 OR { 2995}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 132  and name HG2 ))
 OR { 2995}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 132  and name HG3 ))
 OR { 2995}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 133  and name HG2 ))
 OR { 2995}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 69   and name HG2 ))
 OR { 2995}
   (( segid "    " and resid 69   and name HB3 ))
   (( segid "    " and resid 69   and name HG3 ))
 ASSI { 2999}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 134  and name HD3 ))
      3.700     1.700     1.700 peak  2999 spectrum    1 weight  0.10000E+01 volume  0.12545E-02 ppm1      1.872 ppm2      3.226 CV     1
 OR { 2999}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 134  and name HD2 ))
 OR { 2999}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 134  and name HD3 ))
 OR { 2999}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 134  and name HD2 ))
 OR { 2999}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 68   and name HD3 ))
 OR { 2999}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 68   and name HD2 ))
 ASSI { 3001}
   (( segid "    " and resid 132  and name HB3 ))
   (( segid "    " and resid 132  and name HA  ))
      2.300     0.600     0.600 peak  3001 spectrum    1 weight  0.10000E+01 volume  0.11006E-01 ppm1      1.875 ppm2      4.382 CV     1
 OR { 3001}
   (( segid "    " and resid 69   and name HB3 ))
   (( segid "    " and resid 69   and name HA  ))
 OR { 3001}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 133  and name HA  ))
 OR { 3001}
   (( segid "    " and resid 133  and name HB3 ))
   (( segid "    " and resid 133  and name HA  ))
 OR { 3001}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 132  and name HA  ))
 OR { 3001}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 69   and name HA  ))
 ASSI { 3007}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 49   and name HB2 ))
      4.300     2.300     1.700 peak  3007 spectrum    1 weight  0.10000E+01 volume  0.48016E-03 ppm1      1.338 ppm2      2.209 CV     1
 OR { 3007}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 49   and name HB3 ))
 OR { 3007}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 63   and name HB  ))
 ASSI { 3011}
   (( segid "    " and resid 48   and name HG2 ))
   (  segid "    " and resid 51   and name HD1%)
      4.000     2.000     2.000 peak  3011 spectrum    1 weight  0.10000E+01 volume  0.12781E-02 ppm1      1.336 ppm2      0.778 CV     1
 OR { 3011}
   (( segid "    " and resid 48   and name HG2 ))
   (  segid "    " and resid 37   and name HD2%)
 ASSI { 3013}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 51   and name H   ))
      4.200     2.200     1.800 peak  3013 spectrum    1 weight  0.10000E+01 volume  0.87066E-03 ppm1      1.873 ppm2      8.221 CV     1
 OR { 3013}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 50   and name H   ))
 OR { 3013}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 52   and name H   ))
 ASSI { 3018}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 52   and name H   ))
      3.800     1.800     1.800 peak  3018 spectrum    1 weight  0.10000E+01 volume  0.70100E-03 ppm1      1.334 ppm2      8.217 CV     1
 OR { 3018}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 51   and name H   ))
 OR { 3018}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 50   and name H   ))
 ASSI { 3019}
   (( segid "    " and resid 48   and name HG3 ))
   (( segid "    " and resid 52   and name H   ))
      4.000     2.000     2.000 peak  3019 spectrum    1 weight  0.10000E+01 volume  0.74801E-03 ppm1      1.514 ppm2      8.220 CV     1
 OR { 3019}
   (( segid "    " and resid 48   and name HG3 ))
   (( segid "    " and resid 51   and name H   ))
 ASSI { 3020}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 52   and name HE1 ))
      3.700     1.700     1.700 peak  3020 spectrum    1 weight  0.10000E+01 volume  0.96315E-03 ppm1      1.699 ppm2      7.818 CV     1
 OR { 3020}
   (( segid "    " and resid 64   and name HD2 ))
   (( segid "    " and resid 67   and name H   ))
 OR { 3020}
   (( segid "    " and resid 64   and name HD3 ))
   (( segid "    " and resid 67   and name H   ))
 OR { 3020}
   (( segid "    " and resid 48   and name HD3 ))
   (( segid "    " and resid 52   and name HE1 ))
 ASSI { 3021}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 52   and name H   ))
      4.400     2.400     1.600 peak  3021 spectrum    1 weight  0.10000E+01 volume  0.89209E-03 ppm1      1.687 ppm2      8.227 CV     1
 OR { 3021}
   (( segid "    " and resid 48   and name HD3 ))
   (( segid "    " and resid 52   and name H   ))
 OR { 3021}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 51   and name H   ))
 OR { 3021}
   (( segid "    " and resid 48   and name HD3 ))
   (( segid "    " and resid 51   and name H   ))
 OR { 3021}
   (( segid "    " and resid 48   and name HD3 ))
   (( segid "    " and resid 50   and name H   ))
 ASSI { 3022}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 127  and name HA  ))
      2.500     0.800     0.800 peak  3022 spectrum    1 weight  0.10000E+01 volume  0.26280E-02 ppm1      1.702 ppm2      3.746 CV     1
 OR { 3022}
   (( segid "    " and resid 47   and name HG3 ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI { 3023}
   (( segid "    " and resid 127  and name HA  ))
   (  segid "    " and resid 130  and name HD2%)
      2.300     0.700     0.700 peak  3023 spectrum    1 weight  0.10000E+01 volume  0.79766E-02 ppm1      3.739 ppm2      0.948 CV     1
 OR { 3023}
   (( segid "    " and resid 127  and name HA  ))
   (  segid "    " and resid 130  and name HD1%)
 OR { 3023}
   (( segid "    " and resid 127  and name HA  ))
   (  segid "    " and resid 115  and name HG2%)
 OR { 3023}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 36   and name HD1%)
 OR { 3023}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 22   and name HD2%)
 OR { 3023}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 59   and name HD2%)
 OR { 3023}
   (( segid "    " and resid 47   and name HA  ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI { 3024}
   (( segid "    " and resid 47   and name HA  ))
   (  segid "    " and resid 37   and name HD2%)
      2.200     0.600     0.600 peak  3024 spectrum    1 weight  0.10000E+01 volume  0.60317E-02 ppm1      3.740 ppm2      0.828 CV     1
 OR { 3024}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 59   and name HD1%)
 OR { 3024}
   (( segid "    " and resid 127  and name HA  ))
   (  segid "    " and resid 124  and name HG2%)
 ASSI { 3025}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HB2 ))
      2.300     0.700     0.700 peak  3025 spectrum    1 weight  0.10000E+01 volume  0.55222E-02 ppm1      3.741 ppm2      1.860 CV     1
 OR { 3025}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HB2 ))
 OR { 3025}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 127  and name HB3 ))
 OR { 3025}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 127  and name HB2 ))
 OR { 3025}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HB3 ))
 ASSI { 3026}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 127  and name HG2 ))
      2.500     0.800     0.800 peak  3026 spectrum    1 weight  0.10000E+01 volume  0.37262E-02 ppm1      3.738 ppm2      1.696 CV     1
 OR { 3026}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HG3 ))
 OR { 3026}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HG3 ))
 OR { 3026}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 37   and name HG  ))
 ASSI { 3027}
   (( segid "    " and resid 111  and name HB3 ))
   (  segid "    " and resid 115  and name HG1%)
      3.000     1.100     1.100 peak  3027 spectrum    1 weight  0.10000E+01 volume  0.16939E-02 ppm1      1.875 ppm2      1.158 CV     1
 OR { 3027}
   (( segid "    " and resid 127  and name HB3 ))
   (  segid "    " and resid 115  and name HG1%)
 OR { 3027}
   (( segid "    " and resid 127  and name HB2 ))
   (  segid "    " and resid 115  and name HG1%)
 ASSI { 3028}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 68   and name HG2 ))
      1.700     0.300     0.500 peak  3028 spectrum    1 weight  0.10000E+01 volume  0.66078E-01 ppm1      1.833 ppm2      1.641 CV     1
 OR { 3028}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 5    and name HG2 ))
 OR { 3028}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HG2 ))
 OR { 3028}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 68   and name HG3 ))
 OR { 3028}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HG3 ))
 OR { 3028}
   (( segid "    " and resid 5    and name HB3 ))
   (( segid "    " and resid 5    and name HG3 ))
 ASSI { 3030}
   (( segid "    " and resid 127  and name HG2 ))
   (  segid "    " and resid 115  and name HG2%)
      2.400     0.700     0.700 peak  3030 spectrum    1 weight  0.10000E+01 volume  0.56859E-02 ppm1      1.742 ppm2      0.948 CV     1
 OR { 3030}
   (( segid "    " and resid 127  and name HG2 ))
   (  segid "    " and resid 130  and name HD2%)
 OR { 3030}
   (( segid "    " and resid 127  and name HG2 ))
   (  segid "    " and resid 130  and name HD1%)
 OR { 3030}
   (( segid "    " and resid 111  and name HG2 ))
   (  segid "    " and resid 114  and name HD1%)
 ASSI { 3031}
   (( segid "    " and resid 127  and name HG2 ))
   (  segid "    " and resid 119  and name HD2%)
      2.900     1.100     1.100 peak  3031 spectrum    1 weight  0.10000E+01 volume  0.30487E-02 ppm1      1.738 ppm2      0.806 CV     1
 OR { 3031}
   (( segid "    " and resid 47   and name HG3 ))
   (  segid "    " and resid 37   and name HD2%)
 OR { 3031}
   (( segid "    " and resid 111  and name HG2 ))
   (  segid "    " and resid 98   and name HD2%)
 OR { 3031}
   (( segid "    " and resid 47   and name HG3 ))
   (  segid "    " and resid 51   and name HD1%)
 ASSI { 3032}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 127  and name HA  ))
      2.600     0.900     0.900 peak  3032 spectrum    1 weight  0.10000E+01 volume  0.26139E-02 ppm1      1.752 ppm2      3.748 CV     1
 OR { 3032}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 90   and name HA  ))
 OR { 3032}
   (( segid "    " and resid 47   and name HG3 ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI { 3033}
   (( segid "    " and resid 127  and name HD2 ))
   (( segid "    " and resid 115  and name HB  ))
      2.900     1.000     1.000 peak  3033 spectrum    1 weight  0.10000E+01 volume  0.32716E-02 ppm1      3.202 ppm2      2.229 CV     1
 OR { 3033}
   (( segid "    " and resid 128  and name HD3 ))
   (( segid "    " and resid 126  and name HB2 ))
 OR { 3033}
   (( segid "    " and resid 128  and name HD3 ))
   (( segid "    " and resid 126  and name HG3 ))
 OR { 3033}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 126  and name HB2 ))
 OR { 3033}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 126  and name HG3 ))
 OR { 3033}
   (( segid "    " and resid 47   and name HD3 ))
   (( segid "    " and resid 50   and name HB  ))
 OR { 3033}
   (( segid "    " and resid 111  and name HD3 ))
   (( segid "    " and resid 114  and name HB  ))
 ASSI { 3034}
   (( segid "    " and resid 127  and name HD2 ))
   (( segid "    " and resid 115  and name HB  ))
      3.000     1.100     1.100 peak  3034 spectrum    1 weight  0.10000E+01 volume  0.35823E-02 ppm1      3.211 ppm2      2.178 CV     1
 OR { 3034}
   (( segid "    " and resid 128  and name HD3 ))
   (( segid "    " and resid 126  and name HB2 ))
 OR { 3034}
   (( segid "    " and resid 128  and name HD3 ))
   (( segid "    " and resid 126  and name HG3 ))
 OR { 3034}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 126  and name HB2 ))
 OR { 3034}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 126  and name HG3 ))
 OR { 3034}
   (( segid "    " and resid 127  and name HD3 ))
   (( segid "    " and resid 115  and name HB  ))
 OR { 3034}
   (( segid "    " and resid 111  and name HD3 ))
   (  segid "    " and resid 102  and name HE% )
 OR { 3034}
   (( segid "    " and resid 47   and name HD3 ))
   (( segid "    " and resid 50   and name HB  ))
 ASSI { 3035}
   (( segid "    " and resid 127  and name HD2 ))
   (( segid "    " and resid 116  and name HA  ))
      2.900     1.100     1.100 peak  3035 spectrum    1 weight  0.10000E+01 volume  0.44263E-02 ppm1      3.203 ppm2      4.315 CV     1
 OR { 3035}
   (( segid "    " and resid 134  and name HD2 ))
   (( segid "    " and resid 134  and name HA  ))
 OR { 3035}
   (( segid "    " and resid 134  and name HD3 ))
   (( segid "    " and resid 134  and name HA  ))
 OR { 3035}
   (( segid "    " and resid 4    and name HD3 ))
   (( segid "    " and resid 4    and name HA  ))
 OR { 3035}
   (( segid "    " and resid 4    and name HD2 ))
   (( segid "    " and resid 4    and name HA  ))
 OR { 3035}
   (( segid "    " and resid 5    and name HD3 ))
   (( segid "    " and resid 5    and name HA  ))
 ASSI { 3036}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 19   and name H   ))
      3.700     1.700     1.700 peak  3036 spectrum    1 weight  0.10000E+01 volume  0.10740E-02 ppm1      1.817 ppm2      7.985 CV     1
 OR { 3036}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 84   and name H   ))
 ASSI { 3038}
   (( segid "    " and resid 46   and name HA  ))
   (  segid "    " and resid 50   and name HD1%)
      3.700     1.700     1.700 peak  3038 spectrum    1 weight  0.10000E+01 volume  0.18209E-02 ppm1      4.598 ppm2      0.841 CV     1
 OR { 3038}
   (( segid "    " and resid 46   and name HA  ))
   (  segid "    " and resid 37   and name HD2%)
 ASSI { 3040}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 45   and name HB2 ))
      4.100     2.100     1.900 peak  3040 spectrum    1 weight  0.10000E+01 volume  0.92731E-03 ppm1      4.595 ppm2      1.700 CV     1
 OR { 3040}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 47   and name HG3 ))
 OR { 3040}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 45   and name HB3 ))
 ASSI { 3041}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 47   and name HB3 ))
      4.500     2.500     1.500 peak  3041 spectrum    1 weight  0.10000E+01 volume  0.92887E-03 ppm1      4.597 ppm2      1.884 CV     1
 OR { 3041}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 47   and name HB2 ))
 OR { 3041}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 48   and name HB3 ))
 ASSI { 3044}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 45   and name HG2 ))
      4.600     2.600     1.400 peak  3044 spectrum    1 weight  0.10000E+01 volume  0.81899E-03 ppm1      4.727 ppm2      1.481 CV     1
 OR { 3044}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 48   and name HG3 ))
 ASSI { 3045}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 45   and name HB2 ))
      3.900     1.900     1.900 peak  3045 spectrum    1 weight  0.10000E+01 volume  0.17901E-02 ppm1      4.727 ppm2      1.666 CV     1
 OR { 3045}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 48   and name HD3 ))
 OR { 3045}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 45   and name HB3 ))
 ASSI { 3046}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 48   and name HB3 ))
      4.100     2.100     1.900 peak  3046 spectrum    1 weight  0.10000E+01 volume  0.99382E-03 ppm1      4.721 ppm2      1.870 CV     1
 OR { 3046}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 47   and name HB3 ))
 OR { 3046}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 47   and name HB2 ))
 ASSI { 3048}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 80   and name HB3 ))
      3.100     1.200     1.200 peak  3048 spectrum    1 weight  0.10000E+01 volume  0.24163E-02 ppm1      1.220 ppm2      2.557 CV     1
 OR { 3048}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 49   and name HG2 ))
 ASSI { 3050}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 46   and name HB  ))
      3.000     1.200     1.200 peak  3050 spectrum    1 weight  0.10000E+01 volume  0.18048E-02 ppm1      1.219 ppm2      4.691 CV     1
 OR { 3050}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 77   and name HB  ))
 ASSI { 3051}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 77   and name HA  ))
      3.300     1.400     1.400 peak  3051 spectrum    1 weight  0.10000E+01 volume  0.22622E-02 ppm1      1.217 ppm2      4.613 CV     1
 OR { 3051}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 46   and name HA  ))
 ASSI { 3056}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 49   and name HE22))
      3.700     1.700     1.700 peak  3056 spectrum    1 weight  0.10000E+01 volume  0.15121E-02 ppm1      1.220 ppm2      7.454 CV     1
 OR { 3056}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 80   and name HE21))
 ASSI { 3057}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 46   and name H   ))
      2.700     0.900     0.900 peak  3057 spectrum    1 weight  0.10000E+01 volume  0.32419E-02 ppm1      1.216 ppm2      7.681 CV     1
 OR { 3057}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 49   and name H   ))
 ASSI { 3066}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 13   and name HG3 ))
      2.300     2.300     3.700 peak  3066 spectrum    1 weight  0.10000E+01 volume  0.13712E-02 ppm1      2.301 ppm2      2.436 CV     1
 OR { 3066}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 13   and name HG2 ))
 OR { 3066}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 13   and name HB3 ))
 OR { 3066}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 67   and name HG3 ))
 ASSI { 3086}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 46   and name H   ))
      5.500     3.800     0.500 peak  3086 spectrum    1 weight  0.10000E+01 volume  0.31702E-03 ppm1      2.312 ppm2      7.680 CV     1
 OR { 3086}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 49   and name H   ))
 ASSI { 3088}
   (( segid "    " and resid 45   and name HD3 ))
   (( segid "    " and resid 46   and name H   ))
      5.500     3.700     0.500 peak  3088 spectrum    1 weight  0.10000E+01 volume  0.37203E-03 ppm1      2.854 ppm2      7.681 CV     1
 OR { 3088}
   (( segid "    " and resid 45   and name HD3 ))
   (( segid "    " and resid 49   and name H   ))
 ASSI { 3103}
   (( segid "    " and resid 30   and name HB3 ))
   (( segid "    " and resid 30   and name HB2 ))
      1.700     0.300     0.500 peak  3103 spectrum    1 weight  0.10000E+01 volume  0.18999E-01 ppm1      1.859 ppm2      2.057 CV     1
 OR { 3103}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HG2 ))
 ASSI { 3108}
   (( segid "    " and resid 44   and name HG2 ))
   (( segid "    " and resid 44   and name HA  ))
      4.000     2.000     2.000 peak  3108 spectrum    1 weight  0.10000E+01 volume  0.17637E-02 ppm1      2.056 ppm2      4.379 CV     1
 OR { 3108}
   (( segid "    " and resid 44   and name HG2 ))
   (( segid "    " and resid 43   and name HA  ))
 ASSI { 3109}
   (( segid "    " and resid 44   and name HG3 ))
   (( segid "    " and resid 44   and name HA  ))
      3.700     1.700     1.700 peak  3109 spectrum    1 weight  0.10000E+01 volume  0.27388E-02 ppm1      1.905 ppm2      4.379 CV     1
 OR { 3109}
   (( segid "    " and resid 44   and name HG3 ))
   (( segid "    " and resid 43   and name HA  ))
 ASSI { 3117}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 7    and name HB3 ))
      3.700     1.700     1.700 peak  3117 spectrum    1 weight  0.10000E+01 volume  0.19036E-02 ppm1      3.546 ppm2      2.205 CV     1
 OR { 3117}
   (( segid "    " and resid 44   and name HD2 ))
   (( segid "    " and resid 44   and name HB3 ))
 ASSI { 3119}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 7    and name HG2 ))
      2.200     0.600     0.600 peak  3119 spectrum    1 weight  0.10000E+01 volume  0.10433E-01 ppm1      3.550 ppm2      1.941 CV     1
 OR { 3119}
   (( segid "    " and resid 44   and name HD2 ))
   (( segid "    " and resid 44   and name HG3 ))
 OR { 3119}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 7    and name HG3 ))
 ASSI { 3124}
   (( segid "    " and resid 44   and name HD2 ))
   (( segid "    " and resid 45   and name H   ))
      3.600     1.600     1.600 peak  3124 spectrum    1 weight  0.10000E+01 volume  0.20110E-03 ppm1      3.542 ppm2      8.106 CV     1
 OR { 3124}
   (( segid "    " and resid 7    and name HD3 ))
   (( segid "    " and resid 45   and name H   ))
 ASSI { 3144}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 7    and name HB2 ))
      2.800     1.000     1.000 peak  3144 spectrum    1 weight  0.10000E+01 volume  0.33525E-02 ppm1      0.744 ppm2      1.714 CV     1
 OR { 3144}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 45   and name HB3 ))
 OR { 3144}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 3146}
   (  segid "    " and resid 43   and name HG1%)
   (  segid "    " and resid 6    and name HB% )
      3.300     1.300     1.300 peak  3146 spectrum    1 weight  0.10000E+01 volume  0.26690E-02 ppm1      0.744 ppm2      1.343 CV     1
 OR { 3146}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 45   and name HG3 ))
 ASSI { 3148}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 9    and name HB3 ))
      3.400     1.400     1.400 peak  3148 spectrum    1 weight  0.10000E+01 volume  0.11452E-02 ppm1      0.744 ppm2      2.851 CV     1
 OR { 3148}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 45   and name HD3 ))
 OR { 3148}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 9    and name HB2 ))
 ASSI { 3152}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HB  ))
      2.500     0.800     0.800 peak  3152 spectrum    1 weight  0.10000E+01 volume  0.60840E-02 ppm1      4.383 ppm2      1.901 CV     1
 OR { 3152}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 44   and name HG3 ))
 ASSI { 3163}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 42   and name HA  ))
      2.200     2.200     3.800 peak  3163 spectrum    1 weight  0.10000E+01 volume  0.18683E-02 ppm1      0.743 ppm2      4.201 CV     1
 OR { 3163}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 42   and name HB  ))
 OR { 3163}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 8    and name HA  ))
 OR { 3163}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 49   and name HA  ))
 ASSI { 3165}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 42   and name HB  ))
      2.200     2.200     3.800 peak  3165 spectrum    1 weight  0.10000E+01 volume  0.30626E-02 ppm1      0.713 ppm2      4.202 CV     1
 OR { 3165}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 42   and name HA  ))
 OR { 3165}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 49   and name HA  ))
 ASSI { 3169}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 9    and name HE3 ))
      3.400     1.400     1.400 peak  3169 spectrum    1 weight  0.10000E+01 volume  0.14232E-02 ppm1      0.713 ppm2      7.105 CV     1
 OR { 3169}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 45   and name HE  ))
 ASSI { 3172}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 42   and name H   ))
      3.400     1.500     1.500 peak  3172 spectrum    1 weight  0.10000E+01 volume  0.46777E-03 ppm1      0.713 ppm2      8.164 CV     1
 OR { 3172}
   (  segid "    " and resid 43   and name HG2%)
   (( segid "    " and resid 50   and name H   ))
 ASSI { 3174}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 9    and name HE3 ))
      3.300     1.400     1.400 peak  3174 spectrum    1 weight  0.10000E+01 volume  0.13139E-02 ppm1      0.744 ppm2      7.101 CV     1
 OR { 3174}
   (  segid "    " and resid 43   and name HG1%)
   (( segid "    " and resid 45   and name HE  ))
 ASSI { 3179}
   (( segid "    " and resid 43   and name HB  ))
   (( segid "    " and resid 9    and name HE3 ))
      4.400     2.500     1.600 peak  3179 spectrum    1 weight  0.10000E+01 volume  0.42015E-03 ppm1      1.903 ppm2      7.110 CV     1
 OR { 3179}
   (( segid "    " and resid 43   and name HB  ))
   (( segid "    " and resid 45   and name HE  ))
 ASSI { 3183}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 40   and name HG  ))
      4.900     3.000     1.100 peak  3183 spectrum    1 weight  0.10000E+01 volume  0.40083E-03 ppm1      4.204 ppm2      1.905 CV     1
 OR { 3183}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 43   and name HB  ))
 OR { 3183}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 40   and name HB2 ))
 ASSI { 3184}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 41   and name HB3 ))
      3.600     1.700     1.700 peak  3184 spectrum    1 weight  0.10000E+01 volume  0.43145E-03 ppm1      4.202 ppm2      2.819 CV     1
 OR { 3184}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 45   and name HD3 ))
 ASSI { 3188}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 40   and name HG  ))
      4.100     2.100     1.900 peak  3188 spectrum    1 weight  0.10000E+01 volume  0.94282E-03 ppm1      4.199 ppm2      1.905 CV     1
 OR { 3188}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 40   and name HB2 ))
 OR { 3188}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 43   and name HB  ))
 ASSI { 3195}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 41   and name HD22))
      3.900     1.900     1.900 peak  3195 spectrum    1 weight  0.10000E+01 volume  0.16411E-02 ppm1      2.836 ppm2      6.743 CV     1
 OR { 3195}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 41   and name HD22))
 OR { 3195}
   (( segid "    " and resid 131  and name HB2 ))
   (  segid "    " and resid 131  and name HE% )
 ASSI { 3198}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 131  and name H   ))
      2.700     0.900     0.900 peak  3198 spectrum    1 weight  0.10000E+01 volume  0.30728E-02 ppm1      2.835 ppm2      7.441 CV     1
 OR { 3198}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 41   and name HD21))
 OR { 3198}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 41   and name HD21))
 ASSI { 3203}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 133  and name HG2 ))
      4.500     2.500     1.500 peak  3203 spectrum    1 weight  0.10000E+01 volume  0.64450E-03 ppm1      2.796 ppm2      1.553 CV     1
 OR { 3203}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 133  and name HG3 ))
 OR { 3203}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 40   and name HB3 ))
 OR { 3203}
   (( segid "    " and resid 14   and name HG2 ))
   (  segid "    " and resid 15   and name HB% )
 OR { 3203}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 40   and name HB3 ))
 ASSI { 3205}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 133  and name HG2 ))
      4.200     2.200     1.800 peak  3205 spectrum    1 weight  0.10000E+01 volume  0.90102E-03 ppm1      2.830 ppm2      1.484 CV     1
 OR { 3205}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 133  and name HG3 ))
 OR { 3205}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 132  and name HG2 ))
 ASSI { 3207}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 41   and name HA  ))
      4.000     2.000     2.000 peak  3207 spectrum    1 weight  0.10000E+01 volume  0.45319E-03 ppm1      2.837 ppm2      4.770 CV     1
 OR { 3207}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 41   and name HA  ))
 OR { 3207}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 131  and name HA  ))
 ASSI { 3213}
   (( segid "    " and resid 40   and name HB2 ))
   (  segid "    " and resid 40   and name HD2%)
      2.100     0.500     0.500 peak  3213 spectrum    1 weight  0.10000E+01 volume  0.19414E-01 ppm1      1.921 ppm2      0.957 CV     1
 OR { 3213}
   (( segid "    " and resid 22   and name HB2 ))
   (  segid "    " and resid 22   and name HD1%)
 OR { 3213}
   (( segid "    " and resid 40   and name HB2 ))
   (  segid "    " and resid 40   and name HD1%)
 ASSI { 3217}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 25   and name HE2 ))
      5.100     3.200     0.900 peak  3217 spectrum    1 weight  0.10000E+01 volume  0.46629E-03 ppm1      1.914 ppm2      3.011 CV     1
 OR { 3217}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 25   and name HE3 ))
 OR { 3217}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 21   and name HB3 ))
 ASSI { 3218}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 41   and name HB3 ))
      4.200     2.200     1.800 peak  3218 spectrum    1 weight  0.10000E+01 volume  0.46427E-03 ppm1      1.923 ppm2      2.854 CV     1
 OR { 3218}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 45   and name HD3 ))
 OR { 3218}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 26   and name HB2 ))
 OR { 3218}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 53   and name HB3 ))
 ASSI { 3219}
   (( segid "    " and resid 40   and name HB3 ))
   (( segid "    " and resid 41   and name HB3 ))
      4.700     2.800     1.300 peak  3219 spectrum    1 weight  0.10000E+01 volume  0.20494E-03 ppm1      1.529 ppm2      2.882 CV     1
 OR { 3219}
   (( segid "    " and resid 40   and name HB3 ))
   (( segid "    " and resid 45   and name HD3 ))
 OR { 3219}
   (( segid "    " and resid 40   and name HB3 ))
   (( segid "    " and resid 53   and name HB3 ))
 ASSI { 3221}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 80   and name HA  ))
      3.500     1.500     1.500 peak  3221 spectrum    1 weight  0.10000E+01 volume  0.17600E-02 ppm1      1.905 ppm2      3.968 CV     1
 OR { 3221}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 81   and name HA  ))
 ASSI { 3222}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 19   and name HA  ))
      3.300     1.300     1.300 peak  3222 spectrum    1 weight  0.10000E+01 volume  0.14954E-02 ppm1      1.925 ppm2      4.005 CV     1
 OR { 3222}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI { 3223}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 37   and name HA  ))
      3.400     1.500     1.500 peak  3223 spectrum    1 weight  0.10000E+01 volume  0.13126E-02 ppm1      1.922 ppm2      3.944 CV     1
 OR { 3223}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI { 3226}
   (( segid "    " and resid 40   and name HB3 ))
   (( segid "    " and resid 37   and name HA  ))
      3.200     1.300     1.300 peak  3226 spectrum    1 weight  0.10000E+01 volume  0.11957E-02 ppm1      1.525 ppm2      3.929 CV     1
 OR { 3226}
   (( segid "    " and resid 40   and name HB3 ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI { 3229}
   (  segid "    " and resid 40   and name HD1%)
   (  segid "    " and resid 54   and name HD2%)
      4.000     2.000     2.000 peak  3229 spectrum    1 weight  0.10000E+01 volume  0.19364E-02 ppm1      0.993 ppm2      0.406 CV     1
 OR { 3229}
   (  segid "    " and resid 40   and name HD1%)
   (  segid "    " and resid 54   and name HD1%)
 OR { 3229}
   (  segid "    " and resid 22   and name HD1%)
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 3230}
   (  segid "    " and resid 40   and name HD1%)
   (  segid "    " and resid 20   and name HD2%)
      1.700     1.700     4.300 peak  3230 spectrum    1 weight  0.10000E+01 volume  0.72273E-02 ppm1      0.989 ppm2      0.607 CV     1
 OR { 3230}
   (  segid "    " and resid 40   and name HD1%)
   (  segid "    " and resid 51   and name HG2%)
 ASSI { 3231}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 40   and name HB3 ))
      2.500     0.800     0.800 peak  3231 spectrum    1 weight  0.10000E+01 volume  0.96769E-02 ppm1      0.989 ppm2      1.528 CV     1
 OR { 3231}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 17   and name HG  ))
 ASSI { 3233}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 83   and name HG3 ))
      3.400     1.400     1.400 peak  3233 spectrum    1 weight  0.10000E+01 volume  0.29155E-02 ppm1      0.973 ppm2      2.462 CV     1
 OR { 3233}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 13   and name HG3 ))
 OR { 3233}
   (  segid "    " and resid 82   and name HD1%)
   (( segid "    " and resid 85   and name HG2 ))
 OR { 3233}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 13   and name HG2 ))
 ASSI { 3234}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 45   and name HD3 ))
      3.700     1.700     1.700 peak  3234 spectrum    1 weight  0.10000E+01 volume  0.12599E-02 ppm1      0.987 ppm2      2.856 CV     1
 OR { 3234}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 14   and name HG2 ))
 OR { 3234}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 9    and name HB2 ))
 OR { 3234}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 53   and name HB3 ))
 OR { 3234}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 41   and name HB3 ))
 ASSI { 3235}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 18   and name HD3 ))
      2.900     1.100     1.100 peak  3235 spectrum    1 weight  0.10000E+01 volume  0.24022E-02 ppm1      0.986 ppm2      3.360 CV     1
 OR { 3235}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 16   and name HB3 ))
 ASSI { 3236}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 42   and name HB  ))
      3.800     1.800     1.800 peak  3236 spectrum    1 weight  0.10000E+01 volume  0.14969E-02 ppm1      0.987 ppm2      4.224 CV     1
 OR { 3236}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 42   and name HA  ))
 OR { 3236}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 23   and name HA  ))
 ASSI { 3239}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 102  and name H   ))
      3.200     1.200     1.200 peak  3239 spectrum    1 weight  0.10000E+01 volume  0.26426E-02 ppm1      0.927 ppm2      8.646 CV     1
 OR { 3239}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 97   and name H   ))
 ASSI { 3243}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 9    and name HE3 ))
      4.300     2.400     1.700 peak  3243 spectrum    1 weight  0.10000E+01 volume  0.65496E-03 ppm1      0.988 ppm2      7.077 CV     1
 OR { 3243}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 45   and name HE  ))
 ASSI { 3244}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 16   and name HD2 ))
      3.700     1.800     1.800 peak  3244 spectrum    1 weight  0.10000E+01 volume  0.66180E-03 ppm1      0.991 ppm2      7.296 CV     1
 OR { 3244}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 24   and name H   ))
 ASSI { 3245}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 39   and name H   ))
      2.900     2.900     3.100 peak  3245 spectrum    1 weight  0.10000E+01 volume  0.60910E-03 ppm1      0.990 ppm2      7.538 CV     1
 OR { 3245}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 55   and name H   ))
 ASSI { 3247}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 40   and name H   ))
      3.900     1.900     1.900 peak  3247 spectrum    1 weight  0.10000E+01 volume  0.20360E-02 ppm1      0.988 ppm2      7.870 CV     1
 OR { 3247}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 23   and name H   ))
 ASSI { 3250}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 115  and name H   ))
      4.600     2.600     1.400 peak  3250 spectrum    1 weight  0.10000E+01 volume  0.46679E-03 ppm1      1.880 ppm2      8.570 CV     1
 OR { 3250}
   (( segid "    " and resid 113  and name HG3 ))
   (( segid "    " and resid 115  and name H   ))
 OR { 3250}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 112  and name H   ))
 OR { 3250}
   (( segid "    " and resid 113  and name HG3 ))
   (( segid "    " and resid 112  and name H   ))
 ASSI { 3251}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name H   ))
      2.600     0.900     0.900 peak  3251 spectrum    1 weight  0.10000E+01 volume  0.31156E-02 ppm1      1.924 ppm2      7.866 CV     1
 OR { 3251}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 23   and name H   ))
 ASSI { 3258}
   (( segid "    " and resid 39   and name HB2 ))
   (  segid "    " and resid 36   and name HG2%)
      4.400     2.400     1.600 peak  3258 spectrum    1 weight  0.10000E+01 volume  0.57004E-03 ppm1      3.466 ppm2      0.978 CV     1
 OR { 3258}
   (( segid "    " and resid 39   and name HB2 ))
   (  segid "    " and resid 40   and name HD2%)
 OR { 3258}
   (( segid "    " and resid 39   and name HB2 ))
   (  segid "    " and resid 40   and name HD1%)
 ASSI { 3262}
   (( segid "    " and resid 39   and name HB3 ))
   (  segid "    " and resid 36   and name HG2%)
      4.600     2.700     1.400 peak  3262 spectrum    1 weight  0.10000E+01 volume  0.67678E-03 ppm1      2.858 ppm2      0.968 CV     1
 OR { 3262}
   (( segid "    " and resid 39   and name HB3 ))
   (  segid "    " and resid 40   and name HD2%)
 OR { 3262}
   (( segid "    " and resid 39   and name HB3 ))
   (  segid "    " and resid 40   and name HD1%)
 ASSI { 3271}
   (( segid "    " and resid 39   and name HD2 ))
   (( segid "    " and resid 40   and name H   ))
      5.100     3.300     0.900 peak  3271 spectrum    1 weight  0.10000E+01 volume  0.38895E-03 ppm1      7.413 ppm2      7.868 CV     1
 OR { 3271}
   (( segid "    " and resid 39   and name HD2 ))
   (( segid "    " and resid 35   and name H   ))
 ASSI { 3279}
   (( segid "    " and resid 16   and name HE1 ))
   (( segid "    " and resid 39   and name HB3 ))
      5.300     3.500     0.700 peak  3279 spectrum    1 weight  0.10000E+01 volume  0.20117E-03 ppm1      8.309 ppm2      2.853 CV     1
 OR { 3279}
   (( segid "    " and resid 16   and name HE1 ))
   (( segid "    " and resid 41   and name HB3 ))
 ASSI { 3280}
   (( segid "    " and resid 16   and name HE1 ))
   (( segid "    " and resid 20   and name HG  ))
      5.600     3.900     0.400 peak  3280 spectrum    1 weight  0.10000E+01 volume  0.12208E-03 ppm1      8.314 ppm2      1.724 CV     1
 OR { 3280}
   (( segid "    " and resid 16   and name HE1 ))
   (( segid "    " and resid 17   and name HB2 ))
 ASSI { 3282}
   (( segid "    " and resid 39   and name HD2 ))
   (( segid "    " and resid 40   and name HB2 ))
      6.000     4.700     0.000 peak  3282 spectrum    1 weight  0.10000E+01 volume  0.11323E-03 ppm1      7.415 ppm2      1.895 CV     1
 OR { 3282}
   (( segid "    " and resid 39   and name HD2 ))
   (( segid "    " and resid 37   and name HB3 ))
 ASSI { 3288}
   (( segid "    " and resid 39   and name HD2 ))
   (  segid "    " and resid 36   and name HG2%)
      4.300     2.300     1.700 peak  3288 spectrum    1 weight  0.10000E+01 volume  0.47712E-03 ppm1      7.411 ppm2      0.978 CV     1
 OR { 3288}
   (( segid "    " and resid 39   and name HD2 ))
   (  segid "    " and resid 40   and name HD2%)
 OR { 3288}
   (( segid "    " and resid 39   and name HD2 ))
   (  segid "    " and resid 40   and name HD1%)
 ASSI { 3291}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 50   and name HD1%)
      4.200     2.200     1.800 peak  3291 spectrum    1 weight  0.10000E+01 volume  0.79106E-03 ppm1      4.071 ppm2      0.936 CV     1
 OR { 3291}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 36   and name HG2%)
 OR { 3291}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 40   and name HD2%)
 OR { 3291}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 50   and name HG2%)
 ASSI { 3294}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 37   and name HB3 ))
      4.100     2.100     1.900 peak  3294 spectrum    1 weight  0.10000E+01 volume  0.77773E-03 ppm1      4.065 ppm2      1.887 CV     1
 OR { 3294}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 40   and name HB2 ))
 ASSI { 3297}
   (  segid "    " and resid 38   and name HB% )
   (  segid "    " and resid 50   and name HG2%)
      3.400     1.400     1.400 peak  3297 spectrum    1 weight  0.10000E+01 volume  0.38790E-02 ppm1      1.279 ppm2      0.947 CV     1
 OR { 3297}
   (  segid "    " and resid 38   and name HB% )
   (  segid "    " and resid 36   and name HG2%)
 ASSI { 3300}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 37   and name HB3 ))
      3.900     1.900     1.900 peak  3300 spectrum    1 weight  0.10000E+01 volume  0.18676E-02 ppm1      1.278 ppm2      1.864 CV     1
 OR { 3300}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 40   and name HB2 ))
 ASSI { 3302}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 37   and name HB2 ))
      3.400     1.400     1.400 peak  3302 spectrum    1 weight  0.10000E+01 volume  0.41236E-02 ppm1      1.279 ppm2      1.552 CV     1
 OR { 3302}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 50   and name HG12))
 ASSI { 3308}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name H   ))
      2.700     0.900     0.900 peak  3308 spectrum    1 weight  0.10000E+01 volume  0.40025E-02 ppm1      4.079 ppm2      7.581 CV     1
 OR { 3308}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 39   and name H   ))
 ASSI { 3311}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 38   and name H   ))
      2.100     0.500     0.500 peak  3311 spectrum    1 weight  0.10000E+01 volume  0.13750E-01 ppm1      1.278 ppm2      7.582 CV     1
 OR { 3311}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 39   and name H   ))
 ASSI { 3313}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 40   and name H   ))
      4.000     2.000     2.000 peak  3313 spectrum    1 weight  0.10000E+01 volume  0.18439E-02 ppm1      1.279 ppm2      7.869 CV     1
 OR { 3313}
   (  segid "    " and resid 38   and name HB% )
   (( segid "    " and resid 35   and name H   ))
 ASSI { 3316}
   (( segid "    " and resid 37   and name HA  ))
   (  segid "    " and resid 36   and name HG2%)
      2.600     0.900     0.900 peak  3316 spectrum    1 weight  0.10000E+01 volume  0.59891E-02 ppm1      3.938 ppm2      0.972 CV     1
 OR { 3316}
   (( segid "    " and resid 37   and name HA  ))
   (  segid "    " and resid 40   and name HD2%)
 OR { 3316}
   (( segid "    " and resid 37   and name HA  ))
   (  segid "    " and resid 40   and name HD1%)
 OR { 3316}
   (( segid "    " and resid 37   and name HA  ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI { 3317}
   (( segid "    " and resid 37   and name HA  ))
   (  segid "    " and resid 50   and name HD1%)
      2.500     0.800     0.800 peak  3317 spectrum    1 weight  0.10000E+01 volume  0.97374E-02 ppm1      3.929 ppm2      0.857 CV     1
 OR { 3317}
   (( segid "    " and resid 37   and name HA  ))
   (  segid "    " and resid 50   and name HG2%)
 OR { 3317}
   (( segid "    " and resid 37   and name HA  ))
   (  segid "    " and resid 37   and name HD2%)
 ASSI { 3318}
   (( segid "    " and resid 37   and name HA  ))
   (  segid "    " and resid 38   and name HB% )
      4.200     2.200     1.800 peak  3318 spectrum    1 weight  0.10000E+01 volume  0.93198E-03 ppm1      3.931 ppm2      1.287 CV     1
 OR { 3318}
   (( segid "    " and resid 37   and name HA  ))
   (  segid "    " and resid 42   and name HG2%)
 ASSI { 3319}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 50   and name HG12))
      2.100     0.600     0.600 peak  3319 spectrum    1 weight  0.10000E+01 volume  0.39255E-02 ppm1      3.929 ppm2      1.553 CV     1
 OR { 3319}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HB2 ))
 OR { 3319}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 50   and name HG13))
 ASSI { 3320}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HG  ))
      3.000     1.100     1.100 peak  3320 spectrum    1 weight  0.10000E+01 volume  0.38637E-02 ppm1      3.935 ppm2      1.673 CV     1
 OR { 3320}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 54   and name HG  ))
 ASSI { 3322}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 39   and name HB3 ))
      5.000     3.100     1.000 peak  3322 spectrum    1 weight  0.10000E+01 volume  0.39708E-03 ppm1      3.931 ppm2      2.860 CV     1
 OR { 3322}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 45   and name HD3 ))
 OR { 3322}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 53   and name HB3 ))
 ASSI { 3325}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 37   and name HB2 ))
      1.700     0.400     0.500 peak  3325 spectrum    1 weight  0.10000E+01 volume  0.68167E-02 ppm1      1.852 ppm2      1.564 CV     1
 OR { 3325}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 50   and name HG12))
 OR { 3325}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 50   and name HG13))
 ASSI { 3326}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HB3 ))
      1.700     0.300     0.500 peak  3326 spectrum    1 weight  0.10000E+01 volume  0.73330E-02 ppm1      1.558 ppm2      1.854 CV     1
 OR { 3326}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 47   and name HB3 ))
 ASSI { 3329}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 47   and name HA  ))
      3.900     1.900     1.900 peak  3329 spectrum    1 weight  0.10000E+01 volume  0.35616E-03 ppm1      1.545 ppm2      3.740 CV     1
 OR { 3329}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 50   and name HA  ))
 OR { 3329}
   (( segid "    " and resid 119  and name HB3 ))
   (( segid "    " and resid 127  and name HA  ))
 ASSI { 3331}
   (( segid "    " and resid 138  and name HG  ))
   (( segid "    " and resid 140  and name HA  ))
      4.000     2.000     2.000 peak  3331 spectrum    1 weight  0.10000E+01 volume  0.62490E-03 ppm1      1.648 ppm2      4.534 CV     1
 OR { 3331}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 6    and name HA  ))
 OR { 3331}
   (( segid "    " and resid 5    and name HG3 ))
   (( segid "    " and resid 6    and name HA  ))
 OR { 3331}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 126  and name HA  ))
 OR { 3331}
   (( segid "    " and resid 128  and name HG3 ))
   (( segid "    " and resid 126  and name HA  ))
 ASSI { 3333}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 36   and name H   ))
      3.200     1.300     1.300 peak  3333 spectrum    1 weight  0.10000E+01 volume  0.32553E-02 ppm1      0.803 ppm2      8.134 CV     1
 OR { 3333}
   (  segid "    " and resid 119  and name HD2%)
   (( segid "    " and resid 116  and name H   ))
 ASSI { 3337}
   (( segid "    " and resid 130  and name HG  ))
   (  segid "    " and resid 131  and name HE% )
      5.400     3.600     0.600 peak  3337 spectrum    1 weight  0.10000E+01 volume  0.29611E-03 ppm1      1.647 ppm2      6.741 CV     1
 OR { 3337}
   (( segid "    " and resid 128  and name HG3 ))
   (  segid "    " and resid 131  and name HE% )
 OR { 3337}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 9    and name HH2 ))
 ASSI { 3338}
   (( segid "    " and resid 75   and name HG  ))
   (( segid "    " and resid 76   and name HD1 ))
      4.200     2.200     1.800 peak  3338 spectrum    1 weight  0.10000E+01 volume  0.47946E-03 ppm1      1.580 ppm2      7.372 CV     1
 OR { 3338}
   (( segid "    " and resid 119  and name HG  ))
   (( segid "    " and resid 131  and name H   ))
 ASSI { 3339}
   (( segid "    " and resid 119  and name HG  ))
   (( segid "    " and resid 126  and name H   ))
      4.000     2.000     2.000 peak  3339 spectrum    1 weight  0.10000E+01 volume  0.43809E-03 ppm1      1.567 ppm2      7.604 CV     1
 OR { 3339}
   (( segid "    " and resid 119  and name HG  ))
   (( segid "    " and resid 123  and name H   ))
 ASSI { 3340}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 38   and name H   ))
      3.700     1.700     1.700 peak  3340 spectrum    1 weight  0.10000E+01 volume  0.10361E-02 ppm1      1.860 ppm2      7.586 CV     1
 OR { 3340}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 39   and name H   ))
 ASSI { 3341}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 38   and name H   ))
      3.600     1.600     1.600 peak  3341 spectrum    1 weight  0.10000E+01 volume  0.11867E-02 ppm1      1.558 ppm2      7.586 CV     1
 OR { 3341}
   (( segid "    " and resid 118  and name HB3 ))
   (( segid "    " and resid 123  and name H   ))
 OR { 3341}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 39   and name H   ))
 OR { 3341}
   (( segid "    " and resid 118  and name HB3 ))
   (( segid "    " and resid 117  and name H   ))
 ASSI { 3342}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 38   and name H   ))
      3.000     1.100     1.100 peak  3342 spectrum    1 weight  0.10000E+01 volume  0.11644E-02 ppm1      3.927 ppm2      7.569 CV     1
 OR { 3342}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 39   and name H   ))
 ASSI { 3349}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 40   and name HB3 ))
      3.900     1.900     1.900 peak  3349 spectrum    1 weight  0.10000E+01 volume  0.83359E-03 ppm1      3.661 ppm2      1.506 CV     1
 OR { 3349}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 17   and name HG  ))
 OR { 3349}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 37   and name HB2 ))
 ASSI { 3354}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 37   and name HA  ))
      4.100     2.100     1.900 peak  3354 spectrum    1 weight  0.10000E+01 volume  0.10547E-02 ppm1      3.658 ppm2      3.946 CV     1
 OR { 3354}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 20   and name HA  ))
 OR { 3354}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI { 3356}
   (( segid "    " and resid 14   and name HG3 ))
   (( segid "    " and resid 14   and name HA  ))
      3.800     1.800     1.800 peak  3356 spectrum    1 weight  0.10000E+01 volume  0.79189E-03 ppm1      2.112 ppm2      3.966 CV     1
 OR { 3356}
   (( segid "    " and resid 36   and name HB  ))
   (( segid "    " and resid 37   and name HA  ))
 OR { 3356}
   (( segid "    " and resid 36   and name HB  ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI { 3357}
   (( segid "    " and resid 36   and name HG13))
   (  segid "    " and resid 36   and name HD1%)
      2.300     0.700     0.700 peak  3357 spectrum    1 weight  0.10000E+01 volume  0.49124E-02 ppm1      2.118 ppm2      0.990 CV     1
 OR { 3357}
   (( segid "    " and resid 36   and name HG13))
   (  segid "    " and resid 32   and name HG2%)
 OR { 3357}
   (( segid "    " and resid 36   and name HG13))
   (  segid "    " and resid 36   and name HG2%)
 ASSI { 3358}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 88   and name HA  ))
      3.500     3.500     2.500 peak  3358 spectrum    1 weight  0.10000E+01 volume  0.36135E-02 ppm1      2.109 ppm2      3.981 CV     1
 OR { 3358}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 123  and name HA  ))
 ASSI { 3363}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 20   and name HG  ))
      3.100     1.200     1.200 peak  3363 spectrum    1 weight  0.10000E+01 volume  0.46801E-02 ppm1      0.965 ppm2      1.666 CV     1
 OR { 3363}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 37   and name HG  ))
 ASSI { 3364}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 50   and name HG12))
      2.300     0.700     0.700 peak  3364 spectrum    1 weight  0.10000E+01 volume  0.57108E-02 ppm1      0.970 ppm2      1.525 CV     1
 OR { 3364}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 17   and name HG  ))
 OR { 3364}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 37   and name HB2 ))
 ASSI { 3366}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 33   and name H   ))
      3.900     1.900     1.900 peak  3366 spectrum    1 weight  0.10000E+01 volume  0.78086E-03 ppm1      1.010 ppm2      7.997 CV     1
 OR { 3366}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 34   and name H   ))
 ASSI { 3368}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 33   and name H   ))
      4.000     2.000     2.000 peak  3368 spectrum    1 weight  0.10000E+01 volume  0.11654E-02 ppm1      0.973 ppm2      7.989 CV     1
 OR { 3368}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 34   and name H   ))
 ASSI { 3369}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 40   and name H   ))
      3.800     1.800     1.800 peak  3369 spectrum    1 weight  0.10000E+01 volume  0.12764E-02 ppm1      0.975 ppm2      7.871 CV     1
 OR { 3369}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 35   and name H   ))
 ASSI { 3376}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 18   and name HB2 ))
      4.100     2.100     1.900 peak  3376 spectrum    1 weight  0.10000E+01 volume  0.23944E-02 ppm1      4.201 ppm2      1.817 CV     1
 OR { 3376}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 18   and name HB2 ))
 ASSI { 3379}
   (  segid "    " and resid 35   and name HB% )
   (  segid "    " and resid 32   and name HG2%)
      2.600     0.900     0.900 peak  3379 spectrum    1 weight  0.10000E+01 volume  0.76789E-02 ppm1      1.415 ppm2      1.011 CV     1
 OR { 3379}
   (  segid "    " and resid 35   and name HB% )
   (  segid "    " and resid 36   and name HD1%)
 ASSI { 3380}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 30   and name HG2 ))
      2.500     0.800     0.800 peak  3380 spectrum    1 weight  0.10000E+01 volume  0.62337E-02 ppm1      1.415 ppm2      2.134 CV     1
 OR { 3380}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 36   and name HG13))
 ASSI { 3384}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 32   and name HA  ))
      2.400     0.700     0.700 peak  3384 spectrum    1 weight  0.10000E+01 volume  0.65991E-02 ppm1      1.415 ppm2      3.965 CV     1
 OR { 3384}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 20   and name HA  ))
 ASSI { 3386}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 18   and name HA  ))
      5.200     3.300     0.800 peak  3386 spectrum    1 weight  0.10000E+01 volume  0.69689E-03 ppm1      4.200 ppm2      3.795 CV     1
 OR { 3386}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 18   and name HA  ))
 ASSI { 3387}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 36   and name HA  ))
      4.400     2.500     1.600 peak  3387 spectrum    1 weight  0.10000E+01 volume  0.55336E-03 ppm1      4.192 ppm2      3.678 CV     1
 OR { 3387}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 54   and name HA  ))
 OR { 3387}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 118  and name HA  ))
 ASSI { 3391}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 24   and name H   ))
      3.100     3.100     2.900 peak  3391 spectrum    1 weight  0.10000E+01 volume  0.62702E-03 ppm1      1.415 ppm2      7.284 CV     1
 OR { 3391}
   (  segid "    " and resid 35   and name HB% )
   (  segid "    " and resid 66   and name HD% )
 ASSI { 3393}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 36   and name H   ))
      2.500     0.800     0.800 peak  3393 spectrum    1 weight  0.10000E+01 volume  0.63559E-02 ppm1      1.415 ppm2      8.101 CV     1
 OR { 3393}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 24   and name HD21))
 ASSI { 3394}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 34   and name H   ))
      3.300     1.300     1.300 peak  3394 spectrum    1 weight  0.10000E+01 volume  0.31869E-02 ppm1      1.416 ppm2      7.988 CV     1
 OR { 3394}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 33   and name H   ))
 ASSI { 3397}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 37   and name H   ))
      4.500     2.600     1.500 peak  3397 spectrum    1 weight  0.10000E+01 volume  0.30541E-03 ppm1      4.193 ppm2      8.591 CV     1
 OR { 3397}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 22   and name H   ))
 ASSI { 3399}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 17   and name H   ))
      4.700     2.800     1.300 peak  3399 spectrum    1 weight  0.10000E+01 volume  0.25565E-03 ppm1      4.201 ppm2      8.741 CV     1
 OR { 3399}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 14   and name H   ))
 ASSI { 3403}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 20   and name HD2%)
      3.300     1.400     1.400 peak  3403 spectrum    1 weight  0.10000E+01 volume  0.20713E-02 ppm1      3.965 ppm2      0.612 CV     1
 OR { 3403}
   (( segid "    " and resid 80   and name HA  ))
   (  segid "    " and resid 84   and name HD2%)
 ASSI { 3404}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 40   and name HD1%)
      2.300     0.700     0.700 peak  3404 spectrum    1 weight  0.10000E+01 volume  0.75833E-02 ppm1      3.969 ppm2      0.964 CV     1
 OR { 3404}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 36   and name HG2%)
 OR { 3404}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 33   and name HG1%)
 OR { 3404}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 40   and name HD2%)
 ASSI { 3408}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 37   and name HB2 ))
      3.700     1.800     1.800 peak  3408 spectrum    1 weight  0.10000E+01 volume  0.32300E-02 ppm1      3.980 ppm2      1.552 CV     1
 OR { 3408}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 15   and name HB% )
 OR { 3408}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 47   and name HG2 ))
 OR { 3408}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 50   and name HG12))
 ASSI { 3409}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 56   and name HB3 ))
      3.400     1.500     1.500 peak  3409 spectrum    1 weight  0.10000E+01 volume  0.46331E-02 ppm1      3.990 ppm2      1.856 CV     1
 OR { 3409}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 37   and name HB3 ))
 ASSI { 3410}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HG2 ))
      2.600     0.800     0.800 peak  3410 spectrum    1 weight  0.10000E+01 volume  0.34688E-02 ppm1      3.989 ppm2      2.420 CV     1
 OR { 3410}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HB2 ))
 OR { 3410}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HG3 ))
 ASSI { 3411}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HA  ))
      2.400     0.700     0.700 peak  3411 spectrum    1 weight  0.10000E+01 volume  0.39484E-02 ppm1      2.286 ppm2      4.020 CV     1
 OR { 3411}
   (( segid "    " and resid 34   and name HB3 ))
   (( segid "    " and resid 34   and name HA  ))
 ASSI { 3412}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HA  ))
      2.600     0.800     0.800 peak  3412 spectrum    1 weight  0.10000E+01 volume  0.36667E-02 ppm1      2.423 ppm2      3.984 CV     1
 OR { 3412}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 83   and name HA  ))
 OR { 3412}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 80   and name HA  ))
 OR { 3412}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI { 3415}
   (( segid "    " and resid 89   and name HG2 ))
   (  segid "    " and resid 123  and name HD1%)
      3.000     1.100     1.100 peak  3415 spectrum    1 weight  0.10000E+01 volume  0.24179E-02 ppm1      2.419 ppm2      0.831 CV     1
 OR { 3415}
   (( segid "    " and resid 34   and name HG2 ))
   (  segid "    " and resid 37   and name HD1%)
 ASSI { 3416}
   (( segid "    " and resid 34   and name HG2 ))
   (  segid "    " and resid 33   and name HG1%)
      3.200     1.300     1.300 peak  3416 spectrum    1 weight  0.10000E+01 volume  0.36943E-02 ppm1      2.415 ppm2      0.945 CV     1
 OR { 3416}
   (( segid "    " and resid 34   and name HG2 ))
   (  segid "    " and resid 33   and name HG2%)
 OR { 3416}
   (( segid "    " and resid 89   and name HG2 ))
   (  segid "    " and resid 97   and name HG2%)
 ASSI { 3417}
   (( segid "    " and resid 83   and name HG3 ))
   (  segid "    " and resid 106  and name HG2%)
      4.000     2.000     2.000 peak  3417 spectrum    1 weight  0.10000E+01 volume  0.11459E-02 ppm1      2.421 ppm2      1.288 CV     1
 OR { 3417}
   (( segid "    " and resid 34   and name HG2 ))
   (  segid "    " and resid 38   and name HB% )
 OR { 3417}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 92   and name HG2 ))
 ASSI { 3418}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HG3 ))
      1.600     0.300     0.600 peak  3418 spectrum    1 weight  0.10000E+01 volume  0.35815E-01 ppm1      2.422 ppm2      2.246 CV     1
 OR { 3418}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 19   and name HB3 ))
 OR { 3418}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 19   and name HB2 ))
 OR { 3418}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HB3 ))
 OR { 3418}
   (( segid "    " and resid 83   and name HG3 ))
   (( segid "    " and resid 83   and name HB3 ))
 OR { 3418}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HB2 ))
 ASSI { 3419}
   (( segid "    " and resid 34   and name HG3 ))
   (( segid "    " and resid 34   and name HG2 ))
      1.600     0.300     0.600 peak  3419 spectrum    1 weight  0.10000E+01 volume  0.27340E-01 ppm1      2.250 ppm2      2.427 CV     1
 OR { 3419}
   (( segid "    " and resid 126  and name HG3 ))
   (( segid "    " and resid 129  and name HG2 ))
 OR { 3419}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 129  and name HG2 ))
 ASSI { 3422}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 90   and name H   ))
      3.700     1.700     1.700 peak  3422 spectrum    1 weight  0.10000E+01 volume  0.18116E-02 ppm1      2.419 ppm2      7.880 CV     1
 OR { 3422}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 35   and name H   ))
 ASSI { 3424}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name H   ))
      2.700     0.900     0.900 peak  3424 spectrum    1 weight  0.10000E+01 volume  0.38673E-02 ppm1      2.287 ppm2      7.985 CV     1
 OR { 3424}
   (( segid "    " and resid 34   and name HB3 ))
   (( segid "    " and resid 34   and name H   ))
 ASSI { 3428}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name H   ))
      3.100     1.200     1.200 peak  3428 spectrum    1 weight  0.10000E+01 volume  0.16904E-02 ppm1      3.985 ppm2      7.870 CV     1
 OR { 3428}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 23   and name H   ))
 ASSI { 3429}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 37   and name H   ))
      3.400     1.400     1.400 peak  3429 spectrum    1 weight  0.10000E+01 volume  0.17770E-02 ppm1      3.982 ppm2      8.587 CV     1
 OR { 3429}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 22   and name H   ))
 ASSI { 3432}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 18   and name H   ))
      3.300     1.400     1.400 peak  3432 spectrum    1 weight  0.10000E+01 volume  0.10901E-02 ppm1      3.969 ppm2      8.307 CV     1
 OR { 3432}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 15   and name H   ))
 ASSI { 3433}
   (( segid "    " and resid 33   and name HA  ))
   (  segid "    " and resid 36   and name HD1%)
      1.800     0.400     0.400 peak  3433 spectrum    1 weight  0.10000E+01 volume  0.10878E-01 ppm1      3.579 ppm2      0.959 CV     1
 OR { 3433}
   (( segid "    " and resid 33   and name HA  ))
   (  segid "    " and resid 33   and name HG2%)
 OR { 3433}
   (( segid "    " and resid 33   and name HA  ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI { 3434}
   (( segid "    " and resid 33   and name HA  ))
   (  segid "    " and resid 35   and name HB% )
      4.000     2.000     2.000 peak  3434 spectrum    1 weight  0.10000E+01 volume  0.91244E-03 ppm1      3.581 ppm2      1.425 CV     1
 OR { 3434}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 105  and name HG13))
 OR { 3434}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 98   and name HB2 ))
 ASSI { 3436}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name HB  ))
      2.600     0.900     0.900 peak  3436 spectrum    1 weight  0.10000E+01 volume  0.12946E-02 ppm1      3.581 ppm2      2.338 CV     1
 OR { 3436}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 100  and name HB2 ))
 ASSI { 3441}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 83   and name HA  ))
      3.100     1.200     1.200 peak  3441 spectrum    1 weight  0.10000E+01 volume  0.10468E-02 ppm1      2.339 ppm2      3.979 CV     1
 OR { 3441}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 80   and name HA  ))
 ASSI { 3442}
   (( segid "    " and resid 33   and name HB  ))
   (( segid "    " and resid 33   and name H   ))
      2.300     0.700     0.700 peak  3442 spectrum    1 weight  0.10000E+01 volume  0.41212E-02 ppm1      2.338 ppm2      7.990 CV     1
 OR { 3442}
   (( segid "    " and resid 33   and name HB  ))
   (( segid "    " and resid 34   and name H   ))
 ASSI { 3443}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 36   and name H   ))
      3.100     1.200     1.200 peak  3443 spectrum    1 weight  0.10000E+01 volume  0.10296E-02 ppm1      3.581 ppm2      8.096 CV     1
 OR { 3443}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 105  and name H   ))
 ASSI { 3444}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name H   ))
      2.700     0.900     0.900 peak  3444 spectrum    1 weight  0.10000E+01 volume  0.16060E-02 ppm1      3.579 ppm2      7.984 CV     1
 OR { 3444}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 34   and name H   ))
 ASSI { 3452}
   (  segid "    " and resid 32   and name HG1%)
   (  segid "    " and resid 32   and name HG2%)
      1.900     0.500     0.500 peak  3452 spectrum    1 weight  0.10000E+01 volume  0.24056E-01 ppm1      1.295 ppm2      1.025 CV     1
 OR { 3452}
   (  segid "    " and resid 32   and name HG1%)
   (  segid "    " and resid 36   and name HD1%)
 ASSI { 3453}
   (  segid "    " and resid 32   and name HG1%)
   (  segid "    " and resid 36   and name HD1%)
      2.200     0.600     0.600 peak  3453 spectrum    1 weight  0.10000E+01 volume  0.18593E-01 ppm1      1.295 ppm2      0.954 CV     1
 OR { 3453}
   (  segid "    " and resid 32   and name HG1%)
   (  segid "    " and resid 33   and name HG1%)
 OR { 3453}
   (  segid "    " and resid 32   and name HG1%)
   (  segid "    " and resid 33   and name HG2%)
 ASSI { 3454}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 54   and name HG  ))
      4.100     2.100     1.900 peak  3454 spectrum    1 weight  0.10000E+01 volume  0.15692E-02 ppm1      1.293 ppm2      1.689 CV     1
 OR { 3454}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 37   and name HG  ))
 OR { 3454}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 20   and name HG  ))
 ASSI { 3455}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 37   and name HG  ))
      4.000     2.000     2.000 peak  3455 spectrum    1 weight  0.10000E+01 volume  0.19326E-02 ppm1      1.294 ppm2      1.635 CV     1
 OR { 3455}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 51   and name HB  ))
 ASSI { 3459}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 32   and name HA  ))
      3.100     1.200     1.200 peak  3459 spectrum    1 weight  0.10000E+01 volume  0.46051E-02 ppm1      1.295 ppm2      3.966 CV     1
 OR { 3459}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 21   and name HA  ))
 ASSI { 3470}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 21   and name HA  ))
      2.100     0.600     0.600 peak  3470 spectrum    1 weight  0.10000E+01 volume  0.91804E-02 ppm1      1.035 ppm2      3.971 CV     1
 OR { 3470}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 32   and name HA  ))
 ASSI { 3473}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 24   and name H   ))
      3.000     1.100     1.100 peak  3473 spectrum    1 weight  0.10000E+01 volume  0.23508E-02 ppm1      1.036 ppm2      7.284 CV     1
 OR { 3473}
   (  segid "    " and resid 32   and name HG2%)
   (  segid "    " and resid 66   and name HD% )
 ASSI { 3476}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 25   and name H   ))
      2.900     1.000     1.000 peak  3476 spectrum    1 weight  0.10000E+01 volume  0.35185E-02 ppm1      1.035 ppm2      8.036 CV     1
 OR { 3476}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 34   and name H   ))
 ASSI { 3479}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 22   and name H   ))
      3.600     1.600     1.600 peak  3479 spectrum    1 weight  0.10000E+01 volume  0.16799E-02 ppm1      1.033 ppm2      8.552 CV     1
 OR { 3479}
   (  segid "    " and resid 32   and name HG2%)
   (( segid "    " and resid 37   and name H   ))
 ASSI { 3481}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 66   and name H   ))
      5.500     3.700     0.500 peak  3481 spectrum    1 weight  0.10000E+01 volume  0.48196E-03 ppm1      1.294 ppm2      7.494 CV     1
 OR { 3481}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 24   and name HD22))
 ASSI { 3486}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 37   and name H   ))
      4.900     3.000     1.100 peak  3486 spectrum    1 weight  0.10000E+01 volume  0.62459E-03 ppm1      1.296 ppm2      8.553 CV     1
 OR { 3486}
   (  segid "    " and resid 32   and name HG1%)
   (( segid "    " and resid 22   and name H   ))
 ASSI { 3490}
   (( segid "    " and resid 32   and name HB  ))
   (  segid "    " and resid 66   and name HD% )
      4.700     2.700     1.300 peak  3490 spectrum    1 weight  0.10000E+01 volume  0.29501E-03 ppm1      2.370 ppm2      7.296 CV     1
 OR { 3490}
   (( segid "    " and resid 32   and name HB  ))
   (( segid "    " and resid 24   and name H   ))
 ASSI { 3491}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 66   and name HZ  ))
      4.600     2.700     1.400 peak  3491 spectrum    1 weight  0.10000E+01 volume  0.56164E-03 ppm1      3.968 ppm2      6.907 CV     1
 OR { 3491}
   (( segid "    " and resid 32   and name HA  ))
   (  segid "    " and resid 21   and name HD% )
 ASSI { 3500}
   (( segid "    " and resid 61   and name HB2 ))
   (( segid "    " and resid 61   and name HA  ))
      3.000     1.200     1.200 peak  3500 spectrum    1 weight  0.10000E+01 volume  0.27425E-02 ppm1      2.701 ppm2      4.541 CV     1
 OR { 3500}
   (( segid "    " and resid 61   and name HB3 ))
   (( segid "    " and resid 61   and name HA  ))
 OR { 3500}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 30   and name HA  ))
 ASSI { 3512}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HA  ))
      2.900     1.100     1.100 peak  3512 spectrum    1 weight  0.10000E+01 volume  0.11594E-02 ppm1      2.048 ppm2      4.559 CV     1
 OR { 3512}
   (( segid "    " and resid 11   and name HB3 ))
   (( segid "    " and resid 11   and name HA  ))
 ASSI { 3515}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HE21))
      4.100     2.100     1.900 peak  3515 spectrum    1 weight  0.10000E+01 volume  0.92305E-03 ppm1      2.058 ppm2      7.032 CV     1
 OR { 3515}
   (( segid "    " and resid 27   and name HB  ))
   (( segid "    " and resid 30   and name HE21))
 ASSI { 3516}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HE22))
      3.900     1.900     1.900 peak  3516 spectrum    1 weight  0.10000E+01 volume  0.13920E-02 ppm1      2.058 ppm2      7.753 CV     1
 OR { 3516}
   (( segid "    " and resid 27   and name HB  ))
   (( segid "    " and resid 30   and name HE22))
 ASSI { 3517}
   (( segid "    " and resid 30   and name HB3 ))
   (( segid "    " and resid 27   and name H   ))
      3.700     1.800     1.800 peak  3517 spectrum    1 weight  0.10000E+01 volume  0.34109E-03 ppm1      1.847 ppm2      7.300 CV     1
 OR { 3517}
   (( segid "    " and resid 30   and name HB3 ))
   (( segid "    " and resid 24   and name H   ))
 ASSI { 3519}
   (( segid "    " and resid 122  and name HA3 ))
   (  segid "    " and resid 123  and name HD1%)
      4.700     2.700     1.300 peak  3519 spectrum    1 weight  0.10000E+01 volume  0.72656E-03 ppm1      3.752 ppm2      0.832 CV     1
 OR { 3519}
   (( segid "    " and resid 122  and name HA3 ))
   (  segid "    " and resid 124  and name HG2%)
 OR { 3519}
   (( segid "    " and resid 122  and name HA3 ))
   (  segid "    " and resid 119  and name HD2%)
 ASSI { 3521}
   (( segid "    " and resid 29   and name HA3 ))
   (( segid "    " and resid 30   and name HB2 ))
      3.700     1.700     1.700 peak  3521 spectrum    1 weight  0.10000E+01 volume  0.89652E-03 ppm1      3.749 ppm2      2.004 CV     1
 OR { 3521}
   (( segid "    " and resid 29   and name HA3 ))
   (( segid "    " and resid 28   and name HB2 ))
 OR { 3521}
   (( segid "    " and resid 29   and name HA3 ))
   (( segid "    " and resid 28   and name HB3 ))
 ASSI { 3528}
   (( segid "    " and resid 28   and name HB3 ))
   (  segid "    " and resid 27   and name HG2%)
      3.400     1.400     1.400 peak  3528 spectrum    1 weight  0.10000E+01 volume  0.45248E-02 ppm1      1.991 ppm2      0.904 CV     1
 OR { 3528}
   (( segid "    " and resid 86   and name HB2 ))
   (  segid "    " and resid 82   and name HD2%)
 OR { 3528}
   (( segid "    " and resid 86   and name HB3 ))
   (  segid "    " and resid 82   and name HD2%)
 OR { 3528}
   (( segid "    " and resid 28   and name HB2 ))
   (  segid "    " and resid 27   and name HG2%)
 ASSI { 3529}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 136  and name HG3 ))
      3.500     1.500     1.500 peak  3529 spectrum    1 weight  0.10000E+01 volume  0.19545E-02 ppm1      1.999 ppm2      1.455 CV     1
 OR { 3529}
   (( segid "    " and resid 86   and name HB3 ))
   (( segid "    " and resid 90   and name HB3 ))
 OR { 3529}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 136  and name HG2 ))
 OR { 3529}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 90   and name HB3 ))
 ASSI { 3532}
   (( segid "    " and resid 126  and name HG2 ))
   (( segid "    " and resid 125  and name H   ))
      4.400     2.500     1.600 peak  3532 spectrum    1 weight  0.10000E+01 volume  0.66354E-03 ppm1      2.254 ppm2      8.848 CV     1
 OR { 3532}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 29   and name H   ))
 OR { 3532}
   (( segid "    " and resid 34   and name HG3 ))
   (( segid "    " and resid 31   and name H   ))
 ASSI { 3536}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 97   and name HG2%)
      2.100     0.600     0.600 peak  3536 spectrum    1 weight  0.10000E+01 volume  0.84596E-02 ppm1      3.892 ppm2      0.976 CV     1
 OR { 3536}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 101  and name HD1%)
 OR { 3536}
   (( segid "    " and resid 27   and name HA  ))
   (  segid "    " and resid 27   and name HG1%)
 ASSI { 3541}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 75   and name HA  ))
      4.200     2.200     1.800 peak  3541 spectrum    1 weight  0.10000E+01 volume  0.72875E-03 ppm1      0.872 ppm2      4.454 CV     1
 OR { 3541}
   (  segid "    " and resid 74   and name HG1%)
   (( segid "    " and resid 107  and name HA  ))
 ASSI { 3547}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 27   and name HA  ))
      4.500     2.600     1.500 peak  3547 spectrum    1 weight  0.10000E+01 volume  0.38422E-03 ppm1      2.912 ppm2      3.862 CV     1
 OR { 3547}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI { 3551}
   (( segid "    " and resid 65   and name HB2 ))
   (  segid "    " and resid 66   and name HD% )
      4.200     2.200     1.800 peak  3551 spectrum    1 weight  0.10000E+01 volume  0.77794E-03 ppm1      2.483 ppm2      7.301 CV     1
 OR { 3551}
   (( segid "    " and resid 26   and name HB3 ))
   (( segid "    " and resid 27   and name H   ))
 ASSI { 3562}
   (( segid "    " and resid 25   and name HB3 ))
   (  segid "    " and resid 22   and name HD2%)
      3.800     1.800     1.800 peak  3562 spectrum    1 weight  0.10000E+01 volume  0.12136E-02 ppm1      1.140 ppm2      0.952 CV     1
 OR { 3562}
   (( segid "    " and resid 25   and name HB3 ))
   (  segid "    " and resid 36   and name HD1%)
 ASSI { 3571}
   (( segid "    " and resid 25   and name HD2 ))
   (( segid "    " and resid 25   and name HB2 ))
      2.400     0.700     0.700 peak  3571 spectrum    1 weight  0.10000E+01 volume  0.58938E-02 ppm1      1.347 ppm2      1.472 CV     1
 OR { 3571}
   (( segid "    " and resid 25   and name HD3 ))
   (( segid "    " and resid 25   and name HB2 ))
 OR { 3571}
   (( segid "    " and resid 25   and name HD3 ))
   (( segid "    " and resid 22   and name HB3 ))
 ASSI { 3577}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 21   and name HE% )
      4.600     2.600     1.400 peak  3577 spectrum    1 weight  0.10000E+01 volume  0.58401E-03 ppm1      3.855 ppm2      6.860 CV     1
 OR { 3577}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 21   and name HD% )
 OR { 3577}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HE22))
 ASSI { 3578}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 27   and name H   ))
      3.500     1.500     1.500 peak  3578 spectrum    1 weight  0.10000E+01 volume  0.10319E-02 ppm1      3.849 ppm2      7.288 CV     1
 OR { 3578}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 24   and name H   ))
 ASSI { 3580}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 27   and name H   ))
      4.900     3.100     1.100 peak  3580 spectrum    1 weight  0.10000E+01 volume  0.42033E-03 ppm1      1.486 ppm2      7.285 CV     1
 OR { 3580}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 24   and name H   ))
 ASSI { 3583}
   (( segid "    " and resid 25   and name HB3 ))
   (( segid "    " and resid 24   and name H   ))
      4.400     2.400     1.600 peak  3583 spectrum    1 weight  0.10000E+01 volume  0.33681E-03 ppm1      1.140 ppm2      7.286 CV     1
 OR { 3583}
   (( segid "    " and resid 25   and name HB3 ))
   (( segid "    " and resid 27   and name H   ))
 ASSI { 3585}
   (( segid "    " and resid 25   and name HB3 ))
   (( segid "    " and resid 22   and name H   ))
      4.400     2.400     1.600 peak  3585 spectrum    1 weight  0.10000E+01 volume  0.39549E-03 ppm1      1.143 ppm2      8.531 CV     1
 OR { 3585}
   (( segid "    " and resid 25   and name HB3 ))
   (( segid "    " and resid 26   and name H   ))
 ASSI { 3586}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 26   and name H   ))
      4.300     2.300     1.700 peak  3586 spectrum    1 weight  0.10000E+01 volume  0.65134E-03 ppm1      1.488 ppm2      8.541 CV     1
 OR { 3586}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 22   and name H   ))
 ASSI { 3590}
   (( segid "    " and resid 25   and name HG3 ))
   (( segid "    " and resid 27   and name H   ))
      4.800     2.900     1.200 peak  3590 spectrum    1 weight  0.10000E+01 volume  0.55468E-03 ppm1      1.147 ppm2      7.287 CV     1
 OR { 3590}
   (( segid "    " and resid 25   and name HG3 ))
   (( segid "    " and resid 24   and name H   ))
 ASSI { 3593}
   (( segid "    " and resid 24   and name HA  ))
   (  segid "    " and resid 23   and name HB% )
      3.700     1.700     1.700 peak  3593 spectrum    1 weight  0.10000E+01 volume  0.18576E-02 ppm1      4.934 ppm2      1.428 CV     1
 OR { 3593}
   (( segid "    " and resid 24   and name HA  ))
   (  segid "    " and resid 35   and name HB% )
 ASSI { 3595}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 93   and name HB3 ))
      2.800     0.900     0.900 peak  3595 spectrum    1 weight  0.10000E+01 volume  0.43135E-02 ppm1      4.934 ppm2      2.487 CV     1
 OR { 3595}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 24   and name HB2 ))
 ASSI { 3597}
   (( segid "    " and resid 24   and name HB3 ))
   (  segid "    " and resid 35   and name HB% )
      4.000     2.000     2.000 peak  3597 spectrum    1 weight  0.10000E+01 volume  0.94593E-03 ppm1      2.577 ppm2      1.424 CV     1
 OR { 3597}
   (( segid "    " and resid 24   and name HB3 ))
   (  segid "    " and resid 23   and name HB% )
 ASSI { 3598}
   (( segid "    " and resid 24   and name HB2 ))
   (  segid "    " and resid 35   and name HB% )
      3.400     1.500     1.500 peak  3598 spectrum    1 weight  0.10000E+01 volume  0.99284E-03 ppm1      2.500 ppm2      1.426 CV     1
 OR { 3598}
   (( segid "    " and resid 24   and name HB2 ))
   (  segid "    " and resid 23   and name HB% )
 ASSI { 3599}
   (( segid "    " and resid 24   and name HB3 ))
   (( segid "    " and resid 32   and name HA  ))
      4.300     2.300     1.700 peak  3599 spectrum    1 weight  0.10000E+01 volume  0.32700E-03 ppm1      2.584 ppm2      3.969 CV     1
 OR { 3599}
   (( segid "    " and resid 24   and name HB3 ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI { 3600}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 32   and name HA  ))
      4.000     2.000     2.000 peak  3600 spectrum    1 weight  0.10000E+01 volume  0.31319E-03 ppm1      2.483 ppm2      3.965 CV     1
 OR { 3600}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI { 3605}
   (( segid "    " and resid 24   and name HB3 ))
   (( segid "    " and resid 24   and name H   ))
      4.400     2.500     1.600 peak  3605 spectrum    1 weight  0.10000E+01 volume  0.61775E-03 ppm1      2.567 ppm2      7.282 CV     1
 OR { 3605}
   (( segid "    " and resid 24   and name HB3 ))
   (( segid "    " and resid 27   and name H   ))
 ASSI { 3616}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 22   and name H   ))
      4.600     2.600     1.400 peak  3616 spectrum    1 weight  0.10000E+01 volume  0.45883E-03 ppm1      4.234 ppm2      8.541 CV     1
 OR { 3616}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 26   and name H   ))
 ASSI { 3618}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB3 ))
      2.400     0.700     0.700 peak  3618 spectrum    1 weight  0.10000E+01 volume  0.42364E-02 ppm1      3.719 ppm2      1.453 CV     1
 OR { 3618}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 25   and name HB2 ))
 OR { 3618}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 59   and name HG  ))
 ASSI { 3620}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 25   and name HG2 ))
      2.600     0.900     0.900 peak  3620 spectrum    1 weight  0.10000E+01 volume  0.16202E-02 ppm1      3.714 ppm2      1.232 CV     1
 OR { 3620}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 3621}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HG  ))
      3.200     1.300     1.300 peak  3621 spectrum    1 weight  0.10000E+01 volume  0.24236E-02 ppm1      3.716 ppm2      2.052 CV     1
 OR { 3621}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 18   and name HB3 ))
 ASSI { 3622}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HB3 ))
      2.600     0.900     0.900 peak  3622 spectrum    1 weight  0.10000E+01 volume  0.25667E-02 ppm1      3.714 ppm2      1.935 CV     1
 OR { 3622}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB2 ))
 ASSI { 3624}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 53   and name HA  ))
      3.700     1.700     1.700 peak  3624 spectrum    1 weight  0.10000E+01 volume  0.11334E-02 ppm1      3.686 ppm2      3.993 CV     1
 OR { 3624}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 55   and name HA  ))
 OR { 3624}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 117  and name HA  ))
 OR { 3624}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 21   and name HA  ))
 OR { 3624}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 57   and name HA  ))
 OR { 3624}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 123  and name HA  ))
 OR { 3624}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 122  and name HA2 ))
 ASSI { 3627}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 25   and name HE2 ))
      3.900     1.900     1.900 peak  3627 spectrum    1 weight  0.10000E+01 volume  0.39459E-03 ppm1      1.454 ppm2      3.009 CV     1
 OR { 3627}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 25   and name HE3 ))
 OR { 3627}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 21   and name HB3 ))
 ASSI { 3632}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 88   and name HA  ))
      2.500     0.800     0.800 peak  3632 spectrum    1 weight  0.10000E+01 volume  0.37823E-02 ppm1      0.952 ppm2      3.984 CV     1
 OR { 3632}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 98   and name HA  ))
 OR { 3632}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 21   and name HA  ))
 ASSI { 3633}
   (  segid "    " and resid 97   and name HG2%)
   (( segid "    " and resid 88   and name H   ))
      4.600     2.700     1.400 peak  3633 spectrum    1 weight  0.10000E+01 volume  0.84325E-03 ppm1      0.947 ppm2      8.946 CV     1
 OR { 3633}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 21   and name H   ))
 ASSI { 3641}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 25   and name H   ))
      3.900     1.900     1.900 peak  3641 spectrum    1 weight  0.10000E+01 volume  0.51071E-03 ppm1      3.713 ppm2      8.037 CV     1
 OR { 3641}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 56   and name H   ))
 ASSI { 3642}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name H   ))
      2.800     0.900     0.900 peak  3642 spectrum    1 weight  0.10000E+01 volume  0.14455E-02 ppm1      3.721 ppm2      8.553 CV     1
 OR { 3642}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 26   and name H   ))
 ASSI { 3644}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 24   and name H   ))
      4.500     2.600     1.500 peak  3644 spectrum    1 weight  0.10000E+01 volume  0.26113E-03 ppm1      3.714 ppm2      7.289 CV     1
 OR { 3644}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 27   and name H   ))
 ASSI { 3649}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 21   and name HA  ))
      3.300     1.300     1.300 peak  3649 spectrum    1 weight  0.10000E+01 volume  0.15452E-02 ppm1      6.906 ppm2      4.008 CV     1
 OR { 3649}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 32   and name HA  ))
 ASSI { 3652}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 22   and name HG  ))
      4.300     2.300     1.700 peak  3652 spectrum    1 weight  0.10000E+01 volume  0.11181E-02 ppm1      6.906 ppm2      2.072 CV     1
 OR { 3652}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 36   and name HG13))
 OR { 3652}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 36   and name HB  ))
 OR { 3652}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 18   and name HB3 ))
 ASSI { 3653}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 25   and name HB2 ))
      4.000     2.000     2.000 peak  3653 spectrum    1 weight  0.10000E+01 volume  0.10176E-02 ppm1      6.904 ppm2      1.460 CV     1
 OR { 3653}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 22   and name HB3 ))
 OR { 3653}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 59   and name HG  ))
 ASSI { 3654}
   (  segid "    " and resid 21   and name HD% )
   (  segid "    " and resid 32   and name HG1%)
      2.900     1.100     1.100 peak  3654 spectrum    1 weight  0.10000E+01 volume  0.24939E-02 ppm1      6.905 ppm2      1.296 CV     1
 OR { 3654}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 25   and name HD3 ))
 OR { 3654}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 25   and name HD2 ))
 ASSI { 3655}
   (  segid "    " and resid 21   and name HD% )
   (  segid "    " and resid 36   and name HD1%)
      2.100     0.600     0.600 peak  3655 spectrum    1 weight  0.10000E+01 volume  0.56979E-02 ppm1      6.904 ppm2      1.003 CV     1
 OR { 3655}
   (  segid "    " and resid 21   and name HD% )
   (  segid "    " and resid 32   and name HG2%)
 ASSI { 3656}
   (  segid "    " and resid 21   and name HD% )
   (  segid "    " and resid 22   and name HD2%)
      2.200     0.600     0.600 peak  3656 spectrum    1 weight  0.10000E+01 volume  0.56670E-02 ppm1      6.905 ppm2      0.953 CV     1
 OR { 3656}
   (  segid "    " and resid 21   and name HD% )
   (  segid "    " and resid 36   and name HD1%)
 OR { 3656}
   (  segid "    " and resid 21   and name HD% )
   (  segid "    " and resid 22   and name HD1%)
 ASSI { 3661}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 23   and name HB% )
      4.200     2.200     1.800 peak  3661 spectrum    1 weight  0.10000E+01 volume  0.72763E-03 ppm1      4.008 ppm2      1.442 CV     1
 OR { 3661}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 35   and name HB% )
 OR { 3661}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 25   and name HB2 ))
 OR { 3661}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 22   and name HB3 ))
 ASSI { 3663}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 32   and name HG2%)
      2.200     0.600     0.600 peak  3663 spectrum    1 weight  0.10000E+01 volume  0.56560E-02 ppm1      4.012 ppm2      1.017 CV     1
 OR { 3663}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 36   and name HD1%)
 ASSI { 3664}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 20   and name HB3 ))
      3.800     1.800     1.800 peak  3664 spectrum    1 weight  0.10000E+01 volume  0.10020E-02 ppm1      4.017 ppm2      2.046 CV     1
 OR { 3664}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 22   and name HG  ))
 ASSI { 3666}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 22   and name HA  ))
      4.200     2.200     1.800 peak  3666 spectrum    1 weight  0.10000E+01 volume  0.51315E-03 ppm1      4.013 ppm2      3.717 CV     1
 OR { 3666}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 54   and name HA  ))
 ASSI { 3667}
   (( segid "    " and resid 21   and name HB3 ))
   (  segid "    " and resid 36   and name HD1%)
      2.800     1.000     1.000 peak  3667 spectrum    1 weight  0.10000E+01 volume  0.19727E-02 ppm1      3.038 ppm2      0.992 CV     1
 OR { 3667}
   (( segid "    " and resid 21   and name HB2 ))
   (  segid "    " and resid 22   and name HD2%)
 OR { 3667}
   (( segid "    " and resid 21   and name HB2 ))
   (  segid "    " and resid 36   and name HD1%)
 OR { 3667}
   (( segid "    " and resid 21   and name HB2 ))
   (  segid "    " and resid 32   and name HG2%)
 OR { 3667}
   (( segid "    " and resid 21   and name HB3 ))
   (  segid "    " and resid 22   and name HD2%)
 OR { 3667}
   (( segid "    " and resid 21   and name HB3 ))
   (  segid "    " and resid 22   and name HD1%)
 ASSI { 3668}
   (( segid "    " and resid 21   and name HB3 ))
   (( segid "    " and resid 17   and name HG  ))
      4.000     2.000     2.000 peak  3668 spectrum    1 weight  0.10000E+01 volume  0.14416E-02 ppm1      3.034 ppm2      1.473 CV     1
 OR { 3668}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 59   and name HG  ))
 OR { 3668}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 22   and name HB3 ))
 OR { 3668}
   (( segid "    " and resid 21   and name HB3 ))
   (( segid "    " and resid 59   and name HG  ))
 OR { 3668}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 17   and name HG  ))
 OR { 3668}
   (( segid "    " and resid 21   and name HB3 ))
   (( segid "    " and resid 25   and name HB2 ))
 OR { 3668}
   (( segid "    " and resid 21   and name HB3 ))
   (( segid "    " and resid 22   and name HB3 ))
 ASSI { 3676}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 21   and name HA  ))
      4.300     2.300     1.700 peak  3676 spectrum    1 weight  0.10000E+01 volume  0.97006E-03 ppm1      6.843 ppm2      4.001 CV     1
 OR { 3676}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 32   and name HA  ))
 ASSI { 3679}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 21   and name HB3 ))
      3.800     1.800     1.800 peak  3679 spectrum    1 weight  0.10000E+01 volume  0.17605E-02 ppm1      6.843 ppm2      3.014 CV     1
 OR { 3679}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 21   and name HB2 ))
 OR { 3679}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 25   and name HE2 ))
 ASSI { 3680}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 32   and name HB  ))
      4.800     2.900     1.200 peak  3680 spectrum    1 weight  0.10000E+01 volume  0.42059E-03 ppm1      6.840 ppm2      2.362 CV     1
 OR { 3680}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 33   and name HB  ))
 ASSI { 3681}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 22   and name HG  ))
      5.100     3.200     0.900 peak  3681 spectrum    1 weight  0.10000E+01 volume  0.66937E-03 ppm1      6.845 ppm2      2.066 CV     1
 OR { 3681}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 36   and name HG13))
 OR { 3681}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 36   and name HB  ))
 OR { 3681}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 18   and name HB3 ))
 ASSI { 3682}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 54   and name HG  ))
      5.100     3.300     0.900 peak  3682 spectrum    1 weight  0.10000E+01 volume  0.45945E-03 ppm1      6.847 ppm2      1.696 CV     1
 OR { 3682}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 57   and name HB3 ))
 OR { 3682}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 18   and name HG3 ))
 ASSI { 3683}
   (  segid "    " and resid 21   and name HE% )
   (  segid "    " and resid 32   and name HG1%)
      2.400     0.700     0.700 peak  3683 spectrum    1 weight  0.10000E+01 volume  0.64661E-02 ppm1      6.845 ppm2      1.301 CV     1
 OR { 3683}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 25   and name HD3 ))
 ASSI { 3684}
   (  segid "    " and resid 21   and name HE% )
   (  segid "    " and resid 59   and name HD2%)
      2.900     1.100     1.100 peak  3684 spectrum    1 weight  0.10000E+01 volume  0.61690E-02 ppm1      6.844 ppm2      0.948 CV     1
 OR { 3684}
   (  segid "    " and resid 21   and name HE% )
   (  segid "    " and resid 22   and name HD2%)
 OR { 3684}
   (  segid "    " and resid 21   and name HE% )
   (  segid "    " and resid 36   and name HD1%)
 ASSI { 3685}
   (  segid "    " and resid 21   and name HE% )
   (  segid "    " and resid 59   and name HD1%)
      3.400     1.500     1.500 peak  3685 spectrum    1 weight  0.10000E+01 volume  0.18157E-02 ppm1      6.845 ppm2      0.832 CV     1
 OR { 3685}
   (  segid "    " and resid 21   and name HE% )
   (  segid "    " and resid 55   and name HG1%)
 ASSI { 3687}
   (  segid "    " and resid 21   and name HE% )
   (  segid "    " and resid 66   and name HD% )
      4.300     2.300     1.700 peak  3687 spectrum    1 weight  0.10000E+01 volume  0.62714E-03 ppm1      6.842 ppm2      7.282 CV     1
 OR { 3687}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 24   and name H   ))
 ASSI { 3690}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 22   and name H   ))
      5.300     3.600     0.700 peak  3690 spectrum    1 weight  0.10000E+01 volume  0.35216E-03 ppm1      6.845 ppm2      8.554 CV     1
 OR { 3690}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 26   and name H   ))
 ASSI { 3691}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 33   and name H   ))
      6.000     4.600     0.000 peak  3691 spectrum    1 weight  0.10000E+01 volume  0.25160E-03 ppm1      6.846 ppm2      8.027 CV     1
 OR { 3691}
   (  segid "    " and resid 21   and name HE% )
   (( segid "    " and resid 25   and name H   ))
 ASSI { 3692}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 24   and name H   ))
      5.000     3.200     1.000 peak  3692 spectrum    1 weight  0.10000E+01 volume  0.23101E-03 ppm1      6.895 ppm2      7.296 CV     1
 OR { 3692}
   (  segid "    " and resid 21   and name HD% )
   (  segid "    " and resid 66   and name HD% )
 ASSI { 3693}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 23   and name H   ))
      5.200     3.400     0.800 peak  3693 spectrum    1 weight  0.10000E+01 volume  0.22305E-03 ppm1      6.907 ppm2      7.836 CV     1
 OR { 3693}
   (  segid "    " and resid 21   and name HD% )
   (( segid "    " and resid 35   and name H   ))
 ASSI { 3695}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 24   and name HD21))
      4.400     2.400     1.600 peak  3695 spectrum    1 weight  0.10000E+01 volume  0.37731E-03 ppm1      4.018 ppm2      8.085 CV     1
 OR { 3695}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 25   and name H   ))
 OR { 3695}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 36   and name H   ))
 ASSI { 3696}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 25   and name H   ))
      4.800     2.800     1.200 peak  3696 spectrum    1 weight  0.10000E+01 volume  0.34501E-03 ppm1      4.004 ppm2      8.031 CV     1
 OR { 3696}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 33   and name H   ))
 OR { 3696}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 19   and name H   ))
 ASSI { 3701}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 48   and name H   ))
      4.200     2.200     1.800 peak  3701 spectrum    1 weight  0.10000E+01 volume  0.10669E-02 ppm1      3.275 ppm2      8.309 CV     1
 OR { 3701}
   (( segid "    " and resid 18   and name HD2 ))
   (( segid "    " and resid 18   and name H   ))
 OR { 3701}
   (( segid "    " and resid 47   and name HD3 ))
   (( segid "    " and resid 48   and name H   ))
 ASSI { 3703}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 19   and name H   ))
      3.500     1.500     1.500 peak  3703 spectrum    1 weight  0.10000E+01 volume  0.75412E-03 ppm1      1.639 ppm2      7.982 CV     1
 OR { 3703}
   (( segid "    " and resid 18   and name HG2 ))
   (( segid "    " and resid 16   and name H   ))
 ASSI { 3704}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HD2 ))
      3.300     1.400     1.400 peak  3704 spectrum    1 weight  0.10000E+01 volume  0.11928E-02 ppm1      3.788 ppm2      3.301 CV     1
 OR { 3704}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 127  and name HD3 ))
 OR { 3704}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HD3 ))
 OR { 3704}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HD2 ))
 ASSI { 3705}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HD2 ))
      3.300     1.400     1.400 peak  3705 spectrum    1 weight  0.10000E+01 volume  0.11163E-02 ppm1      3.751 ppm2      3.296 CV     1
 OR { 3705}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 127  and name HD3 ))
 OR { 3705}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HD3 ))
 ASSI { 3708}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HG2 ))
      3.200     1.300     1.300 peak  3708 spectrum    1 weight  0.10000E+01 volume  0.35614E-02 ppm1      3.792 ppm2      1.635 CV     1
 OR { 3708}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 130  and name HG  ))
 OR { 3708}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 37   and name HG  ))
 OR { 3708}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 130  and name HB3 ))
 ASSI { 3709}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HB3 ))
      2.600     0.800     0.800 peak  3709 spectrum    1 weight  0.10000E+01 volume  0.24912E-02 ppm1      3.792 ppm2      2.084 CV     1
 OR { 3709}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 22   and name HG  ))
 ASSI { 3712}
   (( segid "    " and resid 98   and name HG  ))
   (  segid "    " and resid 98   and name HD1%)
      1.900     0.400     0.400 peak  3712 spectrum    1 weight  0.10000E+01 volume  0.16950E-01 ppm1      1.669 ppm2      0.929 CV     1
 OR { 3712}
   (( segid "    " and resid 86   and name HG3 ))
   (  segid "    " and resid 82   and name HD1%)
 OR { 3712}
   (( segid "    " and resid 86   and name HG3 ))
   (  segid "    " and resid 82   and name HD2%)
 ASSI { 3713}
   (( segid "    " and resid 113  and name HD2 ))
   (  segid "    " and resid 74   and name HG2%)
      2.600     0.800     0.800 peak  3713 spectrum    1 weight  0.10000E+01 volume  0.75811E-02 ppm1      3.334 ppm2      0.943 CV     1
 OR { 3713}
   (( segid "    " and resid 113  and name HD3 ))
   (  segid "    " and resid 74   and name HG2%)
 OR { 3713}
   (( segid "    " and resid 18   and name HD3 ))
   (  segid "    " and resid 22   and name HD1%)
 OR { 3713}
   (( segid "    " and resid 18   and name HD3 ))
   (  segid "    " and resid 22   and name HD2%)
 OR { 3713}
   (( segid "    " and resid 18   and name HD3 ))
   (  segid "    " and resid 59   and name HD2%)
 ASSI { 3714}
   (( segid "    " and resid 113  and name HD2 ))
   (  segid "    " and resid 74   and name HG1%)
      3.000     1.100     1.100 peak  3714 spectrum    1 weight  0.10000E+01 volume  0.37729E-02 ppm1      3.333 ppm2      0.833 CV     1
 OR { 3714}
   (( segid "    " and resid 113  and name HD3 ))
   (  segid "    " and resid 74   and name HG1%)
 OR { 3714}
   (( segid "    " and resid 18   and name HD3 ))
   (  segid "    " and resid 59   and name HD1%)
 ASSI { 3715}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 98   and name HB2 ))
      3.400     1.500     1.500 peak  3715 spectrum    1 weight  0.10000E+01 volume  0.30066E-02 ppm1      3.329 ppm2      1.482 CV     1
 OR { 3715}
   (( segid "    " and resid 18   and name HD3 ))
   (( segid "    " and resid 59   and name HG  ))
 OR { 3715}
   (( segid "    " and resid 111  and name HD2 ))
   (  segid "    " and resid 112  and name HB% )
 ASSI { 3716}
   (( segid "    " and resid 18   and name HD3 ))
   (( segid "    " and resid 18   and name HG2 ))
      2.100     0.500     0.500 peak  3716 spectrum    1 weight  0.10000E+01 volume  0.89866E-02 ppm1      3.333 ppm2      1.639 CV     1
 OR { 3716}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 111  and name HG3 ))
 ASSI { 3717}
   (( segid "    " and resid 18   and name HD2 ))
   (( segid "    " and resid 18   and name HB2 ))
      2.300     0.700     0.700 peak  3717 spectrum    1 weight  0.10000E+01 volume  0.64842E-02 ppm1      3.321 ppm2      1.832 CV     1
 OR { 3717}
   (( segid "    " and resid 18   and name HD3 ))
   (( segid "    " and resid 18   and name HB2 ))
 OR { 3717}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 111  and name HB3 ))
 ASSI { 3718}
   (( segid "    " and resid 18   and name HD3 ))
   (( segid "    " and resid 18   and name HB3 ))
      2.500     0.800     0.800 peak  3718 spectrum    1 weight  0.10000E+01 volume  0.35966E-02 ppm1      3.341 ppm2      2.082 CV     1
 OR { 3718}
   (( segid "    " and resid 18   and name HD3 ))
   (( segid "    " and resid 22   and name HG  ))
 ASSI { 3719}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 99   and name HA2 ))
      3.700     1.700     1.700 peak  3719 spectrum    1 weight  0.10000E+01 volume  0.16591E-02 ppm1      3.331 ppm2      3.777 CV     1
 OR { 3719}
   (( segid "    " and resid 18   and name HD3 ))
   (( segid "    " and resid 18   and name HA  ))
 ASSI { 3720}
   (( segid "    " and resid 47   and name HD3 ))
   (( segid "    " and resid 47   and name HA  ))
      2.900     1.000     1.000 peak  3720 spectrum    1 weight  0.10000E+01 volume  0.21590E-02 ppm1      3.275 ppm2      3.769 CV     1
 OR { 3720}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 47   and name HA  ))
 OR { 3720}
   (( segid "    " and resid 127  and name HD3 ))
   (( segid "    " and resid 127  and name HA  ))
 ASSI { 3721}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 111  and name HA  ))
      4.200     2.200     1.800 peak  3721 spectrum    1 weight  0.10000E+01 volume  0.82960E-03 ppm1      3.338 ppm2      4.012 CV     1
 OR { 3721}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 98   and name HA  ))
 OR { 3721}
   (( segid "    " and resid 18   and name HD3 ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI { 3725}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 23   and name HB% )
      3.400     1.500     1.500 peak  3725 spectrum    1 weight  0.10000E+01 volume  0.28103E-02 ppm1      3.976 ppm2      1.457 CV     1
 OR { 3725}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 22   and name HB3 ))
 OR { 3725}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 35   and name HB% )
 OR { 3725}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 87   and name HB3 ))
 ASSI { 3730}
   (( segid "    " and resid 17   and name HB3 ))
   (( segid "    " and resid 14   and name HA  ))
      3.000     1.200     1.200 peak  3730 spectrum    1 weight  0.10000E+01 volume  0.97529E-03 ppm1      2.223 ppm2      3.970 CV     1
 OR { 3730}
   (( segid "    " and resid 17   and name HB3 ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI { 3734}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 17   and name HB3 ))
      3.000     1.100     1.100 peak  3734 spectrum    1 weight  0.10000E+01 volume  0.46908E-02 ppm1      1.073 ppm2      2.201 CV     1
 OR { 3734}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 53   and name HB2 ))
 OR { 3734}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 50   and name HB  ))
 ASSI { 3735}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 36   and name HB  ))
      3.300     1.400     1.400 peak  3735 spectrum    1 weight  0.10000E+01 volume  0.44213E-02 ppm1      1.072 ppm2      2.137 CV     1
 OR { 3735}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 50   and name HB  ))
 OR { 3735}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 36   and name HG13))
 ASSI { 3736}
   (  segid "    " and resid 17   and name HD1%)
   (  segid "    " and resid 57   and name HE% )
      3.400     1.500     1.500 peak  3736 spectrum    1 weight  0.10000E+01 volume  0.36096E-02 ppm1      1.073 ppm2      1.979 CV     1
 OR { 3736}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 54   and name HB3 ))
 ASSI { 3738}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 54   and name HG  ))
      2.200     0.600     0.600 peak  3738 spectrum    1 weight  0.10000E+01 volume  0.54618E-02 ppm1      1.072 ppm2      1.766 CV     1
 OR { 3738}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 17   and name HB2 ))
 ASSI { 3741}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 17   and name HA  ))
      2.300     0.600     0.600 peak  3741 spectrum    1 weight  0.10000E+01 volume  0.65589E-02 ppm1      1.073 ppm2      3.966 CV     1
 OR { 3741}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 37   and name HA  ))
 ASSI { 3743}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 36   and name HA  ))
      3.800     1.800     1.800 peak  3743 spectrum    1 weight  0.10000E+01 volume  0.17819E-02 ppm1      1.072 ppm2      3.671 CV     1
 OR { 3743}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 54   and name HA  ))
 ASSI { 3744}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 14   and name HA  ))
      3.200     1.200     1.200 peak  3744 spectrum    1 weight  0.10000E+01 volume  0.40448E-02 ppm1      0.734 ppm2      3.976 CV     1
 OR { 3744}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 17   and name HA  ))
 OR { 3744}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 53   and name HA  ))
 ASSI { 3745}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 50   and name HA  ))
      3.200     1.300     1.300 peak  3745 spectrum    1 weight  0.10000E+01 volume  0.19695E-02 ppm1      0.736 ppm2      3.779 CV     1
 OR { 3745}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 18   and name HA  ))
 ASSI { 3750}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 14   and name HB2 ))
      3.100     1.200     1.200 peak  3750 spectrum    1 weight  0.10000E+01 volume  0.14819E-02 ppm1      0.734 ppm2      2.380 CV     1
 OR { 3750}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 13   and name HG3 ))
 OR { 3750}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 13   and name HG2 ))
 OR { 3750}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 33   and name HB  ))
 ASSI { 3751}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 53   and name HB2 ))
      2.200     0.600     0.600 peak  3751 spectrum    1 weight  0.10000E+01 volume  0.63921E-02 ppm1      0.735 ppm2      2.207 CV     1
 OR { 3751}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 17   and name HB3 ))
 ASSI { 3753}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 17   and name HB2 ))
      2.300     0.700     0.700 peak  3753 spectrum    1 weight  0.10000E+01 volume  0.61629E-02 ppm1      0.735 ppm2      1.761 CV     1
 OR { 3753}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 54   and name HG  ))
 ASSI { 3757}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 40   and name H   ))
      4.700     2.800     1.300 peak  3757 spectrum    1 weight  0.10000E+01 volume  0.47305E-03 ppm1      1.070 ppm2      7.864 CV     1
 OR { 3757}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 57   and name H   ))
 OR { 3757}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 35   and name H   ))
 ASSI { 3758}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 18   and name H   ))
      3.700     1.700     1.700 peak  3758 spectrum    1 weight  0.10000E+01 volume  0.16378E-02 ppm1      1.073 ppm2      8.300 CV     1
 OR { 3758}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 54   and name H   ))
 ASSI { 3763}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 54   and name H   ))
      3.200     1.300     1.300 peak  3763 spectrum    1 weight  0.10000E+01 volume  0.23921E-02 ppm1      0.735 ppm2      8.299 CV     1
 OR { 3763}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 18   and name H   ))
 ASSI { 3765}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 19   and name H   ))
      4.800     2.900     1.200 peak  3765 spectrum    1 weight  0.10000E+01 volume  0.69908E-03 ppm1      0.736 ppm2      7.984 CV     1
 OR { 3765}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 16   and name H   ))
 OR { 3765}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 53   and name HE1 ))
 ASSI { 3768}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 45   and name HE  ))
      3.700     1.700     1.700 peak  3768 spectrum    1 weight  0.10000E+01 volume  0.15634E-02 ppm1      0.736 ppm2      7.065 CV     1
 OR { 3768}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 9    and name HE3 ))
 OR { 3768}
   (  segid "    " and resid 17   and name HD2%)
   (  segid "    " and resid 66   and name HE% )
 ASSI { 3778}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 16   and name HE1 ))
      5.400     3.700     0.600 peak  3778 spectrum    1 weight  0.10000E+01 volume  0.19041E-03 ppm1      7.304 ppm2      8.303 CV     1
 OR { 3778}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 18   and name H   ))
 ASSI { 3779}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 19   and name H   ))
      4.800     2.900     1.200 peak  3779 spectrum    1 weight  0.10000E+01 volume  0.65791E-03 ppm1      7.302 ppm2      7.978 CV     1
 OR { 3779}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 16   and name H   ))
 ASSI { 3784}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 15   and name H   ))
      5.100     3.200     0.900 peak  3784 spectrum    1 weight  0.10000E+01 volume  0.38980E-03 ppm1      3.390 ppm2      8.275 CV     1
 OR { 3784}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 16   and name HE1 ))
 OR { 3784}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 15   and name H   ))
 OR { 3784}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 16   and name HE1 ))
 ASSI { 3785}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 15   and name H   ))
      4.700     2.800     1.300 peak  3785 spectrum    1 weight  0.10000E+01 volume  0.61872E-03 ppm1      3.333 ppm2      8.262 CV     1
 OR { 3785}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 15   and name H   ))
 OR { 3785}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 16   and name HE1 ))
 ASSI { 3790}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 13   and name HA  ))
      3.700     1.700     1.700 peak  3790 spectrum    1 weight  0.10000E+01 volume  0.76690E-03 ppm1      3.337 ppm2      4.238 CV     1
 OR { 3790}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 13   and name HA  ))
 OR { 3790}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 42   and name HB  ))
 OR { 3790}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 42   and name HB  ))
 ASSI { 3791}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 17   and name HA  ))
      4.700     2.700     1.300 peak  3791 spectrum    1 weight  0.10000E+01 volume  0.36326E-03 ppm1      3.400 ppm2      3.987 CV     1
 OR { 3791}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 14   and name HA  ))
 OR { 3791}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 17   and name HA  ))
 OR { 3791}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 14   and name HA  ))
 OR { 3791}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI { 3792}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 17   and name HA  ))
      4.200     2.200     1.800 peak  3792 spectrum    1 weight  0.10000E+01 volume  0.47952E-03 ppm1      3.329 ppm2      4.009 CV     1
 OR { 3792}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 14   and name HA  ))
 OR { 3792}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI { 3793}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 42   and name HB  ))
      5.300     3.500     0.700 peak  3793 spectrum    1 weight  0.10000E+01 volume  0.25246E-03 ppm1      7.302 ppm2      4.241 CV     1
 OR { 3793}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 13   and name HA  ))
 OR { 3793}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 15   and name HA  ))
 ASSI { 3794}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 20   and name HA  ))
      4.500     2.600     1.500 peak  3794 spectrum    1 weight  0.10000E+01 volume  0.36451E-03 ppm1      7.301 ppm2      3.963 CV     1
 OR { 3794}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI { 3796}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 13   and name HG3 ))
      4.100     2.100     1.900 peak  3796 spectrum    1 weight  0.10000E+01 volume  0.55638E-03 ppm1      3.355 ppm2      2.403 CV     1
 OR { 3796}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 13   and name HG3 ))
 OR { 3796}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 13   and name HG2 ))
 OR { 3796}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 19   and name HG3 ))
 OR { 3796}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 13   and name HB2 ))
 OR { 3796}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 13   and name HG2 ))
 OR { 3796}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 13   and name HB3 ))
 OR { 3796}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 19   and name HG3 ))
 ASSI { 3797}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 19   and name HB3 ))
      4.800     2.900     1.200 peak  3797 spectrum    1 weight  0.10000E+01 volume  0.56794E-03 ppm1      3.341 ppm2      2.236 CV     1
 OR { 3797}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 19   and name HB3 ))
 OR { 3797}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 17   and name HB3 ))
 ASSI { 3799}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 14   and name HB3 ))
      5.400     3.700     0.600 peak  3799 spectrum    1 weight  0.10000E+01 volume  0.24304E-03 ppm1      3.391 ppm2      2.100 CV     1
 OR { 3799}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 14   and name HG3 ))
 OR { 3799}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 14   and name HB3 ))
 OR { 3799}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 18   and name HB3 ))
 OR { 3799}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 14   and name HG3 ))
 OR { 3799}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 18   and name HB3 ))
 ASSI { 3800}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 40   and name HB2 ))
      5.100     3.200     0.900 peak  3800 spectrum    1 weight  0.10000E+01 volume  0.21242E-03 ppm1      3.403 ppm2      1.952 CV     1
 OR { 3800}
   (( segid "    " and resid 16   and name HB2 ))
   (  segid "    " and resid 57   and name HE% )
 OR { 3800}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 40   and name HB2 ))
 OR { 3800}
   (( segid "    " and resid 16   and name HB3 ))
   (  segid "    " and resid 57   and name HE% )
 ASSI { 3801}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 40   and name HG  ))
      5.400     3.700     0.600 peak  3801 spectrum    1 weight  0.10000E+01 volume  0.17838E-03 ppm1      3.366 ppm2      1.857 CV     1
 OR { 3801}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 40   and name HB2 ))
 OR { 3801}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 40   and name HG  ))
 OR { 3801}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 40   and name HB2 ))
 OR { 3801}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 18   and name HB2 ))
 ASSI { 3808}
   (( segid "    " and resid 16   and name HB2 ))
   (  segid "    " and resid 17   and name HD2%)
      5.500     3.800     0.500 peak  3808 spectrum    1 weight  0.10000E+01 volume  0.25703E-03 ppm1      3.347 ppm2      0.746 CV     1
 OR { 3808}
   (( segid "    " and resid 16   and name HB3 ))
   (  segid "    " and resid 17   and name HD2%)
 OR { 3808}
   (( segid "    " and resid 16   and name HB3 ))
   (  segid "    " and resid 43   and name HG2%)
 OR { 3808}
   (( segid "    " and resid 16   and name HB3 ))
   (  segid "    " and resid 43   and name HG1%)
 ASSI { 3809}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 20   and name HB3 ))
      5.600     3.900     0.400 peak  3809 spectrum    1 weight  0.10000E+01 volume  0.25541E-03 ppm1      7.299 ppm2      2.050 CV     1
 OR { 3809}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 22   and name HG  ))
 OR { 3809}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 18   and name HB3 ))
 ASSI { 3812}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 40   and name HG  ))
      4.800     2.900     1.200 peak  3812 spectrum    1 weight  0.10000E+01 volume  0.25655E-03 ppm1      7.304 ppm2      1.911 CV     1
 OR { 3812}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 40   and name HB2 ))
 OR { 3812}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 22   and name HB2 ))
 ASSI { 3813}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 20   and name HG  ))
      4.300     2.300     1.700 peak  3813 spectrum    1 weight  0.10000E+01 volume  0.13258E-02 ppm1      7.301 ppm2      1.687 CV     1
 OR { 3813}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 18   and name HG3 ))
 ASSI { 3815}
   (( segid "    " and resid 16   and name HD2 ))
   (  segid "    " and resid 23   and name HB% )
      5.600     4.000     0.400 peak  3815 spectrum    1 weight  0.10000E+01 volume  0.16093E-03 ppm1      7.295 ppm2      1.411 CV     1
 OR { 3815}
   (( segid "    " and resid 16   and name HD2 ))
   (( segid "    " and resid 22   and name HB3 ))
 ASSI { 3817}
   (( segid "    " and resid 16   and name HD2 ))
   (  segid "    " and resid 40   and name HD1%)
      3.700     1.700     1.700 peak  3817 spectrum    1 weight  0.10000E+01 volume  0.13662E-02 ppm1      7.301 ppm2      0.970 CV     1
 OR { 3817}
   (( segid "    " and resid 16   and name HD2 ))
   (  segid "    " and resid 40   and name HD2%)
 OR { 3817}
   (( segid "    " and resid 16   and name HD2 ))
   (  segid "    " and resid 36   and name HG2%)
 OR { 3817}
   (( segid "    " and resid 16   and name HD2 ))
   (  segid "    " and resid 22   and name HD1%)
 ASSI { 3820}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 17   and name HA  ))
      3.900     1.900     1.900 peak  3820 spectrum    1 weight  0.10000E+01 volume  0.97257E-03 ppm1      4.734 ppm2      3.937 CV     1
 OR { 3820}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 14   and name HA  ))
 OR { 3820}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 20   and name HA  ))
 ASSI { 3825}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name H   ))
      2.700     0.900     0.900 peak  3825 spectrum    1 weight  0.10000E+01 volume  0.24372E-02 ppm1      4.726 ppm2      7.976 CV     1
 OR { 3825}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 19   and name H   ))
 ASSI { 3826}
   (  segid "    " and resid 15   and name HB% )
   (  segid "    " and resid 22   and name HD1%)
      4.400     2.400     1.600 peak  3826 spectrum    1 weight  0.10000E+01 volume  0.82566E-03 ppm1      1.574 ppm2      0.947 CV     1
 OR { 3826}
   (  segid "    " and resid 15   and name HB% )
   (  segid "    " and resid 22   and name HD2%)
 OR { 3826}
   (  segid "    " and resid 15   and name HB% )
   (  segid "    " and resid 40   and name HD1%)
 OR { 3826}
   (  segid "    " and resid 15   and name HB% )
   (  segid "    " and resid 59   and name HD2%)
 ASSI { 3828}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 14   and name HB2 ))
      3.200     1.300     1.300 peak  3828 spectrum    1 weight  0.10000E+01 volume  0.27637E-02 ppm1      1.573 ppm2      2.433 CV     1
 OR { 3828}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 19   and name HG2 ))
 OR { 3828}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 13   and name HB3 ))
 OR { 3828}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 13   and name HB2 ))
 ASSI { 3830}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 14   and name HB3 ))
      3.400     1.400     1.400 peak  3830 spectrum    1 weight  0.10000E+01 volume  0.34095E-02 ppm1      1.573 ppm2      2.099 CV     1
 OR { 3830}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 18   and name HB3 ))
 OR { 3830}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 14   and name HG3 ))
 ASSI { 3832}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 18   and name HD3 ))
      3.700     1.700     1.700 peak  3832 spectrum    1 weight  0.10000E+01 volume  0.18588E-02 ppm1      1.572 ppm2      3.351 CV     1
 OR { 3832}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 16   and name HB3 ))
 OR { 3832}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 16   and name HB2 ))
 ASSI { 3834}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 14   and name HA  ))
      3.900     1.900     1.900 peak  3834 spectrum    1 weight  0.10000E+01 volume  0.15143E-02 ppm1      1.571 ppm2      4.004 CV     1
 OR { 3834}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 19   and name HA  ))
 ASSI { 3837}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 14   and name H   ))
      4.000     2.000     2.000 peak  3837 spectrum    1 weight  0.10000E+01 volume  0.17600E-02 ppm1      1.571 ppm2      8.731 CV     1
 OR { 3837}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 17   and name H   ))
 ASSI { 3838}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 12   and name H   ))
      3.100     3.100     2.900 peak  3838 spectrum    1 weight  0.10000E+01 volume  0.50667E-03 ppm1      1.572 ppm2      8.964 CV     1
 OR { 3838}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 21   and name H   ))
 ASSI { 3839}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 42   and name HG2%)
      4.700     2.700     1.300 peak  3839 spectrum    1 weight  0.10000E+01 volume  0.50591E-03 ppm1      3.995 ppm2      1.274 CV     1
 OR { 3839}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 114  and name HG12))
 ASSI { 3840}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 17   and name HG  ))
      4.000     2.000     2.000 peak  3840 spectrum    1 weight  0.10000E+01 volume  0.15221E-02 ppm1      3.989 ppm2      1.468 CV     1
 OR { 3840}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 98   and name HB2 ))
 OR { 3840}
   (( segid "    " and resid 111  and name HA  ))
   (  segid "    " and resid 112  and name HB% )
 ASSI { 3841}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HG3 ))
      3.200     1.300     1.300 peak  3841 spectrum    1 weight  0.10000E+01 volume  0.20049E-02 ppm1      3.993 ppm2      1.619 CV     1
 OR { 3841}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 51   and name HB  ))
 ASSI { 3842}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 17   and name HB2 ))
      2.500     0.800     0.800 peak  3842 spectrum    1 weight  0.10000E+01 volume  0.29837E-02 ppm1      3.988 ppm2      1.754 CV     1
 OR { 3842}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HG2 ))
 ASSI { 3844}
   (( segid "    " and resid 111  and name HA  ))
   (  segid "    " and resid 102  and name HE% )
      2.600     0.800     0.800 peak  3844 spectrum    1 weight  0.10000E+01 volume  0.43588E-02 ppm1      3.986 ppm2      2.160 CV     1
 OR { 3844}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HG3 ))
 ASSI { 3845}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HB2 ))
      3.000     1.100     1.100 peak  3845 spectrum    1 weight  0.10000E+01 volume  0.21626E-02 ppm1      3.984 ppm2      2.398 CV     1
 OR { 3845}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 80   and name HB2 ))
 OR { 3845}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 13   and name HB3 ))
 OR { 3845}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 13   and name HG3 ))
 ASSI { 3846}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HG2 ))
      3.000     1.100     1.100 peak  3846 spectrum    1 weight  0.10000E+01 volume  0.14841E-02 ppm1      3.982 ppm2      2.855 CV     1
 OR { 3846}
   (( segid "    " and resid 81   and name HA  ))
   (( segid "    " and resid 81   and name HG2 ))
 ASSI { 3853}
   (( segid "    " and resid 135  and name HB3 ))
   (( segid "    " and resid 136  and name HE2 ))
      3.900     1.900     1.900 peak  3853 spectrum    1 weight  0.10000E+01 volume  0.68413E-03 ppm1      2.086 ppm2      3.017 CV     1
 OR { 3853}
   (( segid "    " and resid 135  and name HB3 ))
   (( segid "    " and resid 136  and name HE3 ))
 OR { 3853}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 64   and name HE3 ))
 OR { 3853}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 64   and name HE2 ))
 ASSI { 3856}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 43   and name H   ))
      5.100     3.300     0.900 peak  3856 spectrum    1 weight  0.10000E+01 volume  0.34391E-03 ppm1      2.844 ppm2      7.992 CV     1
 OR { 3856}
   (( segid "    " and resid 14   and name HG2 ))
   (( segid "    " and resid 16   and name H   ))
 OR { 3856}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 43   and name H   ))
 ASSI { 3857}
   (( segid "    " and resid 14   and name HG2 ))
   (( segid "    " and resid 15   and name H   ))
      4.800     2.900     1.200 peak  3857 spectrum    1 weight  0.10000E+01 volume  0.47833E-03 ppm1      2.846 ppm2      8.276 CV     1
 OR { 3857}
   (( segid "    " and resid 14   and name HG2 ))
   (( segid "    " and resid 18   and name H   ))
 OR { 3857}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 16   and name HE1 ))
 ASSI { 3866}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 14   and name H   ))
      3.600     1.600     1.600 peak  3866 spectrum    1 weight  0.10000E+01 volume  0.90720E-03 ppm1      4.252 ppm2      8.745 CV     1
 OR { 3866}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 17   and name H   ))
 ASSI { 3867}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name H   ))
      3.100     1.200     1.200 peak  3867 spectrum    1 weight  0.10000E+01 volume  0.14871E-02 ppm1      4.251 ppm2      8.017 CV     1
 OR { 3867}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 16   and name H   ))
 ASSI { 3870}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 13   and name H   ))
      3.700     1.700     1.700 peak  3870 spectrum    1 weight  0.10000E+01 volume  0.24348E-02 ppm1      2.431 ppm2      8.025 CV     1
 OR { 3870}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 13   and name H   ))
 OR { 3870}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 43   and name H   ))
 OR { 3870}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 43   and name H   ))
 ASSI { 3874}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 16   and name HB2 ))
      3.800     1.800     1.800 peak  3874 spectrum    1 weight  0.10000E+01 volume  0.55256E-03 ppm1      2.437 ppm2      3.370 CV     1
 OR { 3874}
   (( segid "    " and resid 13   and name HG3 ))
   (( segid "    " and resid 16   and name HB3 ))
 OR { 3874}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 16   and name HB2 ))
 OR { 3874}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 16   and name HB3 ))
 OR { 3874}
   (( segid "    " and resid 129  and name HG3 ))
   (( segid "    " and resid 115  and name HA  ))
 ASSI { 3875}
   (( segid "    " and resid 129  and name HG3 ))
   (( segid "    " and resid 128  and name HD3 ))
      3.700     3.700     2.300 peak  3875 spectrum    1 weight  0.10000E+01 volume  0.70528E-03 ppm1      2.387 ppm2      3.204 CV     1
 OR { 3875}
   (( segid "    " and resid 129  and name HG2 ))
   (( segid "    " and resid 127  and name HD2 ))
 OR { 3875}
   (( segid "    " and resid 129  and name HG3 ))
   (( segid "    " and resid 127  and name HD2 ))
 ASSI { 3876}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 12   and name HA  ))
      2.900     1.000     1.000 peak  3876 spectrum    1 weight  0.10000E+01 volume  0.46331E-02 ppm1      2.443 ppm2      4.145 CV     1
 OR { 3876}
   (( segid "    " and resid 129  and name HG3 ))
   (( segid "    " and resid 129  and name HA  ))
 OR { 3876}
   (( segid "    " and resid 129  and name HG2 ))
   (( segid "    " and resid 129  and name HA  ))
 ASSI { 3882}
   (( segid "    " and resid 12   and name HB3 ))
   (( segid "    " and resid 12   and name HG2 ))
      2.300     0.700     0.700 peak  3882 spectrum    1 weight  0.10000E+01 volume  0.87027E-02 ppm1      1.975 ppm2      2.452 CV     1
 OR { 3882}
   (( segid "    " and resid 12   and name HB3 ))
   (( segid "    " and resid 13   and name HB2 ))
 ASSI { 3891}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 14   and name HG3 ))
      3.600     1.600     1.600 peak  3891 spectrum    1 weight  0.10000E+01 volume  0.19221E-02 ppm1      4.513 ppm2      2.133 CV     1
 OR { 3891}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HG2 ))
 ASSI { 3893}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HD2 ))
      4.300     2.300     1.700 peak  3893 spectrum    1 weight  0.10000E+01 volume  0.44153E-03 ppm1      4.533 ppm2      4.017 CV     1
 OR { 3893}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HD3 ))
 OR { 3893}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 14   and name HA  ))
 ASSI { 3894}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 12   and name HA  ))
      4.100     2.100     1.900 peak  3894 spectrum    1 weight  0.10000E+01 volume  0.44350E-03 ppm1      4.527 ppm2      4.163 CV     1
 OR { 3894}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 15   and name HA  ))
 ASSI { 3904}
   (( segid "    " and resid 11   and name HG2 ))
   (( segid "    " and resid 11   and name HA  ))
      4.600     2.700     1.400 peak  3904 spectrum    1 weight  0.10000E+01 volume  0.59574E-03 ppm1      2.143 ppm2      4.524 CV     1
 OR { 3904}
   (( segid "    " and resid 11   and name HG2 ))
   (( segid "    " and resid 10   and name HB2 ))
 ASSI { 3906}
   (( segid "    " and resid 11   and name HD3 ))
   (( segid "    " and resid 10   and name HB2 ))
      3.800     1.800     1.800 peak  3906 spectrum    1 weight  0.10000E+01 volume  0.49345E-03 ppm1      3.994 ppm2      4.498 CV     1
 OR { 3906}
   (( segid "    " and resid 11   and name HD2 ))
   (( segid "    " and resid 10   and name HB2 ))
 OR { 3906}
   (( segid "    " and resid 11   and name HD3 ))
   (( segid "    " and resid 11   and name HA  ))
 ASSI { 3920}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 10   and name HB3 ))
      2.700     0.900     0.900 peak  3920 spectrum    1 weight  0.10000E+01 volume  0.11353E-02 ppm1      4.478 ppm2      4.037 CV     1
 OR { 3920}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 11   and name HD2 ))
 ASSI { 3921}
   (( segid "    " and resid 10   and name HB3 ))
   (( segid "    " and resid 12   and name HB2 ))
      4.800     2.900     1.200 peak  3921 spectrum    1 weight  0.10000E+01 volume  0.60643E-03 ppm1      4.058 ppm2      2.136 CV     1
 OR { 3921}
   (( segid "    " and resid 10   and name HB3 ))
   (( segid "    " and resid 11   and name HG2 ))
 ASSI { 3922}
   (( segid "    " and resid 10   and name HB3 ))
   (( segid "    " and resid 13   and name HB3 ))
      4.600     2.700     1.400 peak  3922 spectrum    1 weight  0.10000E+01 volume  0.65730E-03 ppm1      4.066 ppm2      2.428 CV     1
 OR { 3922}
   (( segid "    " and resid 10   and name HB3 ))
   (( segid "    " and resid 13   and name HB2 ))
 OR { 3922}
   (( segid "    " and resid 10   and name HB3 ))
   (( segid "    " and resid 12   and name HG2 ))
 OR { 3922}
   (( segid "    " and resid 10   and name HB3 ))
   (( segid "    " and resid 14   and name HB2 ))
 ASSI { 3924}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 13   and name HB3 ))
      4.500     2.600     1.500 peak  3924 spectrum    1 weight  0.10000E+01 volume  0.53488E-03 ppm1      4.489 ppm2      2.410 CV     1
 OR { 3924}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 13   and name HB2 ))
 OR { 3924}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 12   and name HG2 ))
 OR { 3924}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 14   and name HB2 ))
 ASSI { 3929}
   (( segid "    " and resid 9    and name HD1 ))
   (( segid "    " and resid 53   and name HB2 ))
      4.700     2.700     1.300 peak  3929 spectrum    1 weight  0.10000E+01 volume  0.27481E-03 ppm1      6.974 ppm2      2.230 CV     1
 OR { 3929}
   (( segid "    " and resid 9    and name HD1 ))
   (( segid "    " and resid 17   and name HB3 ))
 OR { 3929}
   (( segid "    " and resid 9    and name HD1 ))
   (( segid "    " and resid 49   and name HB3 ))
 ASSI { 3930}
   (( segid "    " and resid 9    and name HD1 ))
   (  segid "    " and resid 8    and name HG2%)
      3.200     1.300     1.300 peak  3930 spectrum    1 weight  0.10000E+01 volume  0.61848E-03 ppm1      6.974 ppm2      1.251 CV     1
 OR { 3930}
   (( segid "    " and resid 9    and name HD1 ))
   (  segid "    " and resid 42   and name HG2%)
 ASSI { 3933}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 8    and name HA  ))
      4.000     2.000     2.000 peak  3933 spectrum    1 weight  0.10000E+01 volume  0.10330E-02 ppm1      4.493 ppm2      4.246 CV     1
 OR { 3933}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 8    and name HB  ))
 OR { 3933}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 13   and name HA  ))
 ASSI { 3936}
   (( segid "    " and resid 9    and name HZ3 ))
   (  segid "    " and resid 43   and name HG2%)
      3.900     1.900     1.900 peak  3936 spectrum    1 weight  0.10000E+01 volume  0.84795E-03 ppm1      6.806 ppm2      0.737 CV     1
 OR { 3936}
   (( segid "    " and resid 9    and name HZ3 ))
   (  segid "    " and resid 17   and name HD2%)
 OR { 3936}
   (( segid "    " and resid 9    and name HZ3 ))
   (  segid "    " and resid 43   and name HG1%)
 ASSI { 3938}
   (( segid "    " and resid 9    and name HZ3 ))
   (( segid "    " and resid 40   and name HB3 ))
      5.800     4.300     0.200 peak  3938 spectrum    1 weight  0.10000E+01 volume  0.19408E-03 ppm1      6.810 ppm2      1.492 CV     1
 OR { 3938}
   (( segid "    " and resid 9    and name HZ3 ))
   (( segid "    " and resid 17   and name HG  ))
 ASSI { 3942}
   (( segid "    " and resid 9    and name HZ3 ))
   (( segid "    " and resid 14   and name HG2 ))
      5.000     3.100     1.000 peak  3942 spectrum    1 weight  0.10000E+01 volume  0.27958E-03 ppm1      6.807 ppm2      2.882 CV     1
 OR { 3942}
   (( segid "    " and resid 9    and name HZ3 ))
   (( segid "    " and resid 9    and name HB2 ))
 OR { 3942}
   (( segid "    " and resid 9    and name HZ3 ))
   (( segid "    " and resid 9    and name HB3 ))
 ASSI { 3943}
   (( segid "    " and resid 9    and name HZ3 ))
   (( segid "    " and resid 14   and name HA  ))
      4.100     2.100     1.900 peak  3943 spectrum    1 weight  0.10000E+01 volume  0.28315E-03 ppm1      6.812 ppm2      3.970 CV     1
 OR { 3943}
   (( segid "    " and resid 9    and name HZ3 ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI { 3946}
   (( segid "    " and resid 9    and name HH2 ))
   (  segid "    " and resid 40   and name HD2%)
      3.400     1.400     1.400 peak  3946 spectrum    1 weight  0.10000E+01 volume  0.17916E-02 ppm1      6.714 ppm2      0.911 CV     1
 OR { 3946}
   (( segid "    " and resid 9    and name HH2 ))
   (  segid "    " and resid 50   and name HD1%)
 OR { 3946}
   (( segid "    " and resid 9    and name HH2 ))
   (  segid "    " and resid 50   and name HG2%)
 ASSI { 3948}
   (( segid "    " and resid 9    and name HH2 ))
   (( segid "    " and resid 40   and name HB2 ))
      5.600     4.000     0.400 peak  3948 spectrum    1 weight  0.10000E+01 volume  0.19260E-03 ppm1      6.724 ppm2      1.887 CV     1
 OR { 3948}
   (( segid "    " and resid 9    and name HH2 ))
   (( segid "    " and resid 40   and name HG  ))
 OR { 3948}
   (( segid "    " and resid 9    and name HH2 ))
   (( segid "    " and resid 37   and name HB3 ))
 ASSI { 3949}
   (( segid "    " and resid 9    and name HH2 ))
   (( segid "    " and resid 17   and name HB3 ))
      5.000     3.200     1.000 peak  3949 spectrum    1 weight  0.10000E+01 volume  0.34442E-03 ppm1      6.718 ppm2      2.200 CV     1
 OR { 3949}
   (( segid "    " and resid 9    and name HH2 ))
   (( segid "    " and resid 53   and name HB2 ))
 ASSI { 3950}
   (( segid "    " and resid 9    and name HH2 ))
   (( segid "    " and resid 14   and name HG2 ))
      4.600     2.600     1.400 peak  3950 spectrum    1 weight  0.10000E+01 volume  0.19039E-03 ppm1      6.697 ppm2      2.858 CV     1
 OR { 3950}
   (( segid "    " and resid 9    and name HH2 ))
   (( segid "    " and resid 45   and name HD3 ))
 OR { 3950}
   (( segid "    " and resid 9    and name HH2 ))
   (( segid "    " and resid 53   and name HB3 ))
 ASSI { 3953}
   (( segid "    " and resid 9    and name HZ2 ))
   (  segid "    " and resid 50   and name HD1%)
      3.300     1.300     1.300 peak  3953 spectrum    1 weight  0.10000E+01 volume  0.19238E-02 ppm1      6.921 ppm2      0.902 CV     1
 OR { 3953}
   (( segid "    " and resid 9    and name HZ2 ))
   (  segid "    " and resid 40   and name HD2%)
 OR { 3953}
   (( segid "    " and resid 9    and name HZ2 ))
   (  segid "    " and resid 50   and name HG2%)
 ASSI { 3955}
   (( segid "    " and resid 9    and name HZ2 ))
   (  segid "    " and resid 57   and name HE% )
      5.500     3.800     0.500 peak  3955 spectrum    1 weight  0.10000E+01 volume  0.24026E-03 ppm1      6.918 ppm2      1.967 CV     1
 OR { 3955}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 54   and name HB3 ))
 ASSI { 3956}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 45   and name HB3 ))
      4.400     2.400     1.600 peak  3956 spectrum    1 weight  0.10000E+01 volume  0.54700E-03 ppm1      6.921 ppm2      1.692 CV     1
 OR { 3956}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 45   and name HB2 ))
 OR { 3956}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 54   and name HG  ))
 OR { 3956}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 56   and name HB2 ))
 ASSI { 3957}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 50   and name HG13))
      3.800     1.800     1.800 peak  3957 spectrum    1 weight  0.10000E+01 volume  0.59712E-03 ppm1      6.924 ppm2      1.648 CV     1
 OR { 3957}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 45   and name HB3 ))
 OR { 3957}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 3958}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 50   and name HG13))
      3.900     1.900     1.900 peak  3958 spectrum    1 weight  0.10000E+01 volume  0.57415E-03 ppm1      6.925 ppm2      1.559 CV     1
 OR { 3958}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 50   and name HG12))
 OR { 3958}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 45   and name HG2 ))
 ASSI { 3962}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 53   and name HB2 ))
      3.500     1.500     1.500 peak  3962 spectrum    1 weight  0.10000E+01 volume  0.12022E-02 ppm1      6.920 ppm2      2.215 CV     1
 OR { 3962}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 17   and name HB3 ))
 OR { 3962}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 49   and name HB3 ))
 ASSI { 3963}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 45   and name HD3 ))
      3.600     1.600     1.600 peak  3963 spectrum    1 weight  0.10000E+01 volume  0.79975E-03 ppm1      6.919 ppm2      2.880 CV     1
 OR { 3963}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 53   and name HB3 ))
 OR { 3963}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 14   and name HG2 ))
 ASSI { 3965}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 14   and name HA  ))
      5.600     3.900     0.400 peak  3965 spectrum    1 weight  0.10000E+01 volume  0.18298E-03 ppm1      6.925 ppm2      4.007 CV     1
 OR { 3965}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 53   and name HA  ))
 OR { 3965}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI { 3967}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 50   and name H   ))
      4.500     2.500     1.500 peak  3967 spectrum    1 weight  0.10000E+01 volume  0.43400E-03 ppm1      6.922 ppm2      8.200 CV     1
 OR { 3967}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 52   and name H   ))
 OR { 3967}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 42   and name H   ))
 ASSI { 3968}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 53   and name H   ))
      4.400     2.400     1.600 peak  3968 spectrum    1 weight  0.10000E+01 volume  0.50026E-03 ppm1      6.920 ppm2      8.141 CV     1
 OR { 3968}
   (( segid "    " and resid 9    and name HZ2 ))
   (( segid "    " and resid 42   and name H   ))
 ASSI { 3975}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 43   and name H   ))
      6.000     5.000     0.000 peak  3975 spectrum    1 weight  0.10000E+01 volume  0.12138E-03 ppm1      2.887 ppm2      7.953 CV     1
 OR { 3975}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 16   and name H   ))
 OR { 3975}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 43   and name H   ))
 OR { 3975}
   (( segid "    " and resid 9    and name HB3 ))
   (( segid "    " and resid 16   and name H   ))
 ASSI { 3980}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 7    and name HA  ))
      4.000     2.000     2.000 peak  3980 spectrum    1 weight  0.10000E+01 volume  0.10687E-02 ppm1      4.236 ppm2      4.457 CV     1
 OR { 3980}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 9    and name HA  ))
 ASSI { 3981}
   (( segid "    " and resid 8    and name HB  ))
   (( segid "    " and resid 9    and name HA  ))
      4.200     2.200     1.800 peak  3981 spectrum    1 weight  0.10000E+01 volume  0.10835E-02 ppm1      4.207 ppm2      4.460 CV     1
 OR { 3981}
   (( segid "    " and resid 8    and name HB  ))
   (( segid "    " and resid 7    and name HA  ))
 ASSI { 3982}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 8    and name H   ))
      2.900     2.900     3.100 peak  3982 spectrum    1 weight  0.10000E+01 volume  0.22218E-02 ppm1      1.250 ppm2      8.337 CV     1
 OR { 3982}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 48   and name H   ))
 ASSI { 3988}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 7    and name HA  ))
      3.400     1.400     1.400 peak  3988 spectrum    1 weight  0.10000E+01 volume  0.31264E-02 ppm1      1.247 ppm2      4.476 CV     1
 OR { 3988}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 40   and name HA  ))
 ASSI { 3990}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 9    and name HE1 ))
      4.500     2.500     1.500 peak  3990 spectrum    1 weight  0.10000E+01 volume  0.58121E-03 ppm1      1.251 ppm2      0.130 CV     1
 OR { 3990}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 9    and name HE1 ))
 ASSI { 4010}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 54   and name HB2 ))
      4.800     2.900     1.200 peak  4010 spectrum    1 weight  0.10000E+01 volume  0.60742E-03 ppm1      4.566 ppm2      0.749 CV     1
 OR { 4010}
   (( segid "    " and resid 6    and name HA  ))
   (  segid "    " and resid 43   and name HG1%)
 OR { 4010}
   (( segid "    " and resid 60   and name HA  ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI { 4011}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 7    and name HB2 ))
      4.000     2.000     2.000 peak  4011 spectrum    1 weight  0.10000E+01 volume  0.12535E-02 ppm1      4.560 ppm2      1.716 CV     1
 OR { 4011}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 54   and name HG  ))
 ASSI { 4012}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 5    and name HB3 ))
      3.500     1.500     1.500 peak  4012 spectrum    1 weight  0.10000E+01 volume  0.90063E-03 ppm1      4.559 ppm2      1.833 CV     1
 OR { 4012}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 44   and name HB2 ))
 ASSI { 4020}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 7    and name HG3 ))
      3.800     1.800     1.800 peak  4020 spectrum    1 weight  0.10000E+01 volume  0.32195E-02 ppm1      1.338 ppm2      1.945 CV     1
 OR { 4020}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 44   and name HG3 ))
 OR { 4020}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 7    and name HG2 ))
 ASSI { 4023}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 45   and name HD3 ))
      4.100     2.100     1.900 peak  4023 spectrum    1 weight  0.10000E+01 volume  0.70020E-03 ppm1      1.337 ppm2      2.860 CV     1
 OR { 4023}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 9    and name HB3 ))
 ASSI { 4024}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 5    and name HD3 ))
      2.600     2.600     3.400 peak  4024 spectrum    1 weight  0.10000E+01 volume  0.73442E-03 ppm1      1.338 ppm2      3.202 CV     1
 OR { 4024}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 5    and name HD2 ))
 OR { 4024}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 4    and name HD2 ))
 OR { 4024}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 47   and name HD3 ))
 ASSI { 4037}
   (  segid "    " and resid 118  and name HD1%)
   (  segid "    " and resid 88   and name HE% )
      4.400     2.400     1.600 peak  4037 spectrum    1 weight  0.10000E+01 volume  0.11182E-02 ppm1      0.504 ppm2      7.200 CV     1
 OR { 4037}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 85   and name HE22))
 ASSI { 4039}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 85   and name HE21))
      4.800     2.800     1.200 peak  4039 spectrum    1 weight  0.10000E+01 volume  0.56955E-03 ppm1      0.506 ppm2      6.799 CV     1
 OR { 4039}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 124  and name H   ))
 ASSI { 4040}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 88   and name H   ))
      3.100     3.100     2.900 peak  4040 spectrum    1 weight  0.10000E+01 volume  0.72038E-03 ppm1      0.503 ppm2      8.887 CV     1
 OR { 4040}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 125  and name H   ))
 ASSI { 4042}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 121  and name H   ))
      3.900     1.900     1.900 peak  4042 spectrum    1 weight  0.10000E+01 volume  0.11265E-02 ppm1      0.505 ppm2      8.138 CV     1
 OR { 4042}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 120  and name H   ))
 ASSI { 4043}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 119  and name H   ))
      4.300     2.300     1.700 peak  4043 spectrum    1 weight  0.10000E+01 volume  0.77529E-03 ppm1      0.505 ppm2      7.871 CV     1
 OR { 4043}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 122  and name H   ))
 ASSI { 4047}
   (  segid "    " and resid 118  and name HD2%)
   (( segid "    " and resid 117  and name H   ))
      4.900     2.900     1.100 peak  4047 spectrum    1 weight  0.10000E+01 volume  0.63953E-03 ppm1      0.760 ppm2      7.543 CV     1
 OR { 4047}
   (  segid "    " and resid 118  and name HD2%)
   (( segid "    " and resid 123  and name H   ))
 ASSI { 4049}
   (  segid "    " and resid 118  and name HD2%)
   (( segid "    " and resid 115  and name H   ))
      4.200     2.200     1.800 peak  4049 spectrum    1 weight  0.10000E+01 volume  0.64270E-03 ppm1      0.758 ppm2      8.560 CV     1
 OR { 4049}
   (  segid "    " and resid 118  and name HD2%)
   (( segid "    " and resid 98   and name H   ))
 ASSI { 4051}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 73   and name HA  ))
      4.200     2.300     1.800 peak  4051 spectrum    1 weight  0.10000E+01 volume  0.85640E-03 ppm1      0.504 ppm2      4.130 CV     1
 OR { 4051}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 119  and name HA  ))
 OR { 4051}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 121  and name HA  ))
 ASSI { 4060}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 84   and name HG  ))
      3.100     1.200     1.200 peak  4060 spectrum    1 weight  0.10000E+01 volume  0.34435E-02 ppm1      0.503 ppm2      1.463 CV     1
 OR { 4060}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 121  and name HB3 ))
 ASSI { 4061}
   (  segid "    " and resid 118  and name HD1%)
   (( segid "    " and resid 123  and name HB2 ))
      2.300     0.600     0.600 peak  4061 spectrum    1 weight  0.10000E+01 volume  0.77549E-02 ppm1      0.503 ppm2      1.051 CV     1
 OR { 4061}
   (  segid "    " and resid 118  and name HD1%)
   (  segid "    " and resid 84   and name HD1%)
 ASSI { 4062}
   (  segid "    " and resid 118  and name HD1%)
   (  segid "    " and resid 114  and name HG2%)
      2.300     0.600     0.600 peak  4062 spectrum    1 weight  0.10000E+01 volume  0.89511E-02 ppm1      0.504 ppm2      0.955 CV     1
 OR { 4062}
   (  segid "    " and resid 118  and name HD1%)
   (  segid "    " and resid 130  and name HD2%)
 ASSI { 4063}
   (  segid "    " and resid 118  and name HD1%)
   (  segid "    " and resid 118  and name HD2%)
      2.000     0.500     0.500 peak  4063 spectrum    1 weight  0.10000E+01 volume  0.10676E-01 ppm1      0.503 ppm2      0.770 CV     1
 OR { 4063}
   (  segid "    " and resid 118  and name HD1%)
   (  segid "    " and resid 121  and name HD1%)
 OR { 4063}
   (  segid "    " and resid 118  and name HD1%)
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 4064}
   (  segid "    " and resid 118  and name HD2%)
   (  segid "    " and resid 114  and name HG2%)
      1.900     0.500     0.500 peak  4064 spectrum    1 weight  0.10000E+01 volume  0.18323E-01 ppm1      0.753 ppm2      0.963 CV     1
 OR { 4064}
   (  segid "    " and resid 118  and name HD2%)
   (  segid "    " and resid 130  and name HD2%)
 ASSI { 4065}
   (  segid "    " and resid 118  and name HD2%)
   (  segid "    " and resid 118  and name HD1%)
      2.100     0.600     0.600 peak  4065 spectrum    1 weight  0.10000E+01 volume  0.10297E-01 ppm1      0.755 ppm2      0.514 CV     1
 OR { 4065}
   (  segid "    " and resid 118  and name HD2%)
   (  segid "    " and resid 124  and name HG1%)
 ASSI { 4067}
   (( segid "    " and resid 118  and name HG  ))
   (  segid "    " and resid 118  and name HD1%)
      2.600     0.900     0.900 peak  4067 spectrum    1 weight  0.10000E+01 volume  0.17765E-02 ppm1      1.889 ppm2      0.517 CV     1
 OR { 4067}
   (( segid "    " and resid 118  and name HG  ))
   (  segid "    " and resid 124  and name HG1%)
 ASSI { 4068}
   (( segid "    " and resid 118  and name HG  ))
   (  segid "    " and resid 118  and name HD2%)
      2.500     0.800     0.800 peak  4068 spectrum    1 weight  0.10000E+01 volume  0.32125E-02 ppm1      1.881 ppm2      0.760 CV     1
 OR { 4068}
   (( segid "    " and resid 118  and name HG  ))
   (  segid "    " and resid 123  and name HD1%)
 ASSI { 4073}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 87   and name HB3 ))
      2.800     1.000     1.000 peak  4073 spectrum    1 weight  0.10000E+01 volume  0.25268E-02 ppm1      4.265 ppm2      1.479 CV     1
 OR { 4073}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 90   and name HB3 ))
 ASSI { 4074}
   (( segid "    " and resid 87   and name HB2 ))
   (  segid "    " and resid 87   and name HD1%)
      4.000     2.000     2.000 peak  4074 spectrum    1 weight  0.10000E+01 volume  0.56998E-03 ppm1      2.215 ppm2      1.085 CV     1
 OR { 4074}
   (( segid "    " and resid 87   and name HB2 ))
   (  segid "    " and resid 84   and name HD1%)
 ASSI { 4075}
   (( segid "    " and resid 87   and name HB3 ))
   (  segid "    " and resid 101  and name HD1%)
      3.200     1.300     1.300 peak  4075 spectrum    1 weight  0.10000E+01 volume  0.14769E-02 ppm1      1.516 ppm2      1.020 CV     1
 OR { 4075}
   (( segid "    " and resid 87   and name HB3 ))
   (  segid "    " and resid 101  and name HG2%)
 OR { 4075}
   (( segid "    " and resid 87   and name HB3 ))
   (  segid "    " and resid 87   and name HD2%)
 ASSI { 4079}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 84   and name HB3 ))
      2.700     0.900     0.900 peak  4079 spectrum    1 weight  0.10000E+01 volume  0.47924E-02 ppm1      1.090 ppm2      2.027 CV     1
 OR { 4079}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 118  and name HB2 ))
 ASSI { 4080}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 87   and name HA  ))
      3.100     1.200     1.200 peak  4080 spectrum    1 weight  0.10000E+01 volume  0.19318E-02 ppm1      1.031 ppm2      4.236 CV     1
 OR { 4080}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 105  and name HA  ))
 ASSI { 4084}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 83   and name HB2 ))
      2.700     0.900     0.900 peak  4084 spectrum    1 weight  0.10000E+01 volume  0.13806E-02 ppm1      1.032 ppm2      2.420 CV     1
 OR { 4084}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 83   and name HG3 ))
 OR { 4084}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 89   and name HG2 ))
 OR { 4084}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 109  and name HD3 ))
 ASSI { 4088}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 84   and name H   ))
      3.800     1.800     1.800 peak  4088 spectrum    1 weight  0.10000E+01 volume  0.10983E-02 ppm1      1.031 ppm2      8.074 CV     1
 OR { 4088}
   (  segid "    " and resid 87   and name HD2%)
   (( segid "    " and resid 105  and name H   ))
 ASSI { 4094}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 24   and name H   ))
      4.200     2.200     1.800 peak  4094 spectrum    1 weight  0.10000E+01 volume  0.49925E-03 ppm1      3.955 ppm2      7.280 CV     1
 OR { 4094}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 16   and name HD2 ))
 ASSI { 4101}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 53   and name HB2 ))
      3.200     1.300     1.300 peak  4101 spectrum    1 weight  0.10000E+01 volume  0.14203E-02 ppm1      5.765 ppm2      2.174 CV     1
 OR { 4101}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 14   and name HG3 ))
 ASSI { 4102}
   (( segid "    " and resid 53   and name HD2 ))
   (  segid "    " and resid 57   and name HE% )
      2.400     2.400     3.600 peak  4102 spectrum    1 weight  0.10000E+01 volume  0.88520E-03 ppm1      5.764 ppm2      1.986 CV     1
 OR { 4102}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 57   and name HG2 ))
 OR { 4102}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 11   and name HB3 ))
 ASSI { 4104}
   (( segid "    " and resid 53   and name HD2 ))
   (  segid "    " and resid 40   and name HD1%)
      2.700     2.700     3.300 peak  4104 spectrum    1 weight  0.10000E+01 volume  0.43515E-03 ppm1      5.768 ppm2      0.945 CV     1
 OR { 4104}
   (( segid "    " and resid 53   and name HD2 ))
   (  segid "    " and resid 40   and name HD2%)
 OR { 4104}
   (( segid "    " and resid 53   and name HD2 ))
   (  segid "    " and resid 50   and name HG2%)
 OR { 4104}
   (( segid "    " and resid 53   and name HD2 ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI { 4106}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 17   and name HG  ))
      3.000     3.000     3.000 peak  4106 spectrum    1 weight  0.10000E+01 volume  0.23013E-03 ppm1      5.761 ppm2      1.484 CV     1
 OR { 4106}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 45   and name HG2 ))
 ASSI { 4110}
   (( segid "    " and resid 117  and name HD3 ))
   (( segid "    " and resid 73   and name H   ))
      2.600     2.600     3.400 peak  4110 spectrum    1 weight  0.10000E+01 volume  0.55657E-03 ppm1      0.559 ppm2      8.142 CV     1
 OR { 4110}
   (( segid "    " and resid 117  and name HD3 ))
   (( segid "    " and resid 116  and name H   ))
 OR { 4110}
   (( segid "    " and resid 117  and name HD3 ))
   (( segid "    " and resid 120  and name H   ))
 OR { 4110}
   (( segid "    " and resid 117  and name HD3 ))
   (( segid "    " and resid 114  and name H   ))
 ASSI { 4114}
   (( segid "    " and resid 117  and name HD2 ))
   (( segid "    " and resid 117  and name HD3 ))
      2.100     0.600     0.600 peak  4114 spectrum    1 weight  0.10000E+01 volume  0.28036E-02 ppm1      1.169 ppm2      0.583 CV     1
 OR { 4114}
   (( segid "    " and resid 73   and name HG12))
   (  segid "    " and resid 121  and name HD2%)
 ASSI { 4122}
   (( segid "    " and resid 76   and name HH2 ))
   (  segid "    " and resid 105  and name HD1%)
      3.300     1.400     1.400 peak  4122 spectrum    1 weight  0.10000E+01 volume  0.81840E-03 ppm1      6.884 ppm2      1.065 CV     1
 OR { 4122}
   (( segid "    " and resid 76   and name HH2 ))
   (  segid "    " and resid 84   and name HD1%)
 ASSI { 4123}
   (( segid "    " and resid 76   and name HH2 ))
   (( segid "    " and resid 84   and name HG  ))
      4.400     2.500     1.600 peak  4123 spectrum    1 weight  0.10000E+01 volume  0.21587E-03 ppm1      6.898 ppm2      1.467 CV     1
 OR { 4123}
   (( segid "    " and resid 76   and name HH2 ))
   (( segid "    " and resid 109  and name HG3 ))
 ASSI { 4128}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 88   and name H   ))
      6.000     4.900     0.000 peak  4128 spectrum    1 weight  0.10000E+01 volume  0.14846E-03 ppm1      7.201 ppm2      8.902 CV     1
 OR { 4128}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 125  and name H   ))
 ASSI { 4129}
   (( segid "    " and resid 53   and name HE1 ))
   (( segid "    " and resid 49   and name HB3 ))
      4.600     2.700     1.400 peak  4129 spectrum    1 weight  0.10000E+01 volume  0.25653E-03 ppm1      7.950 ppm2      2.156 CV     1
 OR { 4129}
   (( segid "    " and resid 53   and name HE1 ))
   (( segid "    " and resid 53   and name HB2 ))
 OR { 4129}
   (( segid "    " and resid 53   and name HE1 ))
   (( segid "    " and resid 56   and name HG3 ))
 ASSI { 4137}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 130  and name H   ))
      5.000     3.200     1.000 peak  4137 spectrum    1 weight  0.10000E+01 volume  0.31689E-03 ppm1      7.188 ppm2      7.756 CV     1
 OR { 4137}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 91   and name H   ))
 ASSI { 4139}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 130  and name HA  ))
      5.200     3.400     0.800 peak  4139 spectrum    1 weight  0.10000E+01 volume  0.14425E-03 ppm1      7.204 ppm2      4.274 CV     1
 OR { 4139}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 124  and name HA  ))
 ASSI { 4146}
   (( segid "    " and resid 76   and name HZ3 ))
   (  segid "    " and resid 84   and name HD1%)
      4.000     2.000     2.000 peak  4146 spectrum    1 weight  0.10000E+01 volume  0.56046E-03 ppm1      7.048 ppm2      1.068 CV     1
 OR { 4146}
   (( segid "    " and resid 76   and name HZ3 ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI { 4147}
   (( segid "    " and resid 76   and name HZ3 ))
   (  segid "    " and resid 74   and name HG2%)
      5.200     3.300     0.800 peak  4147 spectrum    1 weight  0.10000E+01 volume  0.24661E-03 ppm1      7.043 ppm2      0.952 CV     1
 OR { 4147}
   (( segid "    " and resid 76   and name HZ3 ))
   (  segid "    " and resid 114  and name HD1%)
 OR { 4147}
   (( segid "    " and resid 76   and name HZ3 ))
   (  segid "    " and resid 114  and name HG2%)
 ASSI { 4149}
   (( segid "    " and resid 76   and name HZ3 ))
   (( segid "    " and resid 84   and name HG  ))
      4.900     3.000     1.100 peak  4149 spectrum    1 weight  0.10000E+01 volume  0.18581E-03 ppm1      7.043 ppm2      1.481 CV     1
 OR { 4149}
   (( segid "    " and resid 76   and name HZ3 ))
   (( segid "    " and resid 109  and name HG3 ))
 ASSI { 4152}
   (( segid "    " and resid 76   and name HZ3 ))
   (( segid "    " and resid 81   and name HA  ))
      5.000     3.100     1.000 peak  4152 spectrum    1 weight  0.10000E+01 volume  0.19102E-03 ppm1      7.040 ppm2      3.888 CV     1
 OR { 4152}
   (( segid "    " and resid 76   and name HZ3 ))
   (( segid "    " and resid 114  and name HA  ))
 ASSI { 4153}
   (( segid "    " and resid 76   and name HE3 ))
   (( segid "    " and resid 81   and name H   ))
      4.600     2.700     1.400 peak  4153 spectrum    1 weight  0.10000E+01 volume  0.39447E-03 ppm1      7.370 ppm2      8.657 CV     1
 OR { 4153}
   (( segid "    " and resid 76   and name HE3 ))
   (( segid "    " and resid 76   and name H   ))
 OR { 4153}
   (( segid "    " and resid 76   and name HE3 ))
   (( segid "    " and resid 77   and name H   ))
 ASSI { 4155}
   (( segid "    " and resid 76   and name HE3 ))
   (  segid "    " and resid 74   and name HG2%)
      4.400     2.400     1.600 peak  4155 spectrum    1 weight  0.10000E+01 volume  0.32619E-03 ppm1      7.366 ppm2      0.914 CV     1
 OR { 4155}
   (( segid "    " and resid 76   and name HE3 ))
   (  segid "    " and resid 74   and name HG1%)
 OR { 4155}
   (( segid "    " and resid 76   and name HE3 ))
   (  segid "    " and resid 114  and name HD1%)
 ASSI { 4156}
   (( segid "    " and resid 76   and name HE3 ))
   (( segid "    " and resid 73   and name HB  ))
      4.500     2.500     1.500 peak  4156 spectrum    1 weight  0.10000E+01 volume  0.36054E-03 ppm1      7.368 ppm2      1.810 CV     1
 OR { 4156}
   (( segid "    " and resid 76   and name HE3 ))
   (( segid "    " and resid 84   and name HB2 ))
 OR { 4156}
   (( segid "    " and resid 76   and name HE3 ))
   (( segid "    " and resid 81   and name HB2 ))
 ASSI { 4159}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 114  and name H   ))
      5.900     4.400     0.100 peak  4159 spectrum    1 weight  0.10000E+01 volume  0.15511E-03 ppm1      7.097 ppm2      8.105 CV     1
 OR { 4159}
   (( segid "    " and resid 76   and name HZ2 ))
   (( segid "    " and resid 85   and name H   ))
 ASSI { 4160}
   (( segid "    " and resid 76   and name HH2 ))
   (( segid "    " and resid 114  and name H   ))
      6.000     5.700     0.000 peak  4160 spectrum    1 weight  0.10000E+01 volume  0.10907E-03 ppm1      6.896 ppm2      8.126 CV     1
 OR { 4160}
   (( segid "    " and resid 76   and name HH2 ))
   (( segid "    " and resid 85   and name H   ))
 ASSI { 4165}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 110  and name H   ))
      5.600     4.000     0.400 peak  4165 spectrum    1 weight  0.10000E+01 volume  0.17245E-03 ppm1      2.779 ppm2      8.378 CV     1
 OR { 4165}
   (( segid "    " and resid 109  and name HD2 ))
   (( segid "    " and resid 74   and name H   ))
 ASSI { 4167}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 128  and name H   ))
      2.700     2.700     3.300 peak  4167 spectrum    1 weight  0.10000E+01 volume  0.41015E-03 ppm1      6.742 ppm2      8.591 CV     1
 OR { 4167}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 115  and name H   ))
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ASP   1           HT1      ASP   1 -23.892  14.677  -3.007
    2    H2   ASP   1           HT2      ASP   1 -23.477  13.053  -3.210
    3    H3   ASP   1           HT3      ASP   1 -25.082  13.482  -2.896
    4    HA   ASP   1           HA       ASP   1 -25.224  14.635  -4.983
    5    HB2  ASP   1           HB2      ASP   1 -23.340  14.214  -6.647
    6    HB3  ASP   1           HB3      ASP   1 -23.012  15.373  -5.367
    7    HA   PRO   2           HA       PRO   2 -27.621  11.501  -6.281
    8    HB2  PRO   2           HB2      PRO   2 -26.413  11.571  -9.010
    9    HB3  PRO   2           HB3      PRO   2 -28.114  11.574  -8.530
   10    HG2  PRO   2           HG2      PRO   2 -26.930  13.834  -9.247
   11    HG3  PRO   2           HG3      PRO   2 -28.065  13.805  -7.888
   12    HD2  PRO   2           HD2      PRO   2 -25.103  14.023  -7.870
   13    HD3  PRO   2           HD3      PRO   2 -26.293  14.689  -6.737
   14    H    SER   3           H        SER   3 -24.836  10.617  -8.378
   15    HA   SER   3           HA       SER   3 -24.920   7.960  -7.148
   16    HB2  SER   3           HB2      SER   3 -24.941   6.953  -9.472
   17    HB3  SER   3           HB3      SER   3 -26.448   7.709  -8.957
   18    HG   SER   3           HG       SER   3 -25.250   9.652 -10.081
   19    H    ARG   4           H        ARG   4 -22.954   9.785  -6.738
   20    HA   ARG   4           HA       ARG   4 -20.700   8.744  -8.319
   21    HB2  ARG   4           HB2      ARG   4 -21.169  11.502  -7.207
   22    HB3  ARG   4           HB3      ARG   4 -19.594  10.956  -7.758
   23    HG2  ARG   4           HG2      ARG   4 -20.206  10.961  -9.962
   24    HG3  ARG   4           HG3      ARG   4 -21.917  10.721  -9.601
   25    HD2  ARG   4           HD2      ARG   4 -21.131  13.035 -10.439
   26    HD3  ARG   4           HD3      ARG   4 -22.253  12.951  -9.083
   27    HE   ARG   4           HE       ARG   4 -20.517  13.548  -7.614
   28   HH11  ARG   4          HH11      ARG   4 -19.473  13.453 -10.956
   29   HH12  ARG   4          HH12      ARG   4 -18.097  14.477 -10.691
   30   HH21  ARG   4          HH21      ARG   4 -18.711  14.903  -7.263
   31   HH22  ARG   4          HH22      ARG   4 -17.653  15.291  -8.582
   32    H    ARG   5           H        ARG   5 -18.656   9.817  -6.777
   33    HA   ARG   5           HA       ARG   5 -18.525   8.042  -4.580
   34    HB2  ARG   5           HB2      ARG   5 -16.334   8.860  -4.253
   35    HB3  ARG   5           HB3      ARG   5 -16.600   8.917  -5.981
   36    HG2  ARG   5           HG2      ARG   5 -16.451  11.194  -4.031
   37    HG3  ARG   5           HG3      ARG   5 -15.435  10.881  -5.434
   38    HD2  ARG   5           HD2      ARG   5 -17.267  11.423  -6.921
   39    HD3  ARG   5           HD3      ARG   5 -18.365  11.599  -5.549
   40    HE   ARG   5           HE       ARG   5 -16.112  13.402  -6.170
   41   HH11  ARG   5          HH11      ARG   5 -19.218  12.792  -4.655
   42   HH12  ARG   5          HH12      ARG   5 -19.429  14.431  -4.147
   43   HH21  ARG   5          HH21      ARG   5 -16.402  15.561  -5.490
   44   HH22  ARG   5          HH22      ARG   5 -17.835  16.002  -4.613
   45    H    ALA   6           H        ALA   6 -20.691   8.941  -3.753
   46    HA   ALA   6           HA       ALA   6 -20.394  11.377  -2.186
   47    HB1  ALA   6           HB1      ALA   6 -22.781  11.195  -1.805
   48    HB2  ALA   6           HB2      ALA   6 -22.801   9.658  -2.681
   49    HB3  ALA   6           HB3      ALA   6 -22.388  11.155  -3.528
   50    HA   PRO   7           HA       PRO   7 -20.155   8.916   1.543
   51    HB2  PRO   7           HB2      PRO   7 -19.726  11.455   2.827
   52    HB3  PRO   7           HB3      PRO   7 -18.629  10.080   2.703
   53    HG2  PRO   7           HG2      PRO   7 -18.153  12.420   1.437
   54    HG3  PRO   7           HG3      PRO   7 -17.701  10.857   0.726
   55    HD2  PRO   7           HD2      PRO   7 -20.139  12.536   0.184
   56    HD3  PRO   7           HD3      PRO   7 -19.032  11.752  -0.972
   57    H    THR   8           H        THR   8 -22.170   8.396   2.188
   58    HA   THR   8           HA       THR   8 -23.191  10.334   4.125
   59    HB   THR   8           HB       THR   8 -25.045   8.426   2.676
   60    HG1  THR   8           HG1      THR   8 -24.125  10.950   1.957
   61   HG21  THR   8          HG21      THR   8 -26.794   9.831   3.677
   62   HG22  THR   8          HG22      THR   8 -25.559  10.823   4.447
   63   HG23  THR   8          HG23      THR   8 -25.751   9.135   4.917
   64    H    TRP   9           H        TRP   9 -22.118   9.376   5.798
   65    HA   TRP   9           HA       TRP   9 -22.640   6.532   6.266
   66    HB2  TRP   9           HB2      TRP   9 -19.878   7.766   6.308
   67    HB3  TRP   9           HB3      TRP   9 -20.269   6.106   6.730
   68    HD1  TRP   9           HD1      TRP   9 -19.839   8.420   3.734
   69    HE1  TRP   9           HE1      TRP   9 -19.667   7.002   1.594
   70    HE3  TRP   9           HE3      TRP   9 -20.958   3.828   5.694
   71    HZ2  TRP   9           HZ2      TRP   9 -19.930   4.315   0.844
   72    HZ3  TRP   9           HZ3      TRP   9 -20.971   1.878   4.181
   73    HH2  TRP   9           HH2      TRP   9 -20.468   2.123   1.808
   74    H    SER  10           H        SER  10 -21.920   5.833   8.388
   75    HA   SER  10           HA       SER  10 -21.452   7.880  10.386
   76    HB2  SER  10           HB2      SER  10 -23.224   6.865  11.849
   77    HB3  SER  10           HB3      SER  10 -23.885   7.662  10.424
   78    HG   SER  10           HG       SER  10 -24.894   5.763  10.386
   79    HA   PRO  11           HA       PRO  11 -18.814   4.714  12.203
   80    HB2  PRO  11           HB2      PRO  11 -20.498   4.808  14.663
   81    HB3  PRO  11           HB3      PRO  11 -18.745   4.952  14.495
   82    HG2  PRO  11           HG2      PRO  11 -20.244   7.099  14.978
   83    HG3  PRO  11           HG3      PRO  11 -18.850   7.185  13.886
   84    HD2  PRO  11           HD2      PRO  11 -21.760   7.121  13.241
   85    HD3  PRO  11           HD3      PRO  11 -20.438   7.974  12.418
   86    H    GLU  12           H        GLU  12 -22.268   4.482  12.678
   87    HA   GLU  12           HA       GLU  12 -22.393   1.656  13.021
   88    HB2  GLU  12           HB2      GLU  12 -24.133   3.077  13.900
   89    HB3  GLU  12           HB3      GLU  12 -24.460   3.737  12.307
   90    HG2  GLU  12           HG2      GLU  12 -25.247   1.530  11.577
   91    HG3  GLU  12           HG3      GLU  12 -24.973   0.914  13.210
   92    H    GLU  13           H        GLU  13 -22.918   3.858  10.261
   93    HA   GLU  13           HA       GLU  13 -23.784   1.845   8.474
   94    HB2  GLU  13           HB2      GLU  13 -24.071   4.367   8.212
   95    HB3  GLU  13           HB3      GLU  13 -22.412   4.386   7.626
   96    HG2  GLU  13           HG2      GLU  13 -23.911   4.341   5.754
   97    HG3  GLU  13           HG3      GLU  13 -23.047   2.806   5.845
   98    H    GLU  14           H        GLU  14 -20.573   3.206   9.143
   99    HA   GLU  14           HA       GLU  14 -19.363   1.621   7.082
  100    HB2  GLU  14           HB2      GLU  14 -18.101   3.178   9.342
  101    HB3  GLU  14           HB3      GLU  14 -17.205   2.389   8.046
  102    HG2  GLU  14           HG2      GLU  14 -18.630   3.793   6.455
  103    HG3  GLU  14           HG3      GLU  14 -19.065   4.732   7.879
  104    H    ALA  15           H        ALA  15 -20.150   1.147  10.431
  105    HA   ALA  15           HA       ALA  15 -18.643  -1.260  10.751
  106    HB1  ALA  15           HB1      ALA  15 -20.097  -1.710  12.654
  107    HB2  ALA  15           HB2      ALA  15 -21.179  -0.413  12.148
  108    HB3  ALA  15           HB3      ALA  15 -19.541  -0.036  12.680
  109    H    HIS  16           H        HIS  16 -21.584  -0.376   9.260
  110    HA   HIS  16           HA       HIS  16 -22.544  -3.033   8.776
  111    HB2  HIS  16           HB2      HIS  16 -24.133  -1.193   9.027
  112    HB3  HIS  16           HB3      HIS  16 -23.386  -0.329   7.690
  113    HD1  HIS  16           HD1      HIS  16 -25.399  -0.248   6.186
  114    HD2  HIS  16           HD2      HIS  16 -24.431  -4.101   7.428
  115    HE1  HIS  16           HE1      HIS  16 -26.837  -1.805   4.809
  116    HE2  HIS  16           HE2      HIS  16 -26.379  -4.101   5.733
  117    H    LEU  17           H        LEU  17 -20.455  -0.719   7.295
  118    HA   LEU  17           HA       LEU  17 -20.417  -1.876   4.685
  119    HB2  LEU  17           HB2      LEU  17 -19.714   0.457   5.175
  120    HB3  LEU  17           HB3      LEU  17 -18.340  -0.170   6.066
  121    HG   LEU  17           HG       LEU  17 -17.579  -1.276   3.940
  122   HD11  LEU  17          HD11      LEU  17 -19.788   0.415   2.798
  123   HD12  LEU  17          HD12      LEU  17 -19.625  -1.340   2.708
  124   HD13  LEU  17          HD13      LEU  17 -18.489  -0.301   1.850
  125   HD21  LEU  17          HD21      LEU  17 -17.829   1.725   3.940
  126   HD22  LEU  17          HD22      LEU  17 -16.686   0.786   2.980
  127   HD23  LEU  17          HD23      LEU  17 -16.572   0.782   4.740
  128    H    ARG  18           H        ARG  18 -18.286  -2.013   7.530
  129    HA   ARG  18           HA       ARG  18 -16.667  -4.091   6.511
  130    HB2  ARG  18           HB2      ARG  18 -15.827  -4.345   8.764
  131    HB3  ARG  18           HB3      ARG  18 -15.980  -2.635   8.405
  132    HG2  ARG  18           HG2      ARG  18 -18.221  -2.769   9.611
  133    HG3  ARG  18           HG3      ARG  18 -17.657  -4.327  10.214
  134    HD2  ARG  18           HD2      ARG  18 -16.141  -1.742  10.529
  135    HD3  ARG  18           HD3      ARG  18 -17.233  -2.394  11.745
  136    HE   ARG  18           HE       ARG  18 -15.102  -4.181  10.920
  137   HH11  ARG  18          HH11      ARG  18 -16.179  -1.737  13.185
  138   HH12  ARG  18          HH12      ARG  18 -15.018  -2.156  14.401
  139   HH21  ARG  18          HH21      ARG  18 -13.569  -4.750  12.538
  140   HH22  ARG  18          HH22      ARG  18 -13.545  -3.884  14.040
  141    H    GLU  19           H        GLU  19 -19.695  -3.944   8.245
  142    HA   GLU  19           HA       GLU  19 -20.083  -6.521   9.051
  143    HB2  GLU  19           HB2      GLU  19 -21.710  -4.814   9.518
  144    HB3  GLU  19           HB3      GLU  19 -22.064  -4.627   7.808
  145    HG2  GLU  19           HG2      GLU  19 -23.833  -5.831   8.896
  146    HG3  GLU  19           HG3      GLU  19 -22.993  -6.881   7.761
  147    H    LEU  20           H        LEU  20 -21.000  -5.175   5.893
  148    HA   LEU  20           HA       LEU  20 -21.736  -7.636   4.731
  149    HB2  LEU  20           HB2      LEU  20 -21.553  -4.871   3.958
  150    HB3  LEU  20           HB3      LEU  20 -20.943  -5.901   2.677
  151    HG   LEU  20           HG       LEU  20 -23.624  -6.373   3.951
  152   HD11  LEU  20          HD11      LEU  20 -23.578  -4.102   3.051
  153   HD12  LEU  20          HD12      LEU  20 -24.618  -5.161   2.098
  154   HD13  LEU  20          HD13      LEU  20 -23.016  -4.731   1.502
  155   HD21  LEU  20          HD21      LEU  20 -22.659  -8.231   2.715
  156   HD22  LEU  20          HD22      LEU  20 -22.419  -7.189   1.314
  157   HD23  LEU  20          HD23      LEU  20 -24.052  -7.567   1.862
  158    H    TYR  21           H        TYR  21 -18.677  -5.941   4.923
  159    HA   TYR  21           HA       TYR  21 -17.359  -7.405   2.875
  160    HB2  TYR  21           HB2      TYR  21 -16.535  -5.226   3.628
  161    HB3  TYR  21           HB3      TYR  21 -16.243  -5.871   5.236
  162    HD1  TYR  21           HD1      TYR  21 -13.924  -5.253   5.254
  163    HD2  TYR  21           HD2      TYR  21 -15.425  -7.786   2.189
  164    HE1  TYR  21           HE1      TYR  21 -11.625  -5.838   4.631
  165    HE2  TYR  21           HE2      TYR  21 -13.123  -8.378   1.549
  166    HH   TYR  21           HH       TYR  21 -10.856  -7.465   1.736
  167    H    LEU  22           H        LEU  22 -17.406  -7.636   6.397
  168    HA   LEU  22           HA       LEU  22 -15.706  -9.872   6.606
  169    HB2  LEU  22           HB2      LEU  22 -17.923  -9.131   8.506
  170    HB3  LEU  22           HB3      LEU  22 -16.456 -10.013   8.872
  171    HG   LEU  22           HG       LEU  22 -16.547  -7.123   8.037
  172   HD11  LEU  22          HD11      LEU  22 -16.152  -8.305  10.773
  173   HD12  LEU  22          HD12      LEU  22 -17.595  -7.465  10.204
  174   HD13  LEU  22          HD13      LEU  22 -16.068  -6.596  10.346
  175   HD21  LEU  22          HD21      LEU  22 -14.275  -8.750   9.154
  176   HD22  LEU  22          HD22      LEU  22 -14.235  -7.043   8.701
  177   HD23  LEU  22          HD23      LEU  22 -14.461  -8.280   7.464
  178    H    ALA  23           H        ALA  23 -19.125  -9.553   5.994
  179    HA   ALA  23           HA       ALA  23 -19.742 -12.301   6.529
  180    HB1  ALA  23           HB1      ALA  23 -21.407 -10.511   6.794
  181    HB2  ALA  23           HB2      ALA  23 -21.955 -11.779   5.698
  182    HB3  ALA  23           HB3      ALA  23 -21.376 -10.243   5.052
  183    H    ASN  24           H        ASN  24 -18.888 -10.429   3.672
  184    HA   ASN  24           HA       ASN  24 -19.432 -12.783   2.011
  185    HB2  ASN  24           HB2      ASN  24 -19.469  -9.843   1.458
  186    HB3  ASN  24           HB3      ASN  24 -19.219 -10.975   0.138
  187   HD21  ASN  24          HD21      ASN  24 -21.433  -9.906   2.602
  188   HD22  ASN  24          HD22      ASN  24 -22.849 -10.622   1.915
  189    H    LYS  25           H        LYS  25 -16.873 -11.555   3.568
  190    HA   LYS  25           HA       LYS  25 -14.934 -11.993   1.452
  191    HB2  LYS  25           HB2      LYS  25 -13.243 -11.579   3.114
  192    HB3  LYS  25           HB3      LYS  25 -14.505 -10.370   3.304
  193    HG2  LYS  25           HG2      LYS  25 -15.433 -11.651   5.185
  194    HG3  LYS  25           HG3      LYS  25 -14.135 -12.832   5.002
  195    HD2  LYS  25           HD2      LYS  25 -13.764  -9.901   5.628
  196    HD3  LYS  25           HD3      LYS  25 -13.680 -11.217   6.799
  197    HE2  LYS  25           HE2      LYS  25 -11.869 -10.844   4.415
  198    HE3  LYS  25           HE3      LYS  25 -11.454 -10.507   6.094
  199    HZ1  LYS  25           HZ1      LYS  25 -11.688 -12.834   6.611
  200    HZ2  LYS  25           HZ2      LYS  25 -10.609 -12.657   5.324
  201    HZ3  LYS  25           HZ3      LYS  25 -12.187 -13.184   5.034
  202    H    ASP  26           H        ASP  26 -16.792 -13.838   3.509
  203    HA   ASP  26           HA       ASP  26 -14.946 -15.918   4.149
  204    HB2  ASP  26           HB2      ASP  26 -16.978 -15.384   5.490
  205    HB3  ASP  26           HB3      ASP  26 -17.968 -15.997   4.171
  206    H    VAL  27           H        VAL  27 -17.245 -15.324   1.595
  207    HA   VAL  27           HA       VAL  27 -17.009 -17.893   0.365
  208    HB   VAL  27           HB       VAL  27 -19.027 -16.620  -0.008
  209   HG11  VAL  27          HG11      VAL  27 -19.027 -14.534  -1.262
  210   HG12  VAL  27          HG12      VAL  27 -17.264 -14.544  -1.251
  211   HG13  VAL  27          HG13      VAL  27 -18.154 -14.406   0.263
  212   HG21  VAL  27          HG21      VAL  27 -17.405 -16.778  -2.543
  213   HG22  VAL  27          HG22      VAL  27 -19.162 -16.651  -2.451
  214   HG23  VAL  27          HG23      VAL  27 -18.347 -18.084  -1.825
  215    H    GLU  28           H        GLU  28 -15.744 -18.440  -1.433
  216    HA   GLU  28           HA       GLU  28 -13.373 -16.725  -1.663
  217    HB2  GLU  28           HB2      GLU  28 -13.627 -19.700  -2.122
  218    HB3  GLU  28           HB3      GLU  28 -12.135 -18.768  -2.143
  219    HG2  GLU  28           HG2      GLU  28 -12.248 -18.339   0.167
  220    HG3  GLU  28           HG3      GLU  28 -13.918 -18.897   0.267
  221    H    GLY  29           H        GLY  29 -12.585 -16.104  -3.599
  222    HA2  GLY  29           HA2      GLY  29 -12.312 -15.938  -5.878
  223    HA3  GLY  29           HA3      GLY  29 -13.251 -17.412  -6.053
  224    H    GLN  30           H        GLN  30 -14.644 -14.826  -4.283
  225    HA   GLN  30           HA       GLN  30 -16.469 -14.314  -6.522
  226    HB2  GLN  30           HB2      GLN  30 -17.910 -15.110  -4.965
  227    HB3  GLN  30           HB3      GLN  30 -16.811 -14.794  -3.641
  228    HG2  GLN  30           HG2      GLN  30 -18.251 -12.514  -4.901
  229    HG3  GLN  30           HG3      GLN  30 -19.116 -13.585  -3.800
  230   HE21  GLN  30          HE21      GLN  30 -19.376 -12.042  -2.198
  231   HE22  GLN  30          HE22      GLN  30 -18.049 -11.436  -1.277
  232    H    ASP  31           H        ASP  31 -17.373 -12.088  -6.641
  233    HA   ASP  31           HA       ASP  31 -15.366 -10.065  -6.180
  234    HB2  ASP  31           HB2      ASP  31 -18.194  -9.898  -7.234
  235    HB3  ASP  31           HB3      ASP  31 -17.117  -8.511  -7.103
  236    H    VAL  32           H        VAL  32 -15.111  -9.790  -3.996
  237    HA   VAL  32           HA       VAL  32 -17.280  -9.743  -2.175
  238    HB   VAL  32           HB       VAL  32 -14.881 -10.278  -1.589
  239   HG11  VAL  32          HG11      VAL  32 -14.603  -7.276  -1.631
  240   HG12  VAL  32          HG12      VAL  32 -13.766  -8.424  -2.677
  241   HG13  VAL  32          HG13      VAL  32 -13.427  -8.398  -0.945
  242   HG21  VAL  32          HG21      VAL  32 -15.031  -9.252   0.661
  243   HG22  VAL  32          HG22      VAL  32 -16.538 -10.004   0.139
  244   HG23  VAL  32          HG23      VAL  32 -16.361  -8.250   0.081
  245    H    VAL  33           H        VAL  33 -15.667  -7.307  -4.063
  246    HA   VAL  33           HA       VAL  33 -16.462  -5.020  -2.645
  247    HB   VAL  33           HB       VAL  33 -16.316  -4.850  -5.595
  248   HG11  VAL  33          HG11      VAL  33 -15.096  -3.271  -3.355
  249   HG12  VAL  33          HG12      VAL  33 -16.497  -2.831  -4.325
  250   HG13  VAL  33          HG13      VAL  33 -14.901  -2.905  -5.068
  251   HG21  VAL  33          HG21      VAL  33 -14.647  -6.469  -5.401
  252   HG22  VAL  33          HG22      VAL  33 -14.049  -5.794  -3.889
  253   HG23  VAL  33          HG23      VAL  33 -13.775  -4.935  -5.405
  254    H    GLU  34           H        GLU  34 -17.891  -6.544  -5.539
  255    HA   GLU  34           HA       GLU  34 -20.136  -4.865  -5.649
  256    HB2  GLU  34           HB2      GLU  34 -19.553  -7.568  -6.805
  257    HB3  GLU  34           HB3      GLU  34 -21.144  -6.834  -6.982
  258    HG2  GLU  34           HG2      GLU  34 -20.092  -4.866  -8.010
  259    HG3  GLU  34           HG3      GLU  34 -18.527  -5.675  -7.907
  260    H    ALA  35           H        ALA  35 -19.567  -7.883  -3.930
  261    HA   ALA  35           HA       ALA  35 -22.177  -8.453  -3.134
  262    HB1  ALA  35           HB1      ALA  35 -19.655  -8.805  -1.510
  263    HB2  ALA  35           HB2      ALA  35 -20.268  -9.944  -2.709
  264    HB3  ALA  35           HB3      ALA  35 -21.193  -9.629  -1.240
  265    H    ILE  36           H        ILE  36 -19.731  -6.439  -1.561
  266    HA   ILE  36           HA       ILE  36 -21.438  -5.457   0.469
  267    HB   ILE  36           HB       ILE  36 -19.002  -4.099  -0.686
  268   HG12  ILE  36          HG12      ILE  36 -19.100  -6.039   1.626
  269   HG13  ILE  36          HG13      ILE  36 -18.691  -6.526  -0.017
  270   HG21  ILE  36          HG21      ILE  36 -20.340  -2.697   0.793
  271   HG22  ILE  36          HG22      ILE  36 -18.810  -3.128   1.558
  272   HG23  ILE  36          HG23      ILE  36 -20.297  -3.947   2.035
  273   HD11  ILE  36          HD11      ILE  36 -16.808  -4.937   0.029
  274   HD12  ILE  36          HD12      ILE  36 -16.690  -6.207   1.245
  275   HD13  ILE  36          HD13      ILE  36 -17.199  -4.584   1.710
  276    H    LEU  37           H        LEU  37 -20.119  -3.828  -2.391
  277    HA   LEU  37           HA       LEU  37 -21.376  -1.433  -2.406
  278    HB2  LEU  37           HB2      LEU  37 -20.626  -3.312  -4.581
  279    HB3  LEU  37           HB3      LEU  37 -21.475  -1.848  -5.004
  280    HG   LEU  37           HG       LEU  37 -18.942  -1.721  -3.396
  281   HD11  LEU  37          HD11      LEU  37 -19.169  -1.882  -6.399
  282   HD12  LEU  37          HD12      LEU  37 -18.463  -3.115  -5.353
  283   HD13  LEU  37          HD13      LEU  37 -17.704  -1.528  -5.485
  284   HD21  LEU  37          HD21      LEU  37 -18.847   0.484  -4.237
  285   HD22  LEU  37          HD22      LEU  37 -20.542   0.234  -3.807
  286   HD23  LEU  37          HD23      LEU  37 -20.035   0.139  -5.489
  287    H    ALA  38           H        ALA  38 -22.815  -4.463  -3.527
  288    HA   ALA  38           HA       ALA  38 -25.071  -3.056  -4.664
  289    HB1  ALA  38           HB1      ALA  38 -24.523  -6.005  -4.566
  290    HB2  ALA  38           HB2      ALA  38 -23.946  -4.916  -5.826
  291    HB3  ALA  38           HB3      ALA  38 -25.679  -5.173  -5.605
  292    H    HIS  39           H        HIS  39 -24.405  -4.747  -1.692
  293    HA   HIS  39           HA       HIS  39 -27.241  -5.315  -1.345
  294    HB2  HIS  39           HB2      HIS  39 -24.810  -6.136   0.200
  295    HB3  HIS  39           HB3      HIS  39 -26.426  -6.332   0.872
  296    HD1  HIS  39           HD1      HIS  39 -27.976  -8.087  -0.251
  297    HD2  HIS  39           HD2      HIS  39 -24.158  -7.900  -1.877
  298    HE1  HIS  39           HE1      HIS  39 -27.736 -10.162  -1.649
  299    HE2  HIS  39           HE2      HIS  39 -25.488  -9.931  -2.767
  300    H    LEU  40           H        LEU  40 -24.865  -3.029  -0.047
  301    HA   LEU  40           HA       LEU  40 -26.965  -2.170   1.796
  302    HB2  LEU  40           HB2      LEU  40 -25.446  -0.990   3.075
  303    HB3  LEU  40           HB3      LEU  40 -24.559  -2.411   2.594
  304    HG   LEU  40           HG       LEU  40 -24.223   0.244   1.206
  305   HD11  LEU  40          HD11      LEU  40 -23.731   0.522   3.584
  306   HD12  LEU  40          HD12      LEU  40 -22.271   0.617   2.597
  307   HD13  LEU  40          HD13      LEU  40 -22.625  -0.851   3.512
  308   HD21  LEU  40          HD21      LEU  40 -22.036  -0.702   0.603
  309   HD22  LEU  40          HD22      LEU  40 -23.381  -1.646  -0.044
  310   HD23  LEU  40          HD23      LEU  40 -22.500  -2.219   1.375
  311    H    ASN  41           H        ASN  41 -28.391  -1.416   0.253
  312    HA   ASN  41           HA       ASN  41 -27.601   0.768  -1.490
  313    HB2  ASN  41           HB2      ASN  41 -30.334  -0.443  -0.998
  314    HB3  ASN  41           HB3      ASN  41 -29.930   0.689  -2.283
  315   HD21  ASN  41          HD21      ASN  41 -28.529  -0.015  -3.962
  316   HD22  ASN  41          HD22      ASN  41 -28.363  -1.699  -4.329
  317    H    THR  42           H        THR  42 -27.223   1.296   1.185
  318    HA   THR  42           HA       THR  42 -29.406   2.972   2.118
  319    HB   THR  42           HB       THR  42 -28.335   1.515   3.749
  320    HG1  THR  42           HG1      THR  42 -27.398   3.364   5.146
  321   HG21  THR  42          HG21      THR  42 -25.774   3.004   3.149
  322   HG22  THR  42          HG22      THR  42 -26.135   1.351   2.649
  323   HG23  THR  42          HG23      THR  42 -25.989   1.738   4.364
  324    H    VAL  43           H        VAL  43 -26.293   3.192   0.618
  325    HA   VAL  43           HA       VAL  43 -26.445   6.112   0.672
  326    HB   VAL  43           HB       VAL  43 -24.907   5.587   2.450
  327   HG11  VAL  43          HG11      VAL  43 -23.375   3.924   0.474
  328   HG12  VAL  43          HG12      VAL  43 -24.370   3.298   1.785
  329   HG13  VAL  43          HG13      VAL  43 -22.922   4.238   2.147
  330   HG21  VAL  43          HG21      VAL  43 -22.883   6.687   1.684
  331   HG22  VAL  43          HG22      VAL  43 -24.310   7.475   1.009
  332   HG23  VAL  43          HG23      VAL  43 -23.345   6.395   0.008
  333    HA   PRO  44           HA       PRO  44 -25.484   5.384  -3.633
  334    HB2  PRO  44           HB2      PRO  44 -25.652   7.937  -4.448
  335    HB3  PRO  44           HB3      PRO  44 -27.090   7.000  -4.027
  336    HG2  PRO  44           HG2      PRO  44 -25.627   9.048  -2.413
  337    HG3  PRO  44           HG3      PRO  44 -27.370   8.798  -2.585
  338    HD2  PRO  44           HD2      PRO  44 -25.892   7.910  -0.451
  339    HD3  PRO  44           HD3      PRO  44 -27.419   7.178  -0.977
  340    H    ARG  45           H        ARG  45 -23.345   4.744  -3.541
  341    HA   ARG  45           HA       ARG  45 -21.384   6.852  -3.934
  342    HB2  ARG  45           HB2      ARG  45 -19.891   5.342  -2.302
  343    HB3  ARG  45           HB3      ARG  45 -20.843   6.706  -1.727
  344    HG2  ARG  45           HG2      ARG  45 -21.452   5.104  -0.221
  345    HG3  ARG  45           HG3      ARG  45 -22.697   4.860  -1.449
  346    HD2  ARG  45           HD2      ARG  45 -20.896   3.231  -2.442
  347    HD3  ARG  45           HD3      ARG  45 -20.334   3.211  -0.772
  348    HE   ARG  45           HE       ARG  45 -22.461   2.333  -0.118
  349   HH11  ARG  45          HH11      ARG  45 -21.849   2.358  -3.573
  350   HH12  ARG  45          HH12      ARG  45 -22.959   1.068  -3.900
  351   HH21  ARG  45          HH21      ARG  45 -23.945   0.638  -0.576
  352   HH22  ARG  45          HH22      ARG  45 -24.121   0.075  -2.208
  353    H    THR  46           H        THR  46 -19.546   6.224  -5.045
  354    HA   THR  46           HA       THR  46 -20.059   4.244  -7.001
  355    HB   THR  46           HB       THR  46 -18.884   6.342  -7.514
  356    HG1  THR  46           HG1      THR  46 -17.926   5.304  -9.085
  357   HG21  THR  46          HG21      THR  46 -16.538   6.647  -6.880
  358   HG22  THR  46          HG22      THR  46 -16.593   5.159  -5.935
  359   HG23  THR  46          HG23      THR  46 -17.567   6.544  -5.451
  360    H    ARG  47           H        ARG  47 -18.166   2.811  -7.725
  361    HA   ARG  47           HA       ARG  47 -17.877   0.658  -5.978
  362    HB2  ARG  47           HB2      ARG  47 -16.747   1.477  -8.587
  363    HB3  ARG  47           HB3      ARG  47 -15.820   0.279  -7.700
  364    HG2  ARG  47           HG2      ARG  47 -17.435  -0.653  -9.348
  365    HG3  ARG  47           HG3      ARG  47 -17.629  -1.253  -7.702
  366    HD2  ARG  47           HD2      ARG  47 -19.801  -0.823  -8.594
  367    HD3  ARG  47           HD3      ARG  47 -19.458   0.413  -7.390
  368    HE   ARG  47           HE       ARG  47 -18.718   1.641  -9.649
  369   HH11  ARG  47          HH11      ARG  47 -21.589  -0.234  -8.918
  370   HH12  ARG  47          HH12      ARG  47 -22.621   0.723  -9.936
  371   HH21  ARG  47          HH21      ARG  47 -20.082   2.900 -10.976
  372   HH22  ARG  47          HH22      ARG  47 -21.767   2.501 -11.102
  373    H    LYS  48           H        LYS  48 -15.754   3.351  -6.677
  374    HA   LYS  48           HA       LYS  48 -13.456   2.487  -5.343
  375    HB2  LYS  48           HB2      LYS  48 -12.790   4.334  -6.413
  376    HB3  LYS  48           HB3      LYS  48 -14.439   4.912  -6.568
  377    HG2  LYS  48           HG2      LYS  48 -14.289   5.884  -4.314
  378    HG3  LYS  48           HG3      LYS  48 -12.621   5.330  -4.206
  379    HD2  LYS  48           HD2      LYS  48 -11.958   6.763  -6.012
  380    HD3  LYS  48           HD3      LYS  48 -13.635   7.189  -6.354
  381    HE2  LYS  48           HE2      LYS  48 -13.825   8.337  -4.251
  382    HE3  LYS  48           HE3      LYS  48 -12.214   7.804  -3.770
  383    HZ1  LYS  48           HZ1      LYS  48 -12.790   9.578  -6.085
  384    HZ2  LYS  48           HZ2      LYS  48 -11.262   9.126  -5.526
  385    HZ3  LYS  48           HZ3      LYS  48 -12.253  10.106  -4.573
  386    H    GLN  49           H        GLN  49 -16.451   3.651  -4.088
  387    HA   GLN  49           HA       GLN  49 -15.372   4.771  -1.685
  388    HB2  GLN  49           HB2      GLN  49 -18.189   4.167  -2.565
  389    HB3  GLN  49           HB3      GLN  49 -17.800   4.910  -1.016
  390    HG2  GLN  49           HG2      GLN  49 -16.834   6.059  -3.609
  391    HG3  GLN  49           HG3      GLN  49 -18.408   6.464  -2.941
  392   HE21  GLN  49          HE21      GLN  49 -18.545   7.743  -1.132
  393   HE22  GLN  49          HE22      GLN  49 -17.187   8.616  -0.506
  394    H    ILE  50           H        ILE  50 -16.946   1.675  -2.493
  395    HA   ILE  50           HA       ILE  50 -16.963   0.698   0.165
  396    HB   ILE  50           HB       ILE  50 -17.243  -0.554  -2.512
  397   HG12  ILE  50          HG12      ILE  50 -19.131  -1.680  -1.395
  398   HG13  ILE  50          HG13      ILE  50 -18.639  -0.980   0.136
  399   HG21  ILE  50          HG21      ILE  50 -17.009  -2.833  -1.682
  400   HG22  ILE  50          HG22      ILE  50 -16.475  -2.220  -0.117
  401   HG23  ILE  50          HG23      ILE  50 -15.482  -1.960  -1.553
  402   HD11  ILE  50          HD11      ILE  50 -20.504   0.214  -0.821
  403   HD12  ILE  50          HD12      ILE  50 -19.568   0.525  -2.279
  404   HD13  ILE  50          HD13      ILE  50 -19.076   1.248  -0.748
  405    H    ILE  51           H        ILE  51 -14.620   0.361  -2.482
  406    HA   ILE  51           HA       ILE  51 -12.695  -1.133  -1.104
  407    HB   ILE  51           HB       ILE  51 -12.198   0.963  -3.229
  408   HG12  ILE  51          HG12      ILE  51 -12.711  -2.008  -3.513
  409   HG13  ILE  51          HG13      ILE  51 -13.840  -0.732  -3.955
  410   HG21  ILE  51          HG21      ILE  51 -10.539  -1.389  -2.334
  411   HG22  ILE  51          HG22      ILE  51 -10.179   0.315  -2.054
  412   HG23  ILE  51          HG23      ILE  51 -10.169  -0.331  -3.696
  413   HD11  ILE  51          HD11      ILE  51 -11.137  -1.172  -5.193
  414   HD12  ILE  51          HD12      ILE  51 -12.319   0.050  -5.668
  415   HD13  ILE  51          HD13      ILE  51 -12.679  -1.663  -5.885
  416    H    HIS  52           H        HIS  52 -13.085   2.345  -1.492
  417    HA   HIS  52           HA       HIS  52 -10.796   3.254  -0.277
  418    HB2  HIS  52           HB2      HIS  52 -13.301   4.358  -1.124
  419    HB3  HIS  52           HB3      HIS  52 -12.861   5.056   0.433
  420    HD1  HIS  52           HD1      HIS  52 -11.796   7.234  -0.011
  421    HD2  HIS  52           HD2      HIS  52 -10.613   4.358  -2.762
  422    HE1  HIS  52           HE1      HIS  52  -9.999   8.318  -1.383
  423    HE2  HIS  52           HE2      HIS  52  -9.162   6.500  -2.902
  424    H    HIS  53           H        HIS  53 -13.977   2.911   1.324
  425    HA   HIS  53           HA       HIS  53 -12.914   3.804   3.808
  426    HB2  HIS  53           HB2      HIS  53 -15.508   2.321   3.379
  427    HB3  HIS  53           HB3      HIS  53 -15.090   3.360   4.736
  428    HD1  HIS  53           HD1      HIS  53 -13.894   5.683   2.931
  429    HD2  HIS  53           HD2      HIS  53 -17.612   3.873   2.462
  430    HE1  HIS  53           HE1      HIS  53 -15.258   7.297   1.589
  431    HE2  HIS  53           HE2      HIS  53 -17.579   6.322   1.630
  432    H    LEU  54           H        LEU  54 -13.115   0.700   2.325
  433    HA   LEU  54           HA       LEU  54 -13.028  -0.789   4.780
  434    HB2  LEU  54           HB2      LEU  54 -12.692  -1.571   1.895
  435    HB3  LEU  54           HB3      LEU  54 -12.490  -2.718   3.207
  436    HG   LEU  54           HG       LEU  54 -15.022  -1.148   2.717
  437   HD11  LEU  54          HD11      LEU  54 -14.416  -4.018   2.017
  438   HD12  LEU  54          HD12      LEU  54 -14.504  -2.690   0.859
  439   HD13  LEU  54          HD13      LEU  54 -15.937  -3.163   1.764
  440   HD21  LEU  54          HD21      LEU  54 -14.771  -1.858   5.024
  441   HD22  LEU  54          HD22      LEU  54 -14.399  -3.500   4.507
  442   HD23  LEU  54          HD23      LEU  54 -16.008  -2.834   4.232
  443    H    VAL  55           H        VAL  55 -10.645  -0.032   2.223
  444    HA   VAL  55           HA       VAL  55  -8.530  -1.254   3.725
  445    HB   VAL  55           HB       VAL  55  -6.995  -0.343   2.086
  446   HG11  VAL  55          HG11      VAL  55  -8.196  -2.355   1.492
  447   HG12  VAL  55          HG12      VAL  55  -7.925  -1.363   0.060
  448   HG13  VAL  55          HG13      VAL  55  -9.515  -1.396   0.822
  449   HG21  VAL  55          HG21      VAL  55  -7.972   1.874   1.792
  450   HG22  VAL  55          HG22      VAL  55  -9.355   1.160   0.959
  451   HG23  VAL  55          HG23      VAL  55  -7.747   1.065   0.241
  452    H    GLN  56           H        GLN  56 -10.078   1.800   3.713
  453    HA   GLN  56           HA       GLN  56  -7.971   3.197   5.058
  454    HB2  GLN  56           HB2      GLN  56 -10.815   3.832   4.384
  455    HB3  GLN  56           HB3      GLN  56  -9.932   4.848   5.506
  456    HG2  GLN  56           HG2      GLN  56  -8.225   5.254   3.798
  457    HG3  GLN  56           HG3      GLN  56  -9.117   4.228   2.678
  458   HE21  GLN  56          HE21      GLN  56  -9.366   5.876   1.212
  459   HE22  GLN  56          HE22      GLN  56 -10.432   7.209   1.483
  460    H    MET  57           H        MET  57 -10.775   1.324   6.066
  461    HA   MET  57           HA       MET  57 -10.443   2.159   8.808
  462    HB2  MET  57           HB2      MET  57 -12.256   0.133   7.531
  463    HB3  MET  57           HB3      MET  57 -12.154   0.333   9.273
  464    HG2  MET  57           HG2      MET  57 -12.787   2.725   8.954
  465    HG3  MET  57           HG3      MET  57 -13.065   2.364   7.252
  466    HE1  MET  57           HE1      MET  57 -14.764   0.613   6.398
  467    HE2  MET  57           HE2      MET  57 -16.107  -0.040   7.334
  468    HE3  MET  57           HE3      MET  57 -14.487  -0.699   7.547
  469    H    GLY  58           H        GLY  58  -8.687   0.264   6.888
  470    HA2  GLY  58           HA2      GLY  58  -6.871  -1.043   7.387
  471    HA3  GLY  58           HA3      GLY  58  -7.166  -0.692   9.081
  472    H    LEU  59           H        LEU  59  -9.757  -2.132   7.282
  473    HA   LEU  59           HA       LEU  59  -9.163  -4.663   8.630
  474    HB2  LEU  59           HB2      LEU  59 -11.475  -5.187   8.591
  475    HB3  LEU  59           HB3      LEU  59 -11.336  -3.545   9.183
  476    HG   LEU  59           HG       LEU  59 -11.876  -4.012   6.286
  477   HD11  LEU  59          HD11      LEU  59 -13.858  -4.153   8.551
  478   HD12  LEU  59          HD12      LEU  59 -13.554  -5.381   7.323
  479   HD13  LEU  59          HD13      LEU  59 -14.321  -3.849   6.880
  480   HD21  LEU  59          HD21      LEU  59 -13.256  -1.963   6.644
  481   HD22  LEU  59          HD22      LEU  59 -11.518  -1.759   6.799
  482   HD23  LEU  59          HD23      LEU  59 -12.523  -1.847   8.246
  483    H    ALA  60           H        ALA  60  -9.114  -3.066   5.723
  484    HA   ALA  60           HA       ALA  60  -8.921  -5.632   4.270
  485    HB1  ALA  60           HB1      ALA  60  -9.436  -4.431   2.222
  486    HB2  ALA  60           HB2      ALA  60  -9.582  -2.926   3.125
  487    HB3  ALA  60           HB3      ALA  60 -10.728  -4.234   3.404
  488    H    ASP  61           H        ASP  61  -7.348  -5.511   2.395
  489    HA   ASP  61           HA       ASP  61  -4.832  -4.632   3.508
  490    HB2  ASP  61           HB2      ASP  61  -5.563  -6.240   1.070
  491    HB3  ASP  61           HB3      ASP  61  -3.908  -5.746   1.403
  492    H    SER  62           H        SER  62  -6.230  -4.302   0.242
  493    HA   SER  62           HA       SER  62  -5.285  -1.589   0.014
  494    HB2  SER  62           HB2      SER  62  -4.029  -3.776  -1.655
  495    HB3  SER  62           HB3      SER  62  -3.745  -2.050  -1.853
  496    HG   SER  62           HG       SER  62  -3.238  -2.537   0.655
  497    H    VAL  63           H        VAL  63  -5.730  -0.703  -2.162
  498    HA   VAL  63           HA       VAL  63  -8.267  -1.347  -3.183
  499    HB   VAL  63           HB       VAL  63  -5.971   0.214  -4.380
  500   HG11  VAL  63          HG11      VAL  63  -7.377  -0.634  -6.182
  501   HG12  VAL  63          HG12      VAL  63  -7.547   1.113  -6.007
  502   HG13  VAL  63          HG13      VAL  63  -8.805   0.040  -5.394
  503   HG21  VAL  63          HG21      VAL  63  -6.921   1.199  -2.375
  504   HG22  VAL  63          HG22      VAL  63  -8.540   1.087  -3.063
  505   HG23  VAL  63          HG23      VAL  63  -7.347   2.164  -3.789
  506    H    LYS  64           H        LYS  64  -5.054  -2.334  -4.033
  507    HA   LYS  64           HA       LYS  64  -5.367  -3.470  -6.538
  508    HB2  LYS  64           HB2      LYS  64  -3.698  -4.630  -4.327
  509    HB3  LYS  64           HB3      LYS  64  -3.381  -4.706  -6.047
  510    HG2  LYS  64           HG2      LYS  64  -3.017  -2.274  -6.065
  511    HG3  LYS  64           HG3      LYS  64  -3.272  -2.243  -4.323
  512    HD2  LYS  64           HD2      LYS  64  -1.210  -4.094  -5.415
  513    HD3  LYS  64           HD3      LYS  64  -0.843  -2.370  -5.375
  514    HE2  LYS  64           HE2      LYS  64  -0.028  -3.018  -3.336
  515    HE3  LYS  64           HE3      LYS  64  -1.673  -2.581  -2.891
  516    HZ1  LYS  64           HZ1      LYS  64  -1.056  -4.674  -1.901
  517    HZ2  LYS  64           HZ2      LYS  64  -0.668  -5.326  -3.411
  518    HZ3  LYS  64           HZ3      LYS  64  -2.270  -4.935  -3.047
  519    H    ASP  65           H        ASP  65  -5.797  -4.918  -3.349
  520    HA   ASP  65           HA       ASP  65  -6.129  -7.578  -4.207
  521    HB2  ASP  65           HB2      ASP  65  -5.480  -6.833  -1.903
  522    HB3  ASP  65           HB3      ASP  65  -7.143  -6.319  -1.651
  523    H    PHE  66           H        PHE  66  -8.275  -4.934  -4.299
  524    HA   PHE  66           HA       PHE  66 -10.627  -6.411  -3.587
  525    HB2  PHE  66           HB2      PHE  66  -9.938  -3.625  -4.208
  526    HB3  PHE  66           HB3      PHE  66 -11.562  -4.108  -4.684
  527    HD1  PHE  66           HD1      PHE  66  -9.238  -4.153  -1.792
  528    HD2  PHE  66           HD2      PHE  66 -13.262  -4.097  -3.151
  529    HE1  PHE  66           HE1      PHE  66 -10.010  -3.855   0.515
  530    HE2  PHE  66           HE2      PHE  66 -14.045  -3.810  -0.863
  531    HZ   PHE  66           HZ       PHE  66 -12.418  -3.680   1.000
  532    H    GLN  67           H        GLN  67  -9.504  -4.920  -6.664
  533    HA   GLN  67           HA       GLN  67 -11.031  -6.844  -8.126
  534    HB2  GLN  67           HB2      GLN  67 -12.825  -5.533  -8.819
  535    HB3  GLN  67           HB3      GLN  67 -12.634  -5.215  -7.090
  536    HG2  GLN  67           HG2      GLN  67 -11.763  -3.094  -7.440
  537    HG3  GLN  67           HG3      GLN  67 -11.430  -3.409  -9.146
  538   HE21  GLN  67          HE21      GLN  67 -13.942  -2.838  -6.789
  539   HE22  GLN  67          HE22      GLN  67 -15.159  -2.370  -7.916
  540    H    ARG  68           H        ARG  68  -8.397  -4.835  -8.168
  541    HA   ARG  68           HA       ARG  68  -8.606  -4.528 -11.078
  542    HB2  ARG  68           HB2      ARG  68  -7.657  -2.273 -10.981
  543    HB3  ARG  68           HB3      ARG  68  -9.207  -2.371 -10.160
  544    HG2  ARG  68           HG2      ARG  68  -8.228  -2.198  -8.047
  545    HG3  ARG  68           HG3      ARG  68  -6.618  -2.579  -8.666
  546    HD2  ARG  68           HD2      ARG  68  -8.181  -0.105  -9.396
  547    HD3  ARG  68           HD3      ARG  68  -6.957  -0.167  -8.127
  548    HE   ARG  68           HE       ARG  68  -5.424  -0.929 -10.009
  549   HH11  ARG  68          HH11      ARG  68  -8.132   1.252 -10.516
  550   HH12  ARG  68          HH12      ARG  68  -7.398   2.047 -11.869
  551   HH21  ARG  68          HH21      ARG  68  -4.469   0.118 -11.789
  552   HH22  ARG  68          HH22      ARG  68  -5.309   1.396 -12.600
  553    H    LYS  69           H        LYS  69  -6.495  -3.726 -12.017
  554    HA   LYS  69           HA       LYS  69  -4.479  -5.603 -11.532
  555    HB2  LYS  69           HB2      LYS  69  -4.792  -4.492 -13.690
  556    HB3  LYS  69           HB3      LYS  69  -4.352  -2.948 -12.974
  557    HG2  LYS  69           HG2      LYS  69  -2.100  -3.602 -12.706
  558    HG3  LYS  69           HG3      LYS  69  -2.478  -5.296 -13.026
  559    HD2  LYS  69           HD2      LYS  69  -1.394  -4.209 -14.951
  560    HD3  LYS  69           HD3      LYS  69  -3.023  -4.768 -15.334
  561    HE2  LYS  69           HE2      LYS  69  -3.848  -2.458 -14.940
  562    HE3  LYS  69           HE3      LYS  69  -2.178  -1.939 -14.713
  563    HZ1  LYS  69           HZ1      LYS  69  -1.674  -2.559 -16.960
  564    HZ2  LYS  69           HZ2      LYS  69  -3.035  -1.551 -16.979
  565    HZ3  LYS  69           HZ3      LYS  69  -3.217  -3.216 -17.180
  566    H    GLY  70           H        GLY  70  -2.768  -5.619 -10.251
  567    HA2  GLY  70           HA2      GLY  70  -2.658  -4.179  -7.917
  568    HA3  GLY  70           HA3      GLY  70  -1.298  -5.053  -8.597
  569    H    THR  71           H        THR  71  -2.440  -2.098  -7.645
  570    HA   THR  71           HA       THR  71  -0.152  -0.766  -8.916
  571    HB   THR  71           HB       THR  71  -1.433   1.372  -8.302
  572    HG1  THR  71           HG1      THR  71  -3.043   0.450  -7.012
  573   HG21  THR  71          HG21      THR  71  -2.732   1.314 -10.375
  574   HG22  THR  71          HG22      THR  71  -2.548  -0.439 -10.447
  575   HG23  THR  71          HG23      THR  71  -1.133   0.604 -10.604
  576    H    HIS  72           H        HIS  72   1.460  -0.765  -7.467
  577    HA   HIS  72           HA       HIS  72   1.148  -1.012  -4.663
  578    HB2  HIS  72           HB2      HIS  72   3.474  -1.001  -4.567
  579    HB3  HIS  72           HB3      HIS  72   3.228  -1.444  -6.254
  580    HD1  HIS  72           HD1      HIS  72   4.130   1.533  -4.117
  581    HD2  HIS  72           HD2      HIS  72   4.211   0.373  -8.093
  582    HE1  HIS  72           HE1      HIS  72   5.191   3.428  -5.351
  583    HE2  HIS  72           HE2      HIS  72   5.638   2.482  -7.656
  584    H    ILE  73           H        ILE  73   0.109   1.482  -6.312
  585    HA   ILE  73           HA       ILE  73   1.361   3.625  -6.631
  586    HB   ILE  73           HB       ILE  73  -1.250   3.393  -5.288
  587   HG12  ILE  73          HG12      ILE  73  -0.537   3.149  -7.791
  588   HG13  ILE  73          HG13      ILE  73  -2.063   3.939  -7.372
  589   HG21  ILE  73          HG21      ILE  73  -0.609   5.347  -4.179
  590   HG22  ILE  73          HG22      ILE  73  -1.495   5.917  -5.596
  591   HG23  ILE  73          HG23      ILE  73   0.270   5.947  -5.583
  592   HD11  ILE  73          HD11      ILE  73  -1.002   6.108  -7.627
  593   HD12  ILE  73          HD12      ILE  73  -0.840   5.149  -9.099
  594   HD13  ILE  73          HD13      ILE  73   0.528   5.324  -8.002
  595    H    VAL  74           H        VAL  74   3.014   4.482  -5.865
  596    HA   VAL  74           HA       VAL  74   3.830   4.982  -3.275
  597    HB   VAL  74           HB       VAL  74   5.422   5.517  -4.896
  598   HG11  VAL  74          HG11      VAL  74   3.264   7.044  -6.344
  599   HG12  VAL  74          HG12      VAL  74   4.041   5.543  -6.854
  600   HG13  VAL  74          HG13      VAL  74   4.962   7.047  -6.817
  601   HG21  VAL  74          HG21      VAL  74   5.313   7.298  -3.207
  602   HG22  VAL  74          HG22      VAL  74   4.219   8.200  -4.259
  603   HG23  VAL  74          HG23      VAL  74   5.880   7.894  -4.767
  604    H    LEU  75           H        LEU  75   3.056   6.210  -1.730
  605    HA   LEU  75           HA       LEU  75   0.534   7.234  -1.652
  606    HB2  LEU  75           HB2      LEU  75   1.414   8.585   0.323
  607    HB3  LEU  75           HB3      LEU  75   1.630   6.841   0.371
  608    HG   LEU  75           HG       LEU  75   3.902   8.090  -0.884
  609   HD11  LEU  75          HD11      LEU  75   4.773   9.290   1.039
  610   HD12  LEU  75          HD12      LEU  75   3.288   8.979   1.938
  611   HD13  LEU  75          HD13      LEU  75   3.256  10.014   0.511
  612   HD21  LEU  75          HD21      LEU  75   5.104   6.830   0.841
  613   HD22  LEU  75          HD22      LEU  75   3.870   5.836   0.071
  614   HD23  LEU  75          HD23      LEU  75   3.585   6.507   1.675
  615    H    TRP  76           H        TRP  76  -0.152   8.574  -3.198
  616    HA   TRP  76           HA       TRP  76   1.454  10.817  -4.057
  617    HB2  TRP  76           HB2      TRP  76  -1.018   9.452  -5.024
  618    HB3  TRP  76           HB3      TRP  76  -0.745  11.127  -5.511
  619    HD1  TRP  76           HD1      TRP  76   0.034   7.690  -6.522
  620    HE1  TRP  76           HE1      TRP  76   1.827   7.665  -8.379
  621    HE3  TRP  76           HE3      TRP  76   1.684  12.482  -6.097
  622    HZ2  TRP  76           HZ2      TRP  76   3.693   9.445  -9.493
  623    HZ3  TRP  76           HZ3      TRP  76   3.477  13.250  -7.591
  624    HH2  TRP  76           HH2      TRP  76   4.465  11.762  -9.250
  625    H    THR  77           H        THR  77   1.440  12.556  -2.833
  626    HA   THR  77           HA       THR  77  -1.094  13.477  -1.668
  627    HB   THR  77           HB       THR  77   0.301  14.926  -0.229
  628    HG1  THR  77           HG1      THR  77   2.670  13.655  -0.670
  629   HG21  THR  77          HG21      THR  77  -0.329  12.725   0.612
  630   HG22  THR  77          HG22      THR  77   1.292  13.147   1.165
  631   HG23  THR  77          HG23      THR  77   1.084  12.007  -0.165
  632    H    GLY  78           H        GLY  78  -1.245  15.953  -1.608
  633    HA2  GLY  78           HA2      GLY  78  -1.493  16.895  -4.206
  634    HA3  GLY  78           HA3      GLY  78  -1.483  17.912  -2.777
  635    H    ASP  79           H        ASP  79   1.105  17.554  -1.885
  636    HA   ASP  79           HA       ASP  79   2.539  19.322  -3.563
  637    HB2  ASP  79           HB2      ASP  79   3.430  17.641  -1.220
  638    HB3  ASP  79           HB3      ASP  79   4.490  18.776  -2.048
  639    H    GLN  80           H        GLN  80   2.674  15.839  -3.085
  640    HA   GLN  80           HA       GLN  80   5.051  15.434  -4.575
  641    HB2  GLN  80           HB2      GLN  80   4.026  13.850  -2.880
  642    HB3  GLN  80           HB3      GLN  80   2.872  13.402  -4.127
  643    HG2  GLN  80           HG2      GLN  80   4.688  12.643  -5.557
  644    HG3  GLN  80           HG3      GLN  80   5.860  13.124  -4.329
  645   HE21  GLN  80          HE21      GLN  80   3.384  10.858  -5.187
  646   HE22  GLN  80          HE22      GLN  80   3.732   9.696  -3.961
  647    H    GLU  81           H        GLU  81   1.604  15.297  -5.397
  648    HA   GLU  81           HA       GLU  81   1.895  14.474  -8.070
  649    HB2  GLU  81           HB2      GLU  81  -0.184  16.310  -6.875
  650    HB3  GLU  81           HB3      GLU  81  -0.301  15.542  -8.449
  651    HG2  GLU  81           HG2      GLU  81  -0.331  13.354  -7.388
  652    HG3  GLU  81           HG3      GLU  81  -0.195  14.118  -5.803
  653    H    LEU  82           H        LEU  82   2.235  17.560  -6.483
  654    HA   LEU  82           HA       LEU  82   2.206  19.190  -8.787
  655    HB2  LEU  82           HB2      LEU  82   1.879  20.014  -6.475
  656    HB3  LEU  82           HB3      LEU  82   3.578  19.712  -6.154
  657    HG   LEU  82           HG       LEU  82   4.048  21.300  -8.108
  658   HD11  LEU  82          HD11      LEU  82   1.176  22.033  -7.555
  659   HD12  LEU  82          HD12      LEU  82   1.809  21.334  -9.045
  660   HD13  LEU  82          HD13      LEU  82   2.304  22.953  -8.552
  661   HD21  LEU  82          HD21      LEU  82   2.810  22.339  -5.568
  662   HD22  LEU  82          HD22      LEU  82   3.858  23.253  -6.655
  663   HD23  LEU  82          HD23      LEU  82   4.487  21.848  -5.794
  664    H    GLU  83           H        GLU  83   4.786  17.458  -7.089
  665    HA   GLU  83           HA       GLU  83   7.029  18.509  -8.365
  666    HB2  GLU  83           HB2      GLU  83   6.687  15.545  -7.950
  667    HB3  GLU  83           HB3      GLU  83   8.167  16.481  -7.910
  668    HG2  GLU  83           HG2      GLU  83   7.569  17.427  -5.790
  669    HG3  GLU  83           HG3      GLU  83   5.993  16.629  -5.845
  670    H    LEU  84           H        LEU  84   5.083  15.715  -9.233
  671    HA   LEU  84           HA       LEU  84   6.333  15.183 -11.691
  672    HB2  LEU  84           HB2      LEU  84   5.080  13.518 -10.429
  673    HB3  LEU  84           HB3      LEU  84   3.599  14.424 -10.660
  674    HG   LEU  84           HG       LEU  84   3.580  13.923 -13.014
  675   HD11  LEU  84          HD11      LEU  84   5.301  12.605 -14.084
  676   HD12  LEU  84          HD12      LEU  84   6.200  12.501 -12.570
  677   HD13  LEU  84          HD13      LEU  84   6.009  14.058 -13.379
  678   HD21  LEU  84          HD21      LEU  84   2.653  12.228 -11.526
  679   HD22  LEU  84          HD22      LEU  84   4.236  11.462 -11.391
  680   HD23  LEU  84          HD23      LEU  84   3.393  11.479 -12.941
  681    H    GLN  85           H        GLN  85   3.385  16.959 -10.863
  682    HA   GLN  85           HA       GLN  85   2.429  17.392 -13.442
  683    HB2  GLN  85           HB2      GLN  85   1.274  17.858 -11.216
  684    HB3  GLN  85           HB3      GLN  85   2.163  19.374 -11.185
  685    HG2  GLN  85           HG2      GLN  85   0.792  18.975 -13.704
  686    HG3  GLN  85           HG3      GLN  85  -0.308  18.918 -12.333
  687   HE21  GLN  85          HE21      GLN  85   2.623  20.834 -12.383
  688   HE22  GLN  85          HE22      GLN  85   1.836  22.370 -12.421
  689    H    ARG  86           H        ARG  86   4.465  19.570 -11.449
  690    HA   ARG  86           HA       ARG  86   4.658  21.532 -13.484
  691    HB2  ARG  86           HB2      ARG  86   6.353  21.054 -11.035
  692    HB3  ARG  86           HB3      ARG  86   6.546  22.441 -12.099
  693    HG2  ARG  86           HG2      ARG  86   4.128  22.987 -11.635
  694    HG3  ARG  86           HG3      ARG  86   4.180  21.743 -10.386
  695    HD2  ARG  86           HD2      ARG  86   5.927  22.912  -9.211
  696    HD3  ARG  86           HD3      ARG  86   6.050  24.102 -10.507
  697    HE   ARG  86           HE       ARG  86   3.442  24.218  -9.666
  698   HH11  ARG  86          HH11      ARG  86   6.580  24.666  -8.186
  699   HH12  ARG  86          HH12      ARG  86   6.007  25.798  -7.004
  700   HH21  ARG  86          HH21      ARG  86   2.676  25.723  -8.118
  701   HH22  ARG  86          HH22      ARG  86   3.780  26.398  -6.963
  702    H    LEU  87           H        LEU  87   7.021  19.081 -12.387
  703    HA   LEU  87           HA       LEU  87   9.063  19.828 -14.147
  704    HB2  LEU  87           HB2      LEU  87   8.443  17.408 -12.571
  705    HB3  LEU  87           HB3      LEU  87   9.564  17.205 -13.905
  706    HG   LEU  87           HG       LEU  87  10.891  19.125 -12.906
  707   HD11  LEU  87          HD11      LEU  87   9.158  20.014 -11.438
  708   HD12  LEU  87          HD12      LEU  87  10.599  19.550 -10.532
  709   HD13  LEU  87          HD13      LEU  87   9.173  18.513 -10.510
  710   HD21  LEU  87          HD21      LEU  87  11.609  16.825 -12.798
  711   HD22  LEU  87          HD22      LEU  87  10.603  16.552 -11.376
  712   HD23  LEU  87          HD23      LEU  87  11.980  17.650 -11.284
  713    H    PHE  88           H        PHE  88   6.429  17.514 -14.578
  714    HA   PHE  88           HA       PHE  88   7.162  16.418 -16.994
  715    HB2  PHE  88           HB2      PHE  88   5.326  15.418 -15.959
  716    HB3  PHE  88           HB3      PHE  88   4.510  16.959 -15.718
  717    HD1  PHE  88           HD1      PHE  88   2.855  17.621 -17.149
  718    HD2  PHE  88           HD2      PHE  88   5.605  14.634 -18.414
  719    HE1  PHE  88           HE1      PHE  88   1.540  17.286 -19.190
  720    HE2  PHE  88           HE2      PHE  88   4.290  14.293 -20.463
  721    HZ   PHE  88           HZ       PHE  88   2.262  15.628 -20.852
  722    H    GLU  89           H        GLU  89   5.301  19.395 -16.454
  723    HA   GLU  89           HA       GLU  89   5.058  19.796 -19.294
  724    HB2  GLU  89           HB2      GLU  89   4.413  21.786 -17.129
  725    HB3  GLU  89           HB3      GLU  89   3.796  21.724 -18.768
  726    HG2  GLU  89           HG2      GLU  89   2.689  19.591 -18.242
  727    HG3  GLU  89           HG3      GLU  89   3.213  19.787 -16.571
  728    H    GLU  90           H        GLU  90   7.381  20.527 -16.934
  729    HA   GLU  90           HA       GLU  90   8.380  22.894 -18.281
  730    HB2  GLU  90           HB2      GLU  90   9.071  21.400 -15.790
  731    HB3  GLU  90           HB3      GLU  90  10.228  22.549 -16.467
  732    HG2  GLU  90           HG2      GLU  90   8.541  24.309 -16.338
  733    HG3  GLU  90           HG3      GLU  90   7.387  23.155 -15.669
  734    H    PHE  91           H        PHE  91   9.016  19.492 -18.170
  735    HA   PHE  91           HA       PHE  91  11.278  19.919 -20.013
  736    HB2  PHE  91           HB2      PHE  91  10.827  17.656 -18.055
  737    HB3  PHE  91           HB3      PHE  91  12.110  17.685 -19.260
  738    HD1  PHE  91           HD1      PHE  91  13.759  19.639 -19.162
  739    HD2  PHE  91           HD2      PHE  91  11.168  18.590 -15.954
  740    HE1  PHE  91           HE1      PHE  91  15.221  20.845 -17.596
  741    HE2  PHE  91           HE2      PHE  91  12.627  19.795 -14.379
  742    HZ   PHE  91           HZ       PHE  91  14.651  20.926 -15.198
  743    H    ARG  92           H        ARG  92   8.287  19.580 -20.373
  744    HA   ARG  92           HA       ARG  92   7.844  17.052 -21.607
  745    HB2  ARG  92           HB2      ARG  92   6.100  18.697 -20.701
  746    HB3  ARG  92           HB3      ARG  92   6.321  19.587 -22.198
  747    HG2  ARG  92           HG2      ARG  92   5.606  17.627 -23.472
  748    HG3  ARG  92           HG3      ARG  92   5.394  16.729 -21.968
  749    HD2  ARG  92           HD2      ARG  92   3.717  18.338 -21.229
  750    HD3  ARG  92           HD3      ARG  92   3.927  19.259 -22.713
  751    HE   ARG  92           HE       ARG  92   3.255  16.795 -23.612
  752   HH11  ARG  92          HH11      ARG  92   1.833  19.023 -21.325
  753   HH12  ARG  92          HH12      ARG  92   0.224  18.407 -21.514
  754   HH21  ARG  92          HH21      ARG  92   1.104  16.008 -23.919
  755   HH22  ARG  92          HH22      ARG  92  -0.195  16.698 -23.002
  756    H    ASP  93           H        ASP  93   9.018  20.143 -22.658
  757    HA   ASP  93           HA       ASP  93   9.038  19.408 -25.460
  758    HB2  ASP  93           HB2      ASP  93  10.089  21.644 -25.763
  759    HB3  ASP  93           HB3      ASP  93   8.553  21.716 -24.908
  760    H    SER  94           H        SER  94  10.495  17.686 -23.767
  761    HA   SER  94           HA       SER  94  13.231  18.186 -24.726
  762    HB2  SER  94           HB2      SER  94  12.384  16.691 -22.230
  763    HB3  SER  94           HB3      SER  94  14.044  16.890 -22.794
  764    HG   SER  94           HG       SER  94  12.437  19.160 -22.401
  765    H    ASP  95           H        ASP  95  14.440  15.896 -24.640
  766    HA   ASP  95           HA       ASP  95  13.099  14.347 -26.651
  767    HB2  ASP  95           HB2      ASP  95  15.209  12.959 -26.559
  768    HB3  ASP  95           HB3      ASP  95  15.442  14.660 -26.954
  769    H    ASP  96           H        ASP  96  13.361  14.185 -23.265
  770    HA   ASP  96           HA       ASP  96  11.507  12.038 -23.149
  771    HB2  ASP  96           HB2      ASP  96  13.741  10.832 -23.504
  772    HB3  ASP  96           HB3      ASP  96  14.188  11.417 -21.905
  773    H    VAL  97           H        VAL  97  10.251  13.227 -21.828
  774    HA   VAL  97           HA       VAL  97  11.340  14.955 -19.866
  775    HB   VAL  97           HB       VAL  97   9.292  15.665 -20.767
  776   HG11  VAL  97          HG11      VAL  97   8.098  13.023 -19.968
  777   HG12  VAL  97          HG12      VAL  97   8.443  13.570 -21.608
  778   HG13  VAL  97          HG13      VAL  97   7.204  14.383 -20.648
  779   HG21  VAL  97          HG21      VAL  97   9.511  16.101 -18.374
  780   HG22  VAL  97          HG22      VAL  97   8.672  14.590 -18.019
  781   HG23  VAL  97          HG23      VAL  97   7.823  15.901 -18.841
  782    H    LEU  98           H        LEU  98  10.017  11.677 -19.704
  783    HA   LEU  98           HA       LEU  98   9.823  11.595 -16.884
  784    HB2  LEU  98           HB2      LEU  98   9.826   9.546 -19.031
  785    HB3  LEU  98           HB3      LEU  98  10.121   9.014 -17.386
  786    HG   LEU  98           HG       LEU  98   7.978  10.250 -16.771
  787   HD11  LEU  98          HD11      LEU  98   7.636  10.153 -19.754
  788   HD12  LEU  98          HD12      LEU  98   7.728  11.592 -18.740
  789   HD13  LEU  98          HD13      LEU  98   6.355  10.498 -18.593
  790   HD21  LEU  98          HD21      LEU  98   7.811   7.848 -18.585
  791   HD22  LEU  98          HD22      LEU  98   6.586   8.360 -17.422
  792   HD23  LEU  98          HD23      LEU  98   8.167   7.818 -16.857
  793    H    GLY  99           H        GLY  99  12.440  10.835 -19.110
  794    HA2  GLY  99           HA2      GLY  99  14.310   9.829 -17.327
  795    HA3  GLY  99           HA3      GLY  99  14.705  10.852 -18.710
  796    H    HIS 100           H        HIS 100  13.389  13.194 -17.924
  797    HA   HIS 100           HA       HIS 100  15.301  14.253 -16.064
  798    HB2  HIS 100           HB2      HIS 100  13.144  15.351 -17.763
  799    HB3  HIS 100           HB3      HIS 100  13.498  16.256 -16.296
  800    HD1  HIS 100           HD1      HIS 100  15.854  17.345 -16.107
  801    HD2  HIS 100           HD2      HIS 100  15.069  15.517 -19.763
  802    HE1  HIS 100           HE1      HIS 100  17.631  18.177 -17.681
  803    HE2  HIS 100           HE2      HIS 100  17.082  17.141 -19.908
  804    H    ILE 101           H        ILE 101  11.931  13.334 -15.994
  805    HA   ILE 101           HA       ILE 101  11.146  14.502 -13.609
  806    HB   ILE 101           HB       ILE 101  10.211  11.929 -14.892
  807   HG12  ILE 101          HG12      ILE 101   9.010  14.709 -14.771
  808   HG13  ILE 101          HG13      ILE 101   9.833  14.013 -16.161
  809   HG21  ILE 101          HG21      ILE 101   8.259  12.039 -13.428
  810   HG22  ILE 101          HG22      ILE 101   8.950  13.429 -12.594
  811   HG23  ILE 101          HG23      ILE 101   9.742  11.859 -12.489
  812   HD11  ILE 101          HD11      ILE 101   7.286  12.979 -14.939
  813   HD12  ILE 101          HD12      ILE 101   8.098  12.320 -16.356
  814   HD13  ILE 101          HD13      ILE 101   7.410  13.943 -16.410
  815    H    MET 102           H        MET 102  12.874  11.455 -14.129
  816    HA   MET 102           HA       MET 102  12.775  10.793 -11.327
  817    HB2  MET 102           HB2      MET 102  14.349   9.566 -13.585
  818    HB3  MET 102           HB3      MET 102  14.291   8.942 -11.939
  819    HG2  MET 102           HG2      MET 102  11.833   8.747 -12.186
  820    HG3  MET 102           HG3      MET 102  12.023   9.160 -13.885
  821    HE1  MET 102           HE1      MET 102  10.613   6.950 -14.162
  822    HE2  MET 102           HE2      MET 102  10.747   6.455 -12.473
  823    HE3  MET 102           HE3      MET 102  11.197   5.336 -13.764
  824    H    LYS 103           H        LYS 103  15.069  12.331 -13.474
  825    HA   LYS 103           HA       LYS 103  17.286  12.031 -11.677
  826    HB2  LYS 103           HB2      LYS 103  17.006  13.910 -14.028
  827    HB3  LYS 103           HB3      LYS 103  18.502  13.491 -13.209
  828    HG2  LYS 103           HG2      LYS 103  16.759  11.580 -14.750
  829    HG3  LYS 103           HG3      LYS 103  18.253  12.312 -15.332
  830    HD2  LYS 103           HD2      LYS 103  19.512  11.185 -13.591
  831    HD3  LYS 103           HD3      LYS 103  18.024  10.510 -12.924
  832    HE2  LYS 103           HE2      LYS 103  17.656   9.196 -14.892
  833    HE3  LYS 103           HE3      LYS 103  18.987   9.991 -15.732
  834    HZ1  LYS 103           HZ1      LYS 103  19.663   7.830 -14.952
  835    HZ2  LYS 103           HZ2      LYS 103  19.225   8.215 -13.365
  836    HZ3  LYS 103           HZ3      LYS 103  20.515   9.019 -14.102
  837    H    ASN 104           H        ASN 104  14.897  14.523 -12.300
  838    HA   ASN 104           HA       ASN 104  16.350  16.387 -10.548
  839    HB2  ASN 104           HB2      ASN 104  14.045  16.923 -12.437
  840    HB3  ASN 104           HB3      ASN 104  14.961  18.136 -11.553
  841   HD21  ASN 104          HD21      ASN 104  17.530  16.850 -11.998
  842   HD22  ASN 104          HD22      ASN 104  17.923  17.099 -13.664
  843    H    ILE 105           H        ILE 105  14.559  14.077  -9.702
  844    HA   ILE 105           HA       ILE 105  12.277  15.561  -8.598
  845    HB   ILE 105           HB       ILE 105  11.931  13.513 -10.042
  846   HG12  ILE 105          HG12      ILE 105  10.062  12.647  -8.652
  847   HG13  ILE 105          HG13      ILE 105  10.672  13.619  -7.317
  848   HG21  ILE 105          HG21      ILE 105  12.845  12.116  -7.560
  849   HG22  ILE 105          HG22      ILE 105  13.630  12.084  -9.141
  850   HG23  ILE 105          HG23      ILE 105  12.046  11.337  -8.926
  851   HD11  ILE 105          HD11      ILE 105   8.793  14.664  -8.516
  852   HD12  ILE 105          HD12      ILE 105   9.789  14.724  -9.969
  853   HD13  ILE 105          HD13      ILE 105  10.257  15.644  -8.540
  854    H    THR 106           H        THR 106  11.458  14.905  -6.543
  855    HA   THR 106           HA       THR 106  13.457  14.390  -4.532
  856    HB   THR 106           HB       THR 106  10.541  15.101  -4.545
  857    HG1  THR 106           HG1      THR 106  11.464  16.802  -3.152
  858   HG21  THR 106          HG21      THR 106  10.767  13.393  -2.857
  859   HG22  THR 106          HG22      THR 106  10.514  14.971  -2.110
  860   HG23  THR 106          HG23      THR 106  12.124  14.252  -2.135
  861    H    ALA 107           H        ALA 107  10.572  12.774  -5.886
  862    HA   ALA 107           HA       ALA 107  11.038  10.456  -4.151
  863    HB1  ALA 107           HB1      ALA 107   8.799   9.753  -4.749
  864    HB2  ALA 107           HB2      ALA 107   8.678  11.060  -5.927
  865    HB3  ALA 107           HB3      ALA 107   8.773  11.431  -4.204
  866    H    LYS 108           H        LYS 108  11.853   8.609  -4.894
  867    HA   LYS 108           HA       LYS 108  12.454   8.314  -7.704
  868    HB2  LYS 108           HB2      LYS 108  12.909   6.372  -5.427
  869    HB3  LYS 108           HB3      LYS 108  13.612   6.269  -7.031
  870    HG2  LYS 108           HG2      LYS 108  14.129   8.716  -5.425
  871    HG3  LYS 108           HG3      LYS 108  14.957   7.228  -4.977
  872    HD2  LYS 108           HD2      LYS 108  16.404   8.417  -6.448
  873    HD3  LYS 108           HD3      LYS 108  15.745   7.059  -7.357
  874    HE2  LYS 108           HE2      LYS 108  14.240   8.480  -8.534
  875    HE3  LYS 108           HE3      LYS 108  14.609   9.849  -7.485
  876    HZ1  LYS 108           HZ1      LYS 108  16.897   9.778  -8.357
  877    HZ2  LYS 108           HZ2      LYS 108  15.754  10.091  -9.561
  878    HZ3  LYS 108           HZ3      LYS 108  16.443   8.549  -9.429
  879    H    ARG 109           H        ARG 109  10.759   7.820  -8.955
  880    HA   ARG 109           HA       ARG 109   8.946   5.683  -8.047
  881    HB2  ARG 109           HB2      ARG 109   8.328   8.001  -9.889
  882    HB3  ARG 109           HB3      ARG 109   7.207   6.710  -9.464
  883    HG2  ARG 109           HG2      ARG 109   7.200   7.415  -7.159
  884    HG3  ARG 109           HG3      ARG 109   8.435   8.629  -7.491
  885    HD2  ARG 109           HD2      ARG 109   5.759   8.609  -8.861
  886    HD3  ARG 109           HD3      ARG 109   6.036   9.459  -7.348
  887    HE   ARG 109           HE       ARG 109   7.291  10.096  -9.933
  888   HH11  ARG 109          HH11      ARG 109   6.502  11.008  -6.636
  889   HH12  ARG 109          HH12      ARG 109   6.905  12.689  -6.861
  890   HH21  ARG 109          HH21      ARG 109   7.777  12.316 -10.237
  891   HH22  ARG 109          HH22      ARG 109   7.605  13.417  -8.911
  892    H    SER 110           H        SER 110   7.725   4.782 -10.116
  893    HA   SER 110           HA       SER 110   9.834   3.856 -11.927
  894    HB2  SER 110           HB2      SER 110   8.608   2.113 -10.715
  895    HB3  SER 110           HB3      SER 110   7.083   2.719 -11.354
  896    HG   SER 110           HG       SER 110   9.204   1.458 -12.751
  897    H    ARG 111           H        ARG 111   9.311   3.564 -14.221
  898    HA   ARG 111           HA       ARG 111   8.246   5.882 -15.405
  899    HB2  ARG 111           HB2      ARG 111   8.595   3.169 -16.700
  900    HB3  ARG 111           HB3      ARG 111   8.422   4.703 -17.537
  901    HG2  ARG 111           HG2      ARG 111  10.707   3.979 -15.718
  902    HG3  ARG 111           HG3      ARG 111  10.740   3.876 -17.474
  903    HD2  ARG 111           HD2      ARG 111  10.143   6.427 -16.002
  904    HD3  ARG 111           HD3      ARG 111  11.780   5.939 -16.429
  905    HE   ARG 111           HE       ARG 111   9.693   6.867 -18.228
  906   HH11  ARG 111          HH11      ARG 111  12.843   5.394 -17.869
  907   HH12  ARG 111          HH12      ARG 111  13.389   5.859 -19.448
  908   HH21  ARG 111          HH21      ARG 111  10.416   7.483 -20.324
  909   HH22  ARG 111          HH22      ARG 111  12.013   7.063 -20.836
  910    H    ALA 112           H        ALA 112   6.895   2.603 -15.152
  911    HA   ALA 112           HA       ALA 112   4.451   3.114 -16.429
  912    HB1  ALA 112           HB1      ALA 112   3.668   1.054 -15.377
  913    HB2  ALA 112           HB2      ALA 112   5.047   1.084 -14.277
  914    HB3  ALA 112           HB3      ALA 112   5.304   0.859 -16.008
  915    H    ARG 113           H        ARG 113   5.505   3.586 -13.143
  916    HA   ARG 113           HA       ARG 113   2.936   4.042 -12.029
  917    HB2  ARG 113           HB2      ARG 113   4.726   3.320 -10.609
  918    HB3  ARG 113           HB3      ARG 113   5.734   4.675 -11.087
  919    HG2  ARG 113           HG2      ARG 113   4.718   4.774  -8.791
  920    HG3  ARG 113           HG3      ARG 113   4.476   6.191  -9.811
  921    HD2  ARG 113           HD2      ARG 113   2.501   5.184  -8.432
  922    HD3  ARG 113           HD3      ARG 113   2.236   5.797 -10.060
  923    HE   ARG 113           HE       ARG 113   2.669   2.916  -9.571
  924   HH11  ARG 113          HH11      ARG 113   0.811   5.560 -10.886
  925   HH12  ARG 113          HH12      ARG 113  -0.342   4.549 -11.694
  926   HH21  ARG 113          HH21      ARG 113   1.185   1.549 -10.687
  927   HH22  ARG 113          HH22      ARG 113  -0.110   2.261 -11.597
  928    H    ILE 114           H        ILE 114   5.395   6.090 -13.458
  929    HA   ILE 114           HA       ILE 114   4.115   8.543 -12.739
  930    HB   ILE 114           HB       ILE 114   6.344   7.899 -14.662
  931   HG12  ILE 114          HG12      ILE 114   6.340   9.385 -12.027
  932   HG13  ILE 114          HG13      ILE 114   6.714   7.675 -12.192
  933   HG21  ILE 114          HG21      ILE 114   5.204   9.857 -15.521
  934   HG22  ILE 114          HG22      ILE 114   6.744  10.330 -14.802
  935   HG23  ILE 114          HG23      ILE 114   5.238  10.607 -13.927
  936   HD11  ILE 114          HD11      ILE 114   8.727   9.051 -12.028
  937   HD12  ILE 114          HD12      ILE 114   8.245   9.920 -13.484
  938   HD13  ILE 114          HD13      ILE 114   8.636   8.204 -13.573
  939    H    VAL 115           H        VAL 115   4.298   6.608 -15.729
  940    HA   VAL 115           HA       VAL 115   2.939   8.478 -17.332
  941    HB   VAL 115           HB       VAL 115   2.617   6.714 -18.967
  942   HG11  VAL 115          HG11      VAL 115   5.314   6.516 -17.642
  943   HG12  VAL 115          HG12      VAL 115   4.814   7.756 -18.793
  944   HG13  VAL 115          HG13      VAL 115   4.939   6.073 -19.306
  945   HG21  VAL 115          HG21      VAL 115   3.600   4.821 -16.841
  946   HG22  VAL 115          HG22      VAL 115   3.322   4.415 -18.535
  947   HG23  VAL 115          HG23      VAL 115   1.968   4.882 -17.507
  948    H    ASP 116           H        ASP 116   1.751   5.801 -15.358
  949    HA   ASP 116           HA       ASP 116  -0.947   5.931 -16.148
  950    HB2  ASP 116           HB2      ASP 116  -0.346   4.036 -14.895
  951    HB3  ASP 116           HB3      ASP 116   0.435   4.998 -13.647
  952    H    LYS 117           H        LYS 117   0.895   7.693 -13.710
  953    HA   LYS 117           HA       LYS 117  -1.421   8.939 -12.617
  954    HB2  LYS 117           HB2      LYS 117   1.520   9.247 -12.200
  955    HB3  LYS 117           HB3      LYS 117   0.417  10.460 -11.556
  956    HG2  LYS 117           HG2      LYS 117   0.034   7.533 -11.028
  957    HG3  LYS 117           HG3      LYS 117   1.095   8.529 -10.033
  958    HD2  LYS 117           HD2      LYS 117  -0.638   9.284  -8.886
  959    HD3  LYS 117           HD3      LYS 117  -1.384   9.893 -10.371
  960    HE2  LYS 117           HE2      LYS 117  -1.643   7.093  -9.275
  961    HE3  LYS 117           HE3      LYS 117  -2.865   8.354  -9.162
  962    HZ1  LYS 117           HZ1      LYS 117  -2.809   8.369 -11.673
  963    HZ2  LYS 117           HZ2      LYS 117  -3.486   7.003 -10.954
  964    HZ3  LYS 117           HZ3      LYS 117  -1.921   6.926 -11.589
  965    H    LEU 118           H        LEU 118   0.843   9.811 -15.168
  966    HA   LEU 118           HA       LEU 118   0.070  12.497 -15.476
  967    HB2  LEU 118           HB2      LEU 118   0.788  10.519 -17.630
  968    HB3  LEU 118           HB3      LEU 118   0.648  12.246 -17.858
  969    HG   LEU 118           HG       LEU 118   2.779  10.715 -16.418
  970   HD11  LEU 118          HD11      LEU 118   2.937  11.131 -18.826
  971   HD12  LEU 118          HD12      LEU 118   4.192  11.987 -17.929
  972   HD13  LEU 118          HD13      LEU 118   2.779  12.863 -18.533
  973   HD21  LEU 118          HD21      LEU 118   3.688  12.810 -15.596
  974   HD22  LEU 118          HD22      LEU 118   2.078  12.555 -14.925
  975   HD23  LEU 118          HD23      LEU 118   2.310  13.693 -16.251
  976    H    LEU 119           H        LEU 119  -1.220   9.544 -16.932
  977    HA   LEU 119           HA       LEU 119  -3.266  10.712 -18.445
  978    HB2  LEU 119           HB2      LEU 119  -2.803   7.985 -17.299
  979    HB3  LEU 119           HB3      LEU 119  -4.349   8.356 -18.034
  980    HG   LEU 119           HG       LEU 119  -2.863   7.214 -19.612
  981   HD11  LEU 119          HD11      LEU 119  -3.089   8.769 -21.473
  982   HD12  LEU 119          HD12      LEU 119  -3.387  10.087 -20.341
  983   HD13  LEU 119          HD13      LEU 119  -4.535   8.754 -20.464
  984   HD21  LEU 119          HD21      LEU 119  -1.071   9.617 -19.274
  985   HD22  LEU 119          HD22      LEU 119  -0.896   8.395 -20.531
  986   HD23  LEU 119          HD23      LEU 119  -0.696   7.952 -18.836
  987    H    ALA 120           H        ALA 120  -3.102   9.736 -15.107
  988    HA   ALA 120           HA       ALA 120  -5.887   9.911 -14.579
  989    HB1  ALA 120           HB1      ALA 120  -5.285   9.650 -12.278
  990    HB2  ALA 120           HB2      ALA 120  -3.619  10.122 -12.614
  991    HB3  ALA 120           HB3      ALA 120  -4.249   8.602 -13.252
  992    H    LEU 121           H        LEU 121  -3.172  12.162 -14.167
  993    HA   LEU 121           HA       LEU 121  -4.726  14.291 -13.084
  994    HB2  LEU 121           HB2      LEU 121  -2.007  13.995 -14.271
  995    HB3  LEU 121           HB3      LEU 121  -2.676  15.605 -14.125
  996    HG   LEU 121           HG       LEU 121  -2.848  15.340 -11.713
  997   HD11  LEU 121          HD11      LEU 121  -1.590  12.636 -12.123
  998   HD12  LEU 121          HD12      LEU 121  -3.243  12.934 -11.588
  999   HD13  LEU 121          HD13      LEU 121  -1.886  13.417 -10.570
 1000   HD21  LEU 121          HD21      LEU 121  -0.405  15.233 -11.252
 1001   HD22  LEU 121          HD22      LEU 121  -0.835  16.280 -12.608
 1002   HD23  LEU 121          HD23      LEU 121  -0.170  14.675 -12.912
 1003    H    GLY 122           H        GLY 122  -4.168  13.077 -16.259
 1004    HA2  GLY 122           HA2      GLY 122  -5.155  13.721 -18.260
 1005    HA3  GLY 122           HA3      GLY 122  -5.835  15.125 -17.443
 1006    H    LEU 123           H        LEU 123  -2.450  14.251 -17.308
 1007    HA   LEU 123           HA       LEU 123  -1.687  16.838 -18.333
 1008    HB2  LEU 123           HB2      LEU 123  -0.113  14.444 -17.401
 1009    HB3  LEU 123           HB3      LEU 123   0.633  15.925 -17.977
 1010    HG   LEU 123           HG       LEU 123  -1.156  15.665 -15.559
 1011   HD11  LEU 123          HD11      LEU 123   0.893  16.276 -14.324
 1012   HD12  LEU 123          HD12      LEU 123   1.804  16.141 -15.828
 1013   HD13  LEU 123          HD13      LEU 123   1.014  14.721 -15.144
 1014   HD21  LEU 123          HD21      LEU 123  -0.550  18.010 -15.132
 1015   HD22  LEU 123          HD22      LEU 123  -1.484  17.818 -16.612
 1016   HD23  LEU 123          HD23      LEU 123   0.259  18.073 -16.697
 1017    H    VAL 124           H        VAL 124  -1.966  13.601 -19.413
 1018    HA   VAL 124           HA       VAL 124  -1.461  14.475 -22.161
 1019    HB   VAL 124           HB       VAL 124  -0.311  12.336 -22.666
 1020   HG11  VAL 124          HG11      VAL 124   1.859  13.007 -21.849
 1021   HG12  VAL 124          HG12      VAL 124   1.115  13.999 -20.597
 1022   HG13  VAL 124          HG13      VAL 124   0.931  14.437 -22.296
 1023   HG21  VAL 124          HG21      VAL 124   0.676  11.074 -20.781
 1024   HG22  VAL 124          HG22      VAL 124  -1.087  11.010 -20.809
 1025   HG23  VAL 124          HG23      VAL 124  -0.263  12.066 -19.664
 1026    H    ALA 125           H        ALA 125  -2.091  12.589 -23.658
 1027    HA   ALA 125           HA       ALA 125  -4.610  11.410 -22.651
 1028    HB1  ALA 125           HB1      ALA 125  -4.955  13.066 -24.429
 1029    HB2  ALA 125           HB2      ALA 125  -5.413  11.448 -24.960
 1030    HB3  ALA 125           HB3      ALA 125  -3.884  12.151 -25.489
 1031    H    GLU 126           H        GLU 126  -1.486  10.785 -23.597
 1032    HA   GLU 126           HA       GLU 126  -1.845   7.952 -23.516
 1033    HB2  GLU 126           HB2      GLU 126  -1.039   7.442 -25.736
 1034    HB3  GLU 126           HB3      GLU 126  -2.482   8.439 -25.862
 1035    HG2  GLU 126           HG2      GLU 126  -1.123  10.398 -26.286
 1036    HG3  GLU 126           HG3      GLU 126   0.344   9.447 -26.087
 1037    H    ARG 127           H        ARG 127   0.389   6.900 -24.144
 1038    HA   ARG 127           HA       ARG 127   2.283   8.210 -22.433
 1039    HB2  ARG 127           HB2      ARG 127   2.015   5.527 -23.625
 1040    HB3  ARG 127           HB3      ARG 127   3.652   6.061 -23.281
 1041    HG2  ARG 127           HG2      ARG 127   2.789   4.799 -21.425
 1042    HG3  ARG 127           HG3      ARG 127   3.010   6.482 -20.955
 1043    HD2  ARG 127           HD2      ARG 127   0.934   5.777 -20.054
 1044    HD3  ARG 127           HD3      ARG 127   0.572   6.834 -21.418
 1045    HE   ARG 127           HE       ARG 127   0.494   4.407 -22.560
 1046   HH11  ARG 127          HH11      ARG 127  -0.972   5.653 -19.632
 1047   HH12  ARG 127          HH12      ARG 127  -2.334   4.582 -19.704
 1048   HH21  ARG 127          HH21      ARG 127  -1.307   2.993 -22.652
 1049   HH22  ARG 127          HH22      ARG 127  -2.527   3.082 -21.420
 1050    H    ARG 128           H        ARG 128   1.867   8.061 -25.875
 1051    HA   ARG 128           HA       ARG 128   4.637   8.253 -26.513
 1052    HB2  ARG 128           HB2      ARG 128   4.025   8.153 -28.687
 1053    HB3  ARG 128           HB3      ARG 128   2.484   7.653 -28.009
 1054    HG2  ARG 128           HG2      ARG 128   1.577   9.849 -28.264
 1055    HG3  ARG 128           HG3      ARG 128   3.154  10.502 -28.716
 1056    HD2  ARG 128           HD2      ARG 128   1.768  10.198 -30.683
 1057    HD3  ARG 128           HD3      ARG 128   3.147   9.100 -30.726
 1058    HE   ARG 128           HE       ARG 128   0.704   7.998 -29.608
 1059   HH11  ARG 128          HH11      ARG 128   2.653   8.445 -32.492
 1060   HH12  ARG 128          HH12      ARG 128   1.954   7.088 -33.323
 1061   HH21  ARG 128          HH21      ARG 128  -0.195   6.214 -30.706
 1062   HH22  ARG 128          HH22      ARG 128   0.343   5.825 -32.311
 1063    H    GLU 129           H        GLU 129   2.254  10.602 -25.606
 1064    HA   GLU 129           HA       GLU 129   3.425  12.867 -26.835
 1065    HB2  GLU 129           HB2      GLU 129   1.722  12.722 -24.351
 1066    HB3  GLU 129           HB3      GLU 129   2.091  14.188 -25.244
 1067    HG2  GLU 129           HG2      GLU 129   0.971  13.165 -27.224
 1068    HG3  GLU 129           HG3      GLU 129   0.469  11.838 -26.172
 1069    H    LEU 130           H        LEU 130   4.147  11.096 -23.976
 1070    HA   LEU 130           HA       LEU 130   5.844  13.218 -22.935
 1071    HB2  LEU 130           HB2      LEU 130   6.190  11.313 -21.123
 1072    HB3  LEU 130           HB3      LEU 130   4.800  12.378 -21.105
 1073    HG   LEU 130           HG       LEU 130   4.552   9.806 -22.586
 1074   HD11  LEU 130          HD11      LEU 130   3.921   8.641 -20.541
 1075   HD12  LEU 130          HD12      LEU 130   4.436  10.033 -19.589
 1076   HD13  LEU 130          HD13      LEU 130   5.618   9.117 -20.524
 1077   HD21  LEU 130          HD21      LEU 130   2.259   9.944 -21.580
 1078   HD22  LEU 130          HD22      LEU 130   2.669  11.278 -22.660
 1079   HD23  LEU 130          HD23      LEU 130   2.716  11.511 -20.908
 1080    H    TYR 131           H        TYR 131   6.145  10.929 -25.191
 1081    HA   TYR 131           HA       TYR 131   9.023  10.586 -24.657
 1082    HB2  TYR 131           HB2      TYR 131   7.156   8.592 -25.956
 1083    HB3  TYR 131           HB3      TYR 131   8.901   8.413 -25.861
 1084    HD1  TYR 131           HD1      TYR 131   6.408   6.755 -24.712
 1085    HD2  TYR 131           HD2      TYR 131   9.327   9.353 -23.043
 1086    HE1  TYR 131           HE1      TYR 131   6.160   5.628 -22.541
 1087    HE2  TYR 131           HE2      TYR 131   9.084   8.244 -20.869
 1088    HH   TYR 131           HH       TYR 131   7.487   5.283 -20.486
 1089    H    LYS 132           H        LYS 132   8.145  12.763 -25.985
 1090    HA   LYS 132           HA       LYS 132   8.528  12.128 -28.826
 1091    HB2  LYS 132           HB2      LYS 132   6.826  14.097 -27.415
 1092    HB3  LYS 132           HB3      LYS 132   7.560  14.642 -28.913
 1093    HG2  LYS 132           HG2      LYS 132   5.738  12.271 -28.547
 1094    HG3  LYS 132           HG3      LYS 132   5.362  13.789 -29.365
 1095    HD2  LYS 132           HD2      LYS 132   7.277  13.253 -30.938
 1096    HD3  LYS 132           HD3      LYS 132   7.283  11.639 -30.231
 1097    HE2  LYS 132           HE2      LYS 132   5.977  11.532 -32.210
 1098    HE3  LYS 132           HE3      LYS 132   4.861  11.459 -30.848
 1099    HZ1  LYS 132           HZ1      LYS 132   4.135  12.952 -32.651
 1100    HZ2  LYS 132           HZ2      LYS 132   5.483  13.933 -32.368
 1101    HZ3  LYS 132           HZ3      LYS 132   4.304  13.747 -31.169
 1102    H    LYS 133           H        LYS 133   9.240  14.426 -29.898
 1103    HA   LYS 133           HA       LYS 133  11.893  14.913 -28.807
 1104    HB2  LYS 133           HB2      LYS 133  10.700  15.998 -31.359
 1105    HB3  LYS 133           HB3      LYS 133  12.403  15.898 -30.933
 1106    HG2  LYS 133           HG2      LYS 133  12.296  13.461 -31.012
 1107    HG3  LYS 133           HG3      LYS 133  10.587  13.547 -31.435
 1108    HD2  LYS 133           HD2      LYS 133  11.215  14.818 -33.473
 1109    HD3  LYS 133           HD3      LYS 133  12.911  14.568 -33.060
 1110    HE2  LYS 133           HE2      LYS 133  12.578  12.145 -33.168
 1111    HE3  LYS 133           HE3      LYS 133  10.884  12.395 -33.583
 1112    HZ1  LYS 133           HZ1      LYS 133  12.228  11.949 -35.539
 1113    HZ2  LYS 133           HZ2      LYS 133  13.207  13.283 -35.199
 1114    HZ3  LYS 133           HZ3      LYS 133  11.583  13.510 -35.608
 1115    H    ARG 134           H        ARG 134  12.667  17.274 -29.013
 1116    HA   ARG 134           HA       ARG 134  11.080  18.917 -27.387
 1117    HB2  ARG 134           HB2      ARG 134  12.727  20.629 -27.627
 1118    HB3  ARG 134           HB3      ARG 134  13.557  19.090 -27.535
 1119    HG2  ARG 134           HG2      ARG 134  13.042  20.599 -30.090
 1120    HG3  ARG 134           HG3      ARG 134  14.528  20.696 -29.150
 1121    HD2  ARG 134           HD2      ARG 134  14.731  18.201 -29.437
 1122    HD3  ARG 134           HD3      ARG 134  13.400  18.309 -30.591
 1123    HE   ARG 134           HE       ARG 134  14.915  19.961 -31.790
 1124   HH11  ARG 134          HH11      ARG 134  16.080  17.239 -29.925
 1125   HH12  ARG 134          HH12      ARG 134  17.583  17.127 -30.784
 1126   HH21  ARG 134          HH21      ARG 134  16.885  19.808 -32.939
 1127   HH22  ARG 134          HH22      ARG 134  18.035  18.583 -32.508
 1128    H    GLN 135           H        GLN 135   9.081  18.853 -28.440
 1129    HA   GLN 135           HA       GLN 135   8.755  20.566 -30.789
 1130    HB2  GLN 135           HB2      GLN 135   6.438  19.736 -30.787
 1131    HB3  GLN 135           HB3      GLN 135   7.586  18.401 -30.773
 1132    HG2  GLN 135           HG2      GLN 135   7.257  18.184 -28.343
 1133    HG3  GLN 135           HG3      GLN 135   6.061  19.475 -28.408
 1134   HE21  GLN 135          HE21      GLN 135   5.775  16.720 -27.544
 1135   HE22  GLN 135          HE22      GLN 135   4.523  16.040 -28.520
 1136    H    LYS 136           H        LYS 136   7.373  22.401 -30.748
 1137    HA   LYS 136           HA       LYS 136   6.297  23.128 -28.134
 1138    HB2  LYS 136           HB2      LYS 136   8.141  24.753 -29.782
 1139    HB3  LYS 136           HB3      LYS 136   6.786  25.604 -29.049
 1140    HG2  LYS 136           HG2      LYS 136   8.744  23.885 -27.534
 1141    HG3  LYS 136           HG3      LYS 136   8.835  25.643 -27.666
 1142    HD2  LYS 136           HD2      LYS 136   6.785  25.924 -26.495
 1143    HD3  LYS 136           HD3      LYS 136   6.414  24.206 -26.588
 1144    HE2  LYS 136           HE2      LYS 136   7.140  24.675 -24.371
 1145    HE3  LYS 136           HE3      LYS 136   8.416  23.768 -25.175
 1146    HZ1  LYS 136           HZ1      LYS 136   9.208  25.675 -23.841
 1147    HZ2  LYS 136           HZ2      LYS 136   8.412  26.721 -24.903
 1148    HZ3  LYS 136           HZ3      LYS 136   9.676  25.748 -25.461
 1149    H    LYS 137           H        LYS 137   4.555  22.041 -29.201
 1150    HA   LYS 137           HA       LYS 137   2.795  23.999 -30.465
 1151    HB2  LYS 137           HB2      LYS 137   1.896  22.370 -32.007
 1152    HB3  LYS 137           HB3      LYS 137   3.633  22.449 -32.253
 1153    HG2  LYS 137           HG2      LYS 137   3.989  20.378 -31.239
 1154    HG3  LYS 137           HG3      LYS 137   2.398  20.378 -30.476
 1155    HD2  LYS 137           HD2      LYS 137   2.908  20.186 -33.443
 1156    HD3  LYS 137           HD3      LYS 137   2.540  18.822 -32.388
 1157    HE2  LYS 137           HE2      LYS 137   0.390  19.940 -31.801
 1158    HE3  LYS 137           HE3      LYS 137   0.759  21.178 -32.999
 1159    HZ1  LYS 137           HZ1      LYS 137   0.384  18.285 -33.534
 1160    HZ2  LYS 137           HZ2      LYS 137   0.822  19.432 -34.695
 1161    HZ3  LYS 137           HZ3      LYS 137  -0.687  19.527 -33.941
 1162    H    LEU 138           H        LEU 138   0.574  23.619 -29.931
 1163    HA   LEU 138           HA       LEU 138  -0.053  22.823 -27.387
 1164    HB2  LEU 138           HB2      LEU 138  -1.795  22.590 -29.843
 1165    HB3  LEU 138           HB3      LEU 138  -2.381  22.541 -28.192
 1166    HG   LEU 138           HG       LEU 138  -1.039  24.906 -29.503
 1167   HD11  LEU 138          HD11      LEU 138  -3.920  24.418 -28.768
 1168   HD12  LEU 138          HD12      LEU 138  -3.256  24.506 -30.401
 1169   HD13  LEU 138          HD13      LEU 138  -3.256  25.937 -29.370
 1170   HD21  LEU 138          HD21      LEU 138  -1.724  26.120 -27.480
 1171   HD22  LEU 138          HD22      LEU 138  -0.575  24.833 -27.121
 1172   HD23  LEU 138          HD23      LEU 138  -2.289  24.606 -26.774
 1173    H    ALA 139           H        ALA 139   0.493  20.934 -26.489
 1174    HA   ALA 139           HA       ALA 139   0.733  18.560 -28.096
 1175    HB1  ALA 139           HB1      ALA 139   1.182  18.925 -25.138
 1176    HB2  ALA 139           HB2      ALA 139   2.408  19.088 -26.396
 1177    HB3  ALA 139           HB3      ALA 139   1.651  17.524 -26.102
 1178    H    SER 140           H        SER 140  -1.490  18.399 -28.668
 1179    HA   SER 140           HA       SER 140  -2.924  16.790 -26.682
 1180    HB2  SER 140           HB2      SER 140  -4.230  18.686 -28.651
 1181    HB3  SER 140           HB3      SER 140  -5.053  17.694 -27.444
 1182    HG   SER 140           HG       SER 140  -3.125  19.188 -26.290
 1183    H    SER 141           H        SER 141  -2.077  14.924 -27.604
 1184    HA   SER 141           HA       SER 141  -2.374  14.386 -30.409
 1185    HB2  SER 141           HB2      SER 141  -0.535  13.457 -28.983
 1186    HB3  SER 141           HB3      SER 141  -1.734  12.456 -28.166
 1187    HG   SER 141           HG       SER 141  -1.357  11.084 -29.697
  Start of MODEL    2
    1    H1   ASP   1           HT1      ASP   1 -21.592  13.234 -10.710
    2    H2   ASP   1           HT2      ASP   1 -20.177  12.310 -10.748
    3    H3   ASP   1           HT3      ASP   1 -21.219  12.207  -9.423
    4    HA   ASP   1           HA       ASP   1 -21.860  11.367 -12.188
    5    HB2  ASP   1           HB2      ASP   1 -21.260   9.767  -9.694
    6    HB3  ASP   1           HB3      ASP   1 -21.870   9.077 -11.193
    7    HA   PRO   2           HA       PRO   2 -26.098  11.781 -11.088
    8    HB2  PRO   2           HB2      PRO   2 -27.109   9.542 -12.384
    9    HB3  PRO   2           HB3      PRO   2 -26.817  11.111 -13.137
   10    HG2  PRO   2           HG2      PRO   2 -25.154   8.640 -13.191
   11    HG3  PRO   2           HG3      PRO   2 -25.414   9.847 -14.461
   12    HD2  PRO   2           HD2      PRO   2 -23.145   9.743 -13.007
   13    HD3  PRO   2           HD3      PRO   2 -23.815  11.271 -13.608
   14    H    SER   3           H        SER   3 -25.152   8.318 -11.016
   15    HA   SER   3           HA       SER   3 -26.901   7.955  -8.712
   16    HB2  SER   3           HB2      SER   3 -25.259   5.823 -10.070
   17    HB3  SER   3           HB3      SER   3 -26.708   5.620  -9.091
   18    HG   SER   3           HG       SER   3 -27.713   6.993 -10.843
   19    H    ARG   4           H        ARG   4 -23.510   8.043  -9.532
   20    HA   ARG   4           HA       ARG   4 -22.756   6.873  -6.979
   21    HB2  ARG   4           HB2      ARG   4 -20.935   7.977  -9.126
   22    HB3  ARG   4           HB3      ARG   4 -20.512   6.863  -7.834
   23    HG2  ARG   4           HG2      ARG   4 -21.706   5.092  -8.831
   24    HG3  ARG   4           HG3      ARG   4 -22.511   6.174  -9.965
   25    HD2  ARG   4           HD2      ARG   4 -20.159   6.689 -10.848
   26    HD3  ARG   4           HD3      ARG   4 -19.650   5.258  -9.948
   27    HE   ARG   4           HE       ARG   4 -21.844   4.524 -11.493
   28   HH11  ARG   4          HH11      ARG   4 -18.539   5.578 -11.981
   29   HH12  ARG   4          HH12      ARG   4 -18.398   4.828 -13.535
   30   HH21  ARG   4          HH21      ARG   4 -21.651   3.524 -13.537
   31   HH22  ARG   4          HH22      ARG   4 -20.158   3.638 -14.414
   32    H    ARG   5           H        ARG   5 -23.332   8.345  -5.456
   33    HA   ARG   5           HA       ARG   5 -22.027  10.969  -5.539
   34    HB2  ARG   5           HB2      ARG   5 -24.557   9.989  -4.492
   35    HB3  ARG   5           HB3      ARG   5 -23.646  10.869  -3.273
   36    HG2  ARG   5           HG2      ARG   5 -24.225  11.955  -6.015
   37    HG3  ARG   5           HG3      ARG   5 -25.250  12.241  -4.607
   38    HD2  ARG   5           HD2      ARG   5 -22.323  12.956  -4.798
   39    HD3  ARG   5           HD3      ARG   5 -23.661  14.084  -5.024
   40    HE   ARG   5           HE       ARG   5 -23.958  12.820  -2.539
   41   HH11  ARG   5          HH11      ARG   5 -21.903  15.147  -4.151
   42   HH12  ARG   5          HH12      ARG   5 -21.447  15.954  -2.684
   43   HH21  ARG   5          HH21      ARG   5 -23.375  13.894  -0.602
   44   HH22  ARG   5          HH22      ARG   5 -22.285  15.243  -0.666
   45    H    ALA   6           H        ALA   6 -20.693  11.636  -3.801
   46    HA   ALA   6           HA       ALA   6 -20.015   9.465  -1.939
   47    HB1  ALA   6           HB1      ALA   6 -18.135  10.111  -3.316
   48    HB2  ALA   6           HB2      ALA   6 -17.861  10.554  -1.630
   49    HB3  ALA   6           HB3      ALA   6 -18.325  11.787  -2.802
   50    HA   PRO   7           HA       PRO   7 -21.371  12.474   1.079
   51    HB2  PRO   7           HB2      PRO   7 -23.137  11.005   2.307
   52    HB3  PRO   7           HB3      PRO   7 -23.407  11.436   0.608
   53    HG2  PRO   7           HG2      PRO   7 -22.446   8.842   1.748
   54    HG3  PRO   7           HG3      PRO   7 -23.609   9.129   0.439
   55    HD2  PRO   7           HD2      PRO   7 -20.819   8.658   0.165
   56    HD3  PRO   7           HD3      PRO   7 -21.947   9.168  -1.111
   57    H    THR   8           H        THR   8 -21.287  12.359   3.514
   58    HA   THR   8           HA       THR   8 -19.059  10.719   4.391
   59    HB   THR   8           HB       THR   8 -19.573  11.948   6.626
   60    HG1  THR   8           HG1      THR   8 -21.647  12.754   5.725
   61   HG21  THR   8          HG21      THR   8 -18.577  13.472   4.215
   62   HG22  THR   8          HG22      THR   8 -17.621  12.364   5.199
   63   HG23  THR   8          HG23      THR   8 -18.239  13.856   5.903
   64    H    TRP   9           H        TRP   9 -19.254   8.881   5.468
   65    HA   TRP   9           HA       TRP   9 -21.851   7.708   5.698
   66    HB2  TRP   9           HB2      TRP   9 -19.105   6.715   6.457
   67    HB3  TRP   9           HB3      TRP   9 -20.569   5.756   6.619
   68    HD1  TRP   9           HD1      TRP   9 -19.222   7.844   3.613
   69    HE1  TRP   9           HE1      TRP   9 -19.218   6.306   1.549
   70    HE3  TRP   9           HE3      TRP   9 -20.885   3.540   5.807
   71    HZ2  TRP   9           HZ2      TRP   9 -19.828   3.610   0.944
   72    HZ3  TRP   9           HZ3      TRP   9 -21.151   1.530   4.418
   73    HH2  TRP   9           HH2      TRP   9 -20.637   1.572   2.033
   74    H    SER  10           H        SER  10 -22.955   7.114   7.510
   75    HA   SER  10           HA       SER  10 -22.310   8.378  10.010
   76    HB2  SER  10           HB2      SER  10 -24.422   6.281   9.426
   77    HB3  SER  10           HB3      SER  10 -24.378   7.388  10.796
   78    HG   SER  10           HG       SER  10 -24.401   9.085   9.064
   79    HA   PRO  11           HA       PRO  11 -19.641   5.418  11.876
   80    HB2  PRO  11           HB2      PRO  11 -21.651   5.306  14.092
   81    HB3  PRO  11           HB3      PRO  11 -19.898   5.523  14.174
   82    HG2  PRO  11           HG2      PRO  11 -21.524   7.599  14.476
   83    HG3  PRO  11           HG3      PRO  11 -20.016   7.759  13.561
   84    HD2  PRO  11           HD2      PRO  11 -22.820   7.616  12.577
   85    HD3  PRO  11           HD3      PRO  11 -21.428   8.484  11.904
   86    H    GLU  12           H        GLU  12 -23.085   4.615  12.279
   87    HA   GLU  12           HA       GLU  12 -22.656   1.833  12.610
   88    HB2  GLU  12           HB2      GLU  12 -25.132   3.374  11.816
   89    HB3  GLU  12           HB3      GLU  12 -25.115   1.661  12.211
   90    HG2  GLU  12           HG2      GLU  12 -24.495   2.093  14.458
   91    HG3  GLU  12           HG3      GLU  12 -24.181   3.792  14.111
   92    H    GLU  13           H        GLU  13 -22.881   3.853   9.790
   93    HA   GLU  13           HA       GLU  13 -23.671   1.704   8.036
   94    HB2  GLU  13           HB2      GLU  13 -24.102   4.265   7.741
   95    HB3  GLU  13           HB3      GLU  13 -22.485   4.275   7.050
   96    HG2  GLU  13           HG2      GLU  13 -24.091   4.079   5.281
   97    HG3  GLU  13           HG3      GLU  13 -23.202   2.562   5.420
   98    H    GLU  14           H        GLU  14 -20.651   3.326   8.942
   99    HA   GLU  14           HA       GLU  14 -19.102   1.843   7.042
  100    HB2  GLU  14           HB2      GLU  14 -18.358   3.540   9.407
  101    HB3  GLU  14           HB3      GLU  14 -17.150   2.621   8.518
  102    HG2  GLU  14           HG2      GLU  14 -17.871   3.782   6.450
  103    HG3  GLU  14           HG3      GLU  14 -18.947   4.771   7.431
  104    H    ALA  15           H        ALA  15 -20.123   1.361  10.353
  105    HA   ALA  15           HA       ALA  15 -18.593  -0.978  10.834
  106    HB1  ALA  15           HB1      ALA  15 -19.713   0.217  12.646
  107    HB2  ALA  15           HB2      ALA  15 -20.240  -1.465  12.584
  108    HB3  ALA  15           HB3      ALA  15 -21.284  -0.191  11.955
  109    H    HIS  16           H        HIS  16 -21.691  -0.350   9.365
  110    HA   HIS  16           HA       HIS  16 -22.431  -3.003   8.779
  111    HB2  HIS  16           HB2      HIS  16 -24.005  -1.084   8.865
  112    HB3  HIS  16           HB3      HIS  16 -23.246  -0.420   7.424
  113    HD1  HIS  16           HD1      HIS  16 -25.435  -0.511   6.115
  114    HD2  HIS  16           HD2      HIS  16 -24.125  -4.226   7.474
  115    HE1  HIS  16           HE1      HIS  16 -26.872  -2.224   4.947
  116    HE2  HIS  16           HE2      HIS  16 -26.248  -4.414   6.011
  117    H    LEU  17           H        LEU  17 -20.397  -0.641   7.254
  118    HA   LEU  17           HA       LEU  17 -20.211  -1.801   4.695
  119    HB2  LEU  17           HB2      LEU  17 -19.471   0.492   5.258
  120    HB3  LEU  17           HB3      LEU  17 -18.160  -0.178   6.207
  121    HG   LEU  17           HG       LEU  17 -17.190  -1.158   4.178
  122   HD11  LEU  17          HD11      LEU  17 -18.082  -0.495   1.989
  123   HD12  LEU  17          HD12      LEU  17 -19.472   0.231   2.797
  124   HD13  LEU  17          HD13      LEU  17 -19.206  -1.508   2.893
  125   HD21  LEU  17          HD21      LEU  17 -16.464   1.037   4.882
  126   HD22  LEU  17          HD22      LEU  17 -17.794   1.783   3.995
  127   HD23  LEU  17          HD23      LEU  17 -16.513   0.942   3.121
  128    H    ARG  18           H        ARG  18 -18.156  -2.096   7.590
  129    HA   ARG  18           HA       ARG  18 -16.624  -4.222   6.460
  130    HB2  ARG  18           HB2      ARG  18 -15.704  -4.515   8.726
  131    HB3  ARG  18           HB3      ARG  18 -15.621  -2.848   8.185
  132    HG2  ARG  18           HG2      ARG  18 -17.654  -2.377   9.534
  133    HG3  ARG  18           HG3      ARG  18 -17.558  -4.023  10.161
  134    HD2  ARG  18           HD2      ARG  18 -15.351  -3.566  11.074
  135    HD3  ARG  18           HD3      ARG  18 -15.398  -1.935  10.410
  136    HE   ARG  18           HE       ARG  18 -17.455  -2.752  12.336
  137   HH11  ARG  18          HH11      ARG  18 -14.644  -0.807  11.568
  138   HH12  ARG  18          HH12      ARG  18 -14.831   0.234  12.939
  139   HH21  ARG  18          HH21      ARG  18 -17.699  -1.374  14.144
  140   HH22  ARG  18          HH22      ARG  18 -16.568  -0.085  14.401
  141    H    GLU  19           H        GLU  19 -19.524  -3.942   8.363
  142    HA   GLU  19           HA       GLU  19 -19.960  -6.460   9.290
  143    HB2  GLU  19           HB2      GLU  19 -21.505  -4.610   9.639
  144    HB3  GLU  19           HB3      GLU  19 -21.949  -4.647   7.940
  145    HG2  GLU  19           HG2      GLU  19 -23.652  -5.662   9.338
  146    HG3  GLU  19           HG3      GLU  19 -22.947  -6.828   8.223
  147    H    LEU  20           H        LEU  20 -20.666  -5.226   6.059
  148    HA   LEU  20           HA       LEU  20 -21.569  -7.693   4.980
  149    HB2  LEU  20           HB2      LEU  20 -21.332  -4.975   4.154
  150    HB3  LEU  20           HB3      LEU  20 -20.583  -5.981   2.935
  151    HG   LEU  20           HG       LEU  20 -22.901  -5.522   2.380
  152   HD11  LEU  20          HD11      LEU  20 -22.495  -8.391   3.189
  153   HD12  LEU  20          HD12      LEU  20 -21.928  -7.652   1.693
  154   HD13  LEU  20          HD13      LEU  20 -23.659  -7.792   2.007
  155   HD21  LEU  20          HD21      LEU  20 -24.713  -6.404   3.744
  156   HD22  LEU  20          HD22      LEU  20 -23.769  -5.197   4.615
  157   HD23  LEU  20          HD23      LEU  20 -23.550  -6.909   4.969
  158    H    TYR  21           H        TYR  21 -18.434  -6.085   5.089
  159    HA   TYR  21           HA       TYR  21 -17.179  -7.712   3.118
  160    HB2  TYR  21           HB2      TYR  21 -16.270  -5.514   3.642
  161    HB3  TYR  21           HB3      TYR  21 -15.994  -5.991   5.312
  162    HD1  TYR  21           HD1      TYR  21 -13.912  -6.829   5.937
  163    HD2  TYR  21           HD2      TYR  21 -14.991  -6.885   1.825
  164    HE1  TYR  21           HE1      TYR  21 -11.642  -7.574   5.356
  165    HE2  TYR  21           HE2      TYR  21 -12.727  -7.621   1.231
  166    HH   TYR  21           HH       TYR  21 -10.446  -7.563   2.162
  167    H    LEU  22           H        LEU  22 -17.182  -7.707   6.652
  168    HA   LEU  22           HA       LEU  22 -15.378  -9.814   7.026
  169    HB2  LEU  22           HB2      LEU  22 -17.706  -9.064   8.795
  170    HB3  LEU  22           HB3      LEU  22 -16.277  -9.952   9.275
  171    HG   LEU  22           HG       LEU  22 -16.382  -7.052   8.452
  172   HD11  LEU  22          HD11      LEU  22 -15.812  -8.342  11.112
  173   HD12  LEU  22          HD12      LEU  22 -17.284  -7.479  10.670
  174   HD13  LEU  22          HD13      LEU  22 -15.748  -6.616  10.761
  175   HD21  LEU  22          HD21      LEU  22 -14.025  -6.953   9.021
  176   HD22  LEU  22          HD22      LEU  22 -14.298  -8.103   7.713
  177   HD23  LEU  22          HD23      LEU  22 -14.012  -8.684   9.351
  178    H    ALA  23           H        ALA  23 -18.776  -9.764   6.289
  179    HA   ALA  23           HA       ALA  23 -19.242 -12.519   6.928
  180    HB1  ALA  23           HB1      ALA  23 -21.456 -12.137   6.007
  181    HB2  ALA  23           HB2      ALA  23 -20.933 -10.587   5.349
  182    HB3  ALA  23           HB3      ALA  23 -21.000 -10.827   7.095
  183    H    ASN  24           H        ASN  24 -18.607 -10.722   3.917
  184    HA   ASN  24           HA       ASN  24 -19.001 -13.221   2.415
  185    HB2  ASN  24           HB2      ASN  24 -19.102 -10.340   1.510
  186    HB3  ASN  24           HB3      ASN  24 -19.255 -11.724   0.434
  187   HD21  ASN  24          HD21      ASN  24 -20.754  -9.895   2.984
  188   HD22  ASN  24          HD22      ASN  24 -22.343 -10.560   2.797
  189    H    LYS  25           H        LYS  25 -16.494 -12.189   3.822
  190    HA   LYS  25           HA       LYS  25 -14.670 -11.592   1.660
  191    HB2  LYS  25           HB2      LYS  25 -12.987 -11.386   3.362
  192    HB3  LYS  25           HB3      LYS  25 -14.454 -10.623   3.963
  193    HG2  LYS  25           HG2      LYS  25 -14.959 -12.705   5.214
  194    HG3  LYS  25           HG3      LYS  25 -13.398 -13.342   4.697
  195    HD2  LYS  25           HD2      LYS  25 -12.321 -11.367   5.778
  196    HD3  LYS  25           HD3      LYS  25 -13.901 -10.924   6.421
  197    HE2  LYS  25           HE2      LYS  25 -12.295 -13.400   7.003
  198    HE3  LYS  25           HE3      LYS  25 -12.760 -12.124   8.126
  199    HZ1  LYS  25           HZ1      LYS  25 -14.536 -14.138   6.846
  200    HZ2  LYS  25           HZ2      LYS  25 -15.110 -12.801   7.720
  201    HZ3  LYS  25           HZ3      LYS  25 -14.174 -13.976   8.494
  202    H    ASP  26           H        ASP  26 -15.939 -14.425   2.966
  203    HA   ASP  26           HA       ASP  26 -13.484 -15.954   2.482
  204    HB2  ASP  26           HB2      ASP  26 -15.983 -16.728   4.003
  205    HB3  ASP  26           HB3      ASP  26 -14.555 -17.743   3.815
  206    H    VAL  27           H        VAL  27 -15.715 -14.968   0.584
  207    HA   VAL  27           HA       VAL  27 -16.278 -17.572  -0.670
  208    HB   VAL  27           HB       VAL  27 -17.714 -14.958  -1.178
  209   HG11  VAL  27          HG11      VAL  27 -18.370 -17.787  -1.999
  210   HG12  VAL  27          HG12      VAL  27 -17.781 -16.505  -3.058
  211   HG13  VAL  27          HG13      VAL  27 -19.371 -16.367  -2.307
  212   HG21  VAL  27          HG21      VAL  27 -19.578 -15.898   0.109
  213   HG22  VAL  27          HG22      VAL  27 -18.138 -15.705   1.108
  214   HG23  VAL  27          HG23      VAL  27 -18.591 -17.302   0.512
  215    H    GLU  28           H        GLU  28 -14.767 -17.980  -2.136
  216    HA   GLU  28           HA       GLU  28 -13.624 -15.789  -3.670
  217    HB2  GLU  28           HB2      GLU  28 -12.944 -18.729  -3.596
  218    HB3  GLU  28           HB3      GLU  28 -12.097 -17.532  -4.565
  219    HG2  GLU  28           HG2      GLU  28 -11.504 -16.328  -2.494
  220    HG3  GLU  28           HG3      GLU  28 -12.268 -17.615  -1.563
  221    H    GLY  29           H        GLY  29 -13.475 -15.916  -5.989
  222    HA2  GLY  29           HA2      GLY  29 -14.362 -16.323  -8.111
  223    HA3  GLY  29           HA3      GLY  29 -15.449 -17.512  -7.398
  224    H    GLN  30           H        GLN  30 -15.444 -14.745  -5.612
  225    HA   GLN  30           HA       GLN  30 -17.782 -13.621  -6.971
  226    HB2  GLN  30           HB2      GLN  30 -18.796 -14.765  -5.231
  227    HB3  GLN  30           HB3      GLN  30 -17.412 -14.602  -4.173
  228    HG2  GLN  30           HG2      GLN  30 -18.900 -12.127  -4.817
  229    HG3  GLN  30           HG3      GLN  30 -19.699 -13.309  -3.781
  230   HE21  GLN  30          HE21      GLN  30 -19.587 -11.928  -1.990
  231   HE22  GLN  30          HE22      GLN  30 -18.105 -11.628  -1.162
  232    H    ASP  31           H        ASP  31 -18.056 -11.358  -6.688
  233    HA   ASP  31           HA       ASP  31 -15.660  -9.877  -6.029
  234    HB2  ASP  31           HB2      ASP  31 -18.442  -8.882  -6.660
  235    HB3  ASP  31           HB3      ASP  31 -17.003  -7.881  -6.548
  236    H    VAL  32           H        VAL  32 -15.241  -9.930  -3.842
  237    HA   VAL  32           HA       VAL  32 -17.137  -9.971  -1.803
  238    HB   VAL  32           HB       VAL  32 -14.643 -10.342  -1.524
  239   HG11  VAL  32          HG11      VAL  32 -13.795  -8.366  -2.611
  240   HG12  VAL  32          HG12      VAL  32 -13.305  -8.340  -0.916
  241   HG13  VAL  32          HG13      VAL  32 -14.645  -7.325  -1.465
  242   HG21  VAL  32          HG21      VAL  32 -16.116 -10.280   0.385
  243   HG22  VAL  32          HG22      VAL  32 -16.065  -8.518   0.410
  244   HG23  VAL  32          HG23      VAL  32 -14.612  -9.446   0.780
  245    H    VAL  33           H        VAL  33 -15.770  -7.324  -3.608
  246    HA   VAL  33           HA       VAL  33 -16.674  -5.177  -2.025
  247    HB   VAL  33           HB       VAL  33 -16.628  -4.804  -4.957
  248   HG11  VAL  33          HG11      VAL  33 -15.475  -3.330  -2.615
  249   HG12  VAL  33          HG12      VAL  33 -16.837  -2.871  -3.629
  250   HG13  VAL  33          HG13      VAL  33 -15.205  -2.858  -4.291
  251   HG21  VAL  33          HG21      VAL  33 -14.884  -6.352  -4.962
  252   HG22  VAL  33          HG22      VAL  33 -14.231  -5.761  -3.439
  253   HG23  VAL  33          HG23      VAL  33 -14.082  -4.782  -4.899
  254    H    GLU  34           H        GLU  34 -17.984  -6.786  -4.864
  255    HA   GLU  34           HA       GLU  34 -20.233  -5.121  -5.159
  256    HB2  GLU  34           HB2      GLU  34 -19.009  -6.823  -6.777
  257    HB3  GLU  34           HB3      GLU  34 -20.233  -7.926  -6.166
  258    HG2  GLU  34           HG2      GLU  34 -21.105  -5.273  -7.166
  259    HG3  GLU  34           HG3      GLU  34 -20.599  -6.489  -8.338
  260    H    ALA  35           H        ALA  35 -19.633  -8.095  -3.413
  261    HA   ALA  35           HA       ALA  35 -22.243  -8.726  -2.637
  262    HB1  ALA  35           HB1      ALA  35 -20.282 -10.148  -2.199
  263    HB2  ALA  35           HB2      ALA  35 -21.242  -9.865  -0.746
  264    HB3  ALA  35           HB3      ALA  35 -19.731  -8.985  -0.990
  265    H    ILE  36           H        ILE  36 -19.862  -6.586  -1.167
  266    HA   ILE  36           HA       ILE  36 -21.452  -5.766   1.033
  267    HB   ILE  36           HB       ILE  36 -19.196  -4.287  -0.328
  268   HG12  ILE  36          HG12      ILE  36 -18.974  -6.131   2.042
  269   HG13  ILE  36          HG13      ILE  36 -18.737  -6.685   0.389
  270   HG21  ILE  36          HG21      ILE  36 -18.858  -3.264   1.883
  271   HG22  ILE  36          HG22      ILE  36 -20.307  -4.083   2.462
  272   HG23  ILE  36          HG23      ILE  36 -20.431  -2.873   1.189
  273   HD11  ILE  36          HD11      ILE  36 -16.639  -6.195   1.486
  274   HD12  ILE  36          HD12      ILE  36 -17.158  -4.540   1.774
  275   HD13  ILE  36          HD13      ILE  36 -16.904  -5.111   0.125
  276    H    LEU  37           H        LEU  37 -20.480  -4.002  -1.897
  277    HA   LEU  37           HA       LEU  37 -21.991  -1.736  -1.148
  278    HB2  LEU  37           HB2      LEU  37 -21.419  -0.923  -3.467
  279    HB3  LEU  37           HB3      LEU  37 -20.109  -1.296  -2.380
  280    HG   LEU  37           HG       LEU  37 -19.841  -3.499  -3.574
  281   HD11  LEU  37          HD11      LEU  37 -20.743  -3.491  -5.928
  282   HD12  LEU  37          HD12      LEU  37 -21.811  -2.177  -5.439
  283   HD13  LEU  37          HD13      LEU  37 -21.943  -3.755  -4.664
  284   HD21  LEU  37          HD21      LEU  37 -19.442  -0.922  -5.071
  285   HD22  LEU  37          HD22      LEU  37 -18.708  -2.466  -5.511
  286   HD23  LEU  37          HD23      LEU  37 -18.316  -1.711  -3.969
  287    H    ALA  38           H        ALA  38 -22.944  -4.527  -2.870
  288    HA   ALA  38           HA       ALA  38 -25.162  -3.174  -4.164
  289    HB1  ALA  38           HB1      ALA  38 -25.706  -5.315  -5.123
  290    HB2  ALA  38           HB2      ALA  38 -24.537  -6.113  -4.071
  291    HB3  ALA  38           HB3      ALA  38 -23.983  -4.993  -5.315
  292    H    HIS  39           H        HIS  39 -24.582  -5.230  -1.377
  293    HA   HIS  39           HA       HIS  39 -27.375  -5.751  -0.948
  294    HB2  HIS  39           HB2      HIS  39 -24.900  -6.292   0.670
  295    HB3  HIS  39           HB3      HIS  39 -26.505  -6.550   1.346
  296    HD1  HIS  39           HD1      HIS  39 -27.366  -8.837   1.050
  297    HD2  HIS  39           HD2      HIS  39 -24.639  -7.831  -1.918
  298    HE1  HIS  39           HE1      HIS  39 -27.121 -10.897  -0.367
  299    HE2  HIS  39           HE2      HIS  39 -25.579 -10.219  -2.247
  300    H    LEU  40           H        LEU  40 -25.073  -3.357   0.148
  301    HA   LEU  40           HA       LEU  40 -27.241  -2.178   1.724
  302    HB2  LEU  40           HB2      LEU  40 -25.284  -0.660   2.566
  303    HB3  LEU  40           HB3      LEU  40 -25.567  -2.243   3.248
  304    HG   LEU  40           HG       LEU  40 -23.759  -3.069   1.610
  305   HD11  LEU  40          HD11      LEU  40 -23.594  -1.147   0.182
  306   HD12  LEU  40          HD12      LEU  40 -22.072  -1.362   1.049
  307   HD13  LEU  40          HD13      LEU  40 -23.208  -0.112   1.560
  308   HD21  LEU  40          HD21      LEU  40 -22.005  -2.527   3.189
  309   HD22  LEU  40          HD22      LEU  40 -23.501  -2.901   4.046
  310   HD23  LEU  40          HD23      LEU  40 -22.986  -1.224   3.862
  311    H    ASN  41           H        ASN  41 -28.293  -1.423  -0.180
  312    HA   ASN  41           HA       ASN  41 -26.982   0.735  -1.638
  313    HB2  ASN  41           HB2      ASN  41 -29.041   0.806  -2.988
  314    HB3  ASN  41           HB3      ASN  41 -28.382  -0.821  -2.916
  315   HD21  ASN  41          HD21      ASN  41 -31.084   0.144  -3.485
  316   HD22  ASN  41          HD22      ASN  41 -32.116  -0.666  -2.360
  317    H    THR  42           H        THR  42 -27.283   1.074   1.079
  318    HA   THR  42           HA       THR  42 -29.456   2.872   1.629
  319    HB   THR  42           HB       THR  42 -28.813   1.717   3.538
  320    HG1  THR  42           HG1      THR  42 -27.360   3.383   4.738
  321   HG21  THR  42          HG21      THR  42 -26.805   0.663   2.770
  322   HG22  THR  42          HG22      THR  42 -26.438   1.472   4.292
  323   HG23  THR  42          HG23      THR  42 -25.937   2.196   2.760
  324    H    VAL  43           H        VAL  43 -26.241   3.023   0.450
  325    HA   VAL  43           HA       VAL  43 -26.406   5.954   0.309
  326    HB   VAL  43           HB       VAL  43 -23.679   5.256   0.159
  327   HG11  VAL  43          HG11      VAL  43 -24.588   7.349   1.012
  328   HG12  VAL  43          HG12      VAL  43 -23.461   6.622   2.159
  329   HG13  VAL  43          HG13      VAL  43 -25.201   6.510   2.436
  330   HG21  VAL  43          HG21      VAL  43 -24.321   3.116   1.268
  331   HG22  VAL  43          HG22      VAL  43 -24.890   4.058   2.645
  332   HG23  VAL  43          HG23      VAL  43 -23.185   4.098   2.195
  333    HA   PRO  44           HA       PRO  44 -25.809   4.916  -4.055
  334    HB2  PRO  44           HB2      PRO  44 -26.256   7.362  -5.031
  335    HB3  PRO  44           HB3      PRO  44 -27.585   6.408  -4.355
  336    HG2  PRO  44           HG2      PRO  44 -25.973   8.591  -3.052
  337    HG3  PRO  44           HG3      PRO  44 -27.741   8.387  -3.097
  338    HD2  PRO  44           HD2      PRO  44 -26.224   7.617  -0.980
  339    HD3  PRO  44           HD3      PRO  44 -27.720   6.779  -1.444
  340    H    ARG  45           H        ARG  45 -23.593   4.486  -4.233
  341    HA   ARG  45           HA       ARG  45 -21.847   6.844  -4.439
  342    HB2  ARG  45           HB2      ARG  45 -20.610   4.483  -3.183
  343    HB3  ARG  45           HB3      ARG  45 -20.380   6.189  -2.854
  344    HG2  ARG  45           HG2      ARG  45 -21.987   6.257  -1.269
  345    HG3  ARG  45           HG3      ARG  45 -22.958   4.999  -2.039
  346    HD2  ARG  45           HD2      ARG  45 -20.415   3.944  -1.178
  347    HD3  ARG  45           HD3      ARG  45 -21.246   4.743   0.150
  348    HE   ARG  45           HE       ARG  45 -22.615   2.949   0.251
  349   HH11  ARG  45          HH11      ARG  45 -21.456   3.096  -3.063
  350   HH12  ARG  45          HH12      ARG  45 -22.323   1.685  -3.559
  351   HH21  ARG  45          HH21      ARG  45 -23.752   1.075  -0.429
  352   HH22  ARG  45          HH22      ARG  45 -23.616   0.541  -2.073
  353    H    THR  46           H        THR  46 -19.630   6.162  -5.194
  354    HA   THR  46           HA       THR  46 -19.803   4.358  -7.444
  355    HB   THR  46           HB       THR  46 -18.530   6.412  -7.747
  356    HG1  THR  46           HG1      THR  46 -16.762   5.487  -8.688
  357   HG21  THR  46          HG21      THR  46 -17.801   6.897  -5.508
  358   HG22  THR  46          HG22      THR  46 -16.371   6.727  -6.523
  359   HG23  THR  46          HG23      THR  46 -16.848   5.416  -5.451
  360    H    ARG  47           H        ARG  47 -17.850   2.782  -7.677
  361    HA   ARG  47           HA       ARG  47 -18.023   0.937  -5.486
  362    HB2  ARG  47           HB2      ARG  47 -16.046   0.731  -7.752
  363    HB3  ARG  47           HB3      ARG  47 -16.784  -0.568  -6.829
  364    HG2  ARG  47           HG2      ARG  47 -18.182   1.194  -8.833
  365    HG3  ARG  47           HG3      ARG  47 -17.662  -0.469  -9.091
  366    HD2  ARG  47           HD2      ARG  47 -19.147  -1.081  -7.129
  367    HD3  ARG  47           HD3      ARG  47 -19.817   0.545  -7.254
  368    HE   ARG  47           HE       ARG  47 -19.883  -0.751  -9.766
  369   HH11  ARG  47          HH11      ARG  47 -21.555  -0.626  -6.684
  370   HH12  ARG  47          HH12      ARG  47 -22.991  -1.377  -7.296
  371   HH21  ARG  47          HH21      ARG  47 -21.779  -1.720 -10.566
  372   HH22  ARG  47          HH22      ARG  47 -23.122  -1.995  -9.499
  373    H    LYS  48           H        LYS  48 -15.833   3.356  -6.577
  374    HA   LYS  48           HA       LYS  48 -13.473   2.703  -5.277
  375    HB2  LYS  48           HB2      LYS  48 -13.284   4.423  -6.810
  376    HB3  LYS  48           HB3      LYS  48 -14.740   5.223  -6.258
  377    HG2  LYS  48           HG2      LYS  48 -12.337   5.172  -4.488
  378    HG3  LYS  48           HG3      LYS  48 -12.403   6.291  -5.852
  379    HD2  LYS  48           HD2      LYS  48 -14.608   7.093  -4.983
  380    HD3  LYS  48           HD3      LYS  48 -14.347   6.092  -3.554
  381    HE2  LYS  48           HE2      LYS  48 -13.681   8.287  -2.987
  382    HE3  LYS  48           HE3      LYS  48 -12.202   7.351  -3.197
  383    HZ1  LYS  48           HZ1      LYS  48 -13.388   9.175  -5.220
  384    HZ2  LYS  48           HZ2      LYS  48 -11.953   8.304  -5.402
  385    HZ3  LYS  48           HZ3      LYS  48 -12.055   9.532  -4.246
  386    H    GLN  49           H        GLN  49 -16.407   4.124  -3.977
  387    HA   GLN  49           HA       GLN  49 -15.331   5.225  -1.609
  388    HB2  GLN  49           HB2      GLN  49 -18.075   4.288  -2.414
  389    HB3  GLN  49           HB3      GLN  49 -17.757   4.842  -0.779
  390    HG2  GLN  49           HG2      GLN  49 -17.241   6.494  -3.235
  391    HG3  GLN  49           HG3      GLN  49 -18.730   6.544  -2.301
  392   HE21  GLN  49          HE21      GLN  49 -15.443   7.502  -2.459
  393   HE22  GLN  49          HE22      GLN  49 -15.438   8.491  -1.043
  394    H    ILE  50           H        ILE  50 -16.787   2.150  -2.386
  395    HA   ILE  50           HA       ILE  50 -17.017   1.108   0.199
  396    HB   ILE  50           HB       ILE  50 -16.575  -0.558  -2.264
  397   HG12  ILE  50          HG12      ILE  50 -18.100   1.354  -2.777
  398   HG13  ILE  50          HG13      ILE  50 -18.868  -0.210  -2.909
  399   HG21  ILE  50          HG21      ILE  50 -18.355  -0.899   0.141
  400   HG22  ILE  50          HG22      ILE  50 -16.820  -1.722  -0.133
  401   HG23  ILE  50          HG23      ILE  50 -18.194  -2.038  -1.195
  402   HD11  ILE  50          HD11      ILE  50 -20.310   1.449  -1.853
  403   HD12  ILE  50          HD12      ILE  50 -19.116   1.659  -0.571
  404   HD13  ILE  50          HD13      ILE  50 -19.944   0.111  -0.761
  405    H    ILE  51           H        ILE  51 -14.667   0.442  -2.340
  406    HA   ILE  51           HA       ILE  51 -13.028  -1.337  -0.956
  407    HB   ILE  51           HB       ILE  51 -12.172   0.655  -3.057
  408   HG12  ILE  51          HG12      ILE  51 -13.158  -2.182  -3.401
  409   HG13  ILE  51          HG13      ILE  51 -14.093  -0.736  -3.765
  410   HG21  ILE  51          HG21      ILE  51 -10.931  -1.939  -2.159
  411   HG22  ILE  51          HG22      ILE  51 -10.269  -0.319  -1.944
  412   HG23  ILE  51          HG23      ILE  51 -10.415  -1.004  -3.562
  413   HD11  ILE  51          HD11      ILE  51 -13.162  -1.706  -5.778
  414   HD12  ILE  51          HD12      ILE  51 -11.536  -1.572  -5.108
  415   HD13  ILE  51          HD13      ILE  51 -12.465  -0.116  -5.472
  416    H    HIS  52           H        HIS  52 -12.832   2.161  -1.292
  417    HA   HIS  52           HA       HIS  52 -10.345   2.418  -0.006
  418    HB2  HIS  52           HB2      HIS  52 -12.489   4.341  -0.797
  419    HB3  HIS  52           HB3      HIS  52 -11.157   4.886   0.217
  420    HD1  HIS  52           HD1      HIS  52  -9.621   6.128  -1.263
  421    HD2  HIS  52           HD2      HIS  52 -10.986   2.626  -3.056
  422    HE1  HIS  52           HE1      HIS  52  -8.344   5.921  -3.407
  423    HE2  HIS  52           HE2      HIS  52  -9.338   3.916  -4.573
  424    H    HIS  53           H        HIS  53 -13.663   2.991   1.239
  425    HA   HIS  53           HA       HIS  53 -12.805   3.915   3.762
  426    HB2  HIS  53           HB2      HIS  53 -15.395   2.482   3.152
  427    HB3  HIS  53           HB3      HIS  53 -15.077   3.522   4.534
  428    HD1  HIS  53           HD1      HIS  53 -13.594   5.713   2.673
  429    HD2  HIS  53           HD2      HIS  53 -17.423   4.147   2.187
  430    HE1  HIS  53           HE1      HIS  53 -14.804   7.351   1.218
  431    HE2  HIS  53           HE2      HIS  53 -17.184   6.552   1.219
  432    H    LEU  54           H        LEU  54 -12.983   0.740   2.474
  433    HA   LEU  54           HA       LEU  54 -13.070  -0.571   5.050
  434    HB2  LEU  54           HB2      LEU  54 -12.929  -1.547   2.217
  435    HB3  LEU  54           HB3      LEU  54 -12.655  -2.641   3.558
  436    HG   LEU  54           HG       LEU  54 -15.166  -0.997   3.317
  437   HD11  LEU  54          HD11      LEU  54 -14.930  -2.427   1.329
  438   HD12  LEU  54          HD12      LEU  54 -16.257  -2.936   2.373
  439   HD13  LEU  54          HD13      LEU  54 -14.736  -3.829   2.382
  440   HD21  LEU  54          HD21      LEU  54 -14.497  -3.504   4.863
  441   HD22  LEU  54          HD22      LEU  54 -16.053  -2.675   4.856
  442   HD23  LEU  54          HD23      LEU  54 -14.635  -1.881   5.539
  443    H    VAL  55           H        VAL  55 -10.732  -0.293   2.377
  444    HA   VAL  55           HA       VAL  55  -8.656  -1.606   3.816
  445    HB   VAL  55           HB       VAL  55  -7.147  -0.889   2.070
  446   HG11  VAL  55          HG11      VAL  55  -8.331  -1.785   0.110
  447   HG12  VAL  55          HG12      VAL  55  -9.854  -1.651   0.990
  448   HG13  VAL  55          HG13      VAL  55  -8.598  -2.749   1.562
  449   HG21  VAL  55          HG21      VAL  55  -7.877   0.598   0.258
  450   HG22  VAL  55          HG22      VAL  55  -7.860   1.422   1.817
  451   HG23  VAL  55          HG23      VAL  55  -9.388   0.892   1.116
  452    H    GLN  56           H        GLN  56  -9.678   1.718   3.487
  453    HA   GLN  56           HA       GLN  56  -7.447   2.885   4.801
  454    HB2  GLN  56           HB2      GLN  56 -10.251   3.818   4.238
  455    HB3  GLN  56           HB3      GLN  56  -9.124   4.800   5.140
  456    HG2  GLN  56           HG2      GLN  56  -7.579   4.750   3.212
  457    HG3  GLN  56           HG3      GLN  56  -8.785   3.835   2.306
  458   HE21  GLN  56          HE21      GLN  56  -9.098   5.362   0.754
  459   HE22  GLN  56          HE22      GLN  56  -9.860   6.884   1.051
  460    H    MET  57           H        MET  57 -10.352   1.314   5.879
  461    HA   MET  57           HA       MET  57 -10.195   2.329   8.559
  462    HB2  MET  57           HB2      MET  57 -12.339   1.694   7.510
  463    HB3  MET  57           HB3      MET  57 -11.807   0.021   7.466
  464    HG2  MET  57           HG2      MET  57 -12.202  -0.305   9.663
  465    HG3  MET  57           HG3      MET  57 -11.765   1.344  10.101
  466    HE1  MET  57           HE1      MET  57 -14.257   0.678   7.180
  467    HE2  MET  57           HE2      MET  57 -15.808   0.535   8.010
  468    HE3  MET  57           HE3      MET  57 -14.598  -0.734   8.180
  469    H    GLY  58           H        GLY  58  -8.302   0.238   6.923
  470    HA2  GLY  58           HA2      GLY  58  -6.487  -0.940   7.708
  471    HA3  GLY  58           HA3      GLY  58  -6.973  -0.508   9.338
  472    H    LEU  59           H        LEU  59  -9.476  -1.977   7.602
  473    HA   LEU  59           HA       LEU  59  -8.966  -4.490   8.993
  474    HB2  LEU  59           HB2      LEU  59 -11.308  -5.042   8.445
  475    HB3  LEU  59           HB3      LEU  59 -11.141  -3.592   9.410
  476    HG   LEU  59           HG       LEU  59 -11.289  -2.379   7.091
  477   HD11  LEU  59          HD11      LEU  59 -12.678  -3.503   5.484
  478   HD12  LEU  59          HD12      LEU  59 -12.769  -4.934   6.505
  479   HD13  LEU  59          HD13      LEU  59 -11.232  -4.467   5.776
  480   HD21  LEU  59          HD21      LEU  59 -12.866  -2.066   8.865
  481   HD22  LEU  59          HD22      LEU  59 -13.621  -3.622   8.520
  482   HD23  LEU  59          HD23      LEU  59 -13.739  -2.307   7.352
  483    H    ALA  60           H        ALA  60  -8.939  -3.048   5.907
  484    HA   ALA  60           HA       ALA  60  -8.360  -5.686   4.725
  485    HB1  ALA  60           HB1      ALA  60  -9.638  -3.318   3.366
  486    HB2  ALA  60           HB2      ALA  60 -10.421  -4.845   3.780
  487    HB3  ALA  60           HB3      ALA  60  -9.142  -4.808   2.567
  488    H    ASP  61           H        ASP  61  -6.972  -5.425   2.691
  489    HA   ASP  61           HA       ASP  61  -4.577  -4.113   3.596
  490    HB2  ASP  61           HB2      ASP  61  -5.196  -5.859   1.220
  491    HB3  ASP  61           HB3      ASP  61  -3.614  -5.134   1.468
  492    H    SER  62           H        SER  62  -6.233  -4.054   0.429
  493    HA   SER  62           HA       SER  62  -5.803  -1.252   0.036
  494    HB2  SER  62           HB2      SER  62  -4.023  -3.202  -1.440
  495    HB3  SER  62           HB3      SER  62  -4.157  -1.486  -1.801
  496    HG   SER  62           HG       SER  62  -3.631  -1.739   0.790
  497    H    VAL  63           H        VAL  63  -6.134  -0.746  -2.430
  498    HA   VAL  63           HA       VAL  63  -8.500  -1.860  -3.436
  499    HB   VAL  63           HB       VAL  63  -6.240  -0.447  -4.871
  500   HG11  VAL  63          HG11      VAL  63  -7.438  -1.828  -6.475
  501   HG12  VAL  63          HG12      VAL  63  -7.778  -0.117  -6.743
  502   HG13  VAL  63          HG13      VAL  63  -8.974  -1.138  -5.944
  503   HG21  VAL  63          HG21      VAL  63  -7.757   1.469  -4.857
  504   HG22  VAL  63          HG22      VAL  63  -7.418   0.902  -3.220
  505   HG23  VAL  63          HG23      VAL  63  -8.958   0.512  -3.987
  506    H    LYS  64           H        LYS  64  -5.188  -2.797  -3.688
  507    HA   LYS  64           HA       LYS  64  -5.291  -4.709  -5.726
  508    HB2  LYS  64           HB2      LYS  64  -3.587  -4.630  -3.235
  509    HB3  LYS  64           HB3      LYS  64  -3.254  -5.606  -4.653
  510    HG2  LYS  64           HG2      LYS  64  -2.901  -3.629  -5.992
  511    HG3  LYS  64           HG3      LYS  64  -3.376  -2.595  -4.645
  512    HD2  LYS  64           HD2      LYS  64  -1.016  -4.484  -4.533
  513    HD3  LYS  64           HD3      LYS  64  -0.878  -2.799  -5.030
  514    HE2  LYS  64           HE2      LYS  64  -2.103  -3.592  -2.402
  515    HE3  LYS  64           HE3      LYS  64  -0.368  -3.365  -2.589
  516    HZ1  LYS  64           HZ1      LYS  64  -1.588  -1.383  -1.770
  517    HZ2  LYS  64           HZ2      LYS  64  -2.376  -1.291  -3.264
  518    HZ3  LYS  64           HZ3      LYS  64  -0.700  -1.104  -3.183
  519    H    ASP  65           H        ASP  65  -6.610  -4.756  -2.558
  520    HA   ASP  65           HA       ASP  65  -6.771  -7.661  -2.422
  521    HB2  ASP  65           HB2      ASP  65  -6.272  -6.404  -0.373
  522    HB3  ASP  65           HB3      ASP  65  -7.779  -5.517  -0.535
  523    H    PHE  66           H        PHE  66  -8.633  -5.025  -3.554
  524    HA   PHE  66           HA       PHE  66 -11.139  -6.546  -3.334
  525    HB2  PHE  66           HB2      PHE  66 -10.560  -3.612  -3.545
  526    HB3  PHE  66           HB3      PHE  66 -12.142  -4.244  -3.974
  527    HD1  PHE  66           HD1      PHE  66 -13.760  -4.220  -2.353
  528    HD2  PHE  66           HD2      PHE  66  -9.670  -4.499  -1.203
  529    HE1  PHE  66           HE1      PHE  66 -14.417  -4.150   0.009
  530    HE2  PHE  66           HE2      PHE  66 -10.329  -4.430   1.155
  531    HZ   PHE  66           HZ       PHE  66 -12.701  -4.257   1.771
  532    H    GLN  67           H        GLN  67  -9.208  -4.654  -5.661
  533    HA   GLN  67           HA       GLN  67 -11.042  -5.629  -7.737
  534    HB2  GLN  67           HB2      GLN  67 -10.482  -2.880  -6.938
  535    HB3  GLN  67           HB3      GLN  67 -10.303  -3.156  -8.673
  536    HG2  GLN  67           HG2      GLN  67 -12.595  -4.217  -8.610
  537    HG3  GLN  67           HG3      GLN  67 -12.737  -3.602  -6.963
  538   HE21  GLN  67          HE21      GLN  67 -14.455  -2.258  -7.491
  539   HE22  GLN  67          HE22      GLN  67 -14.250  -0.826  -8.438
  540    H    ARG  68           H        ARG  68  -7.808  -4.622  -6.976
  541    HA   ARG  68           HA       ARG  68  -6.997  -5.210  -9.729
  542    HB2  ARG  68           HB2      ARG  68  -5.432  -3.930  -7.483
  543    HB3  ARG  68           HB3      ARG  68  -4.822  -4.213  -9.106
  544    HG2  ARG  68           HG2      ARG  68  -6.526  -2.718 -10.010
  545    HG3  ARG  68           HG3      ARG  68  -7.139  -2.431  -8.379
  546    HD2  ARG  68           HD2      ARG  68  -4.858  -1.605  -7.765
  547    HD3  ARG  68           HD3      ARG  68  -4.424  -1.717  -9.469
  548    HE   ARG  68           HE       ARG  68  -6.706  -0.181  -9.387
  549   HH11  ARG  68          HH11      ARG  68  -3.470  -0.010  -8.087
  550   HH12  ARG  68          HH12      ARG  68  -3.446   1.724  -8.012
  551   HH21  ARG  68          HH21      ARG  68  -6.691   2.115  -9.297
  552   HH22  ARG  68          HH22      ARG  68  -5.282   2.931  -8.709
  553    H    LYS  69           H        LYS  69  -6.728  -7.337  -9.987
  554    HA   LYS  69           HA       LYS  69  -5.796  -9.126  -8.022
  555    HB2  LYS  69           HB2      LYS  69  -5.935  -9.310 -11.024
  556    HB3  LYS  69           HB3      LYS  69  -5.293 -10.619 -10.044
  557    HG2  LYS  69           HG2      LYS  69  -7.473 -10.653  -8.817
  558    HG3  LYS  69           HG3      LYS  69  -8.082  -9.504 -10.009
  559    HD2  LYS  69           HD2      LYS  69  -7.674 -11.086 -11.796
  560    HD3  LYS  69           HD3      LYS  69  -6.945 -12.219 -10.659
  561    HE2  LYS  69           HE2      LYS  69  -9.190 -12.930 -11.121
  562    HE3  LYS  69           HE3      LYS  69  -9.107 -12.343  -9.462
  563    HZ1  LYS  69           HZ1      LYS  69 -10.046 -10.231 -10.223
  564    HZ2  LYS  69           HZ2      LYS  69 -11.083 -11.529 -10.535
  565    HZ3  LYS  69           HZ3      LYS  69 -10.178 -10.849 -11.796
  566    H    GLY  70           H        GLY  70  -4.163  -6.833  -9.904
  567    HA2  GLY  70           HA2      GLY  70  -1.562  -8.031  -9.840
  568    HA3  GLY  70           HA3      GLY  70  -1.933  -6.337 -10.145
  569    H    THR  71           H        THR  71  -1.878  -8.727  -7.525
  570    HA   THR  71           HA       THR  71  -1.810  -7.034  -5.346
  571    HB   THR  71           HB       THR  71  -0.314  -8.887  -4.308
  572    HG1  THR  71           HG1      THR  71  -0.347 -10.832  -5.558
  573   HG21  THR  71          HG21      THR  71  -2.732  -8.724  -3.936
  574   HG22  THR  71          HG22      THR  71  -2.230 -10.405  -4.103
  575   HG23  THR  71          HG23      THR  71  -3.030  -9.586  -5.445
  576    H    HIS  72           H        HIS  72  -0.092  -6.137  -4.114
  577    HA   HIS  72           HA       HIS  72   1.845  -4.862  -5.671
  578    HB2  HIS  72           HB2      HIS  72   1.246  -3.826  -3.598
  579    HB3  HIS  72           HB3      HIS  72   1.714  -5.260  -2.683
  580    HD1  HIS  72           HD1      HIS  72   3.125  -2.292  -4.450
  581    HD2  HIS  72           HD2      HIS  72   4.489  -5.570  -2.312
  582    HE1  HIS  72           HE1      HIS  72   5.564  -1.919  -4.090
  583    HE2  HIS  72           HE2      HIS  72   6.243  -3.691  -2.431
  584    H    ILE  73           H        ILE  73   1.886  -7.787  -3.836
  585    HA   ILE  73           HA       ILE  73   4.716  -8.034  -4.329
  586    HB   ILE  73           HB       ILE  73   2.843  -9.329  -2.468
  587   HG12  ILE  73          HG12      ILE  73   4.122  -7.416  -1.762
  588   HG13  ILE  73          HG13      ILE  73   4.734  -8.841  -0.927
  589   HG21  ILE  73          HG21      ILE  73   4.049 -11.168  -3.749
  590   HG22  ILE  73          HG22      ILE  73   4.224 -11.180  -1.996
  591   HG23  ILE  73          HG23      ILE  73   5.526 -10.560  -3.005
  592   HD11  ILE  73          HD11      ILE  73   5.988  -7.335  -3.212
  593   HD12  ILE  73          HD12      ILE  73   6.520  -8.947  -2.736
  594   HD13  ILE  73          HD13      ILE  73   6.631  -7.608  -1.592
  595    H    VAL  74           H        VAL  74   5.205  -8.607  -6.131
  596    HA   VAL  74           HA       VAL  74   4.140 -10.386  -7.947
  597    HB   VAL  74           HB       VAL  74   7.052  -9.869  -7.285
  598   HG11  VAL  74          HG11      VAL  74   5.759 -10.735  -9.857
  599   HG12  VAL  74          HG12      VAL  74   6.815 -11.702  -8.824
  600   HG13  VAL  74          HG13      VAL  74   7.454 -10.289  -9.661
  601   HG21  VAL  74          HG21      VAL  74   6.851  -8.061  -8.995
  602   HG22  VAL  74          HG22      VAL  74   5.983  -7.765  -7.483
  603   HG23  VAL  74          HG23      VAL  74   5.099  -8.283  -8.926
  604    H    LEU  75           H        LEU  75   4.595 -12.680  -8.269
  605    HA   LEU  75           HA       LEU  75   4.522 -14.200  -5.915
  606    HB2  LEU  75           HB2      LEU  75   4.839 -16.181  -7.392
  607    HB3  LEU  75           HB3      LEU  75   3.524 -15.122  -7.862
  608    HG   LEU  75           HG       LEU  75   6.051 -14.519  -9.231
  609   HD11  LEU  75          HD11      LEU  75   4.684 -17.168  -9.698
  610   HD12  LEU  75          HD12      LEU  75   6.303 -16.937  -9.039
  611   HD13  LEU  75          HD13      LEU  75   5.955 -16.470 -10.703
  612   HD21  LEU  75          HD21      LEU  75   4.583 -14.451 -11.170
  613   HD22  LEU  75          HD22      LEU  75   3.856 -13.555  -9.838
  614   HD23  LEU  75          HD23      LEU  75   3.275 -15.170 -10.231
  615    H    TRP  76           H        TRP  76   6.300 -13.454  -4.712
  616    HA   TRP  76           HA       TRP  76   8.988 -13.895  -5.674
  617    HB2  TRP  76           HB2      TRP  76   7.838 -12.708  -3.154
  618    HB3  TRP  76           HB3      TRP  76   9.556 -13.057  -3.297
  619    HD1  TRP  76           HD1      TRP  76   6.917 -10.573  -4.359
  620    HE1  TRP  76           HE1      TRP  76   8.027  -8.587  -5.534
  621    HE3  TRP  76           HE3      TRP  76  11.628 -12.480  -4.852
  622    HZ2  TRP  76           HZ2      TRP  76  10.571  -7.910  -6.538
  623    HZ3  TRP  76           HZ3      TRP  76  13.344 -11.088  -5.936
  624    HH2  TRP  76           HH2      TRP  76  12.823  -8.857  -6.757
  625    H    THR  77           H        THR  77   9.663 -15.903  -5.687
  626    HA   THR  77           HA       THR  77   9.237 -17.567  -3.312
  627    HB   THR  77           HB       THR  77  10.195 -19.381  -4.826
  628    HG1  THR  77           HG1      THR  77  10.787 -18.826  -6.779
  629   HG21  THR  77          HG21      THR  77   7.606 -18.040  -5.628
  630   HG22  THR  77          HG22      THR  77   7.807 -19.247  -4.357
  631   HG23  THR  77          HG23      THR  77   8.066 -19.693  -6.043
  632    H    GLY  78           H        GLY  78  11.274 -19.011  -2.869
  633    HA2  GLY  78           HA2      GLY  78  13.319 -17.397  -1.922
  634    HA3  GLY  78           HA3      GLY  78  13.469 -19.125  -2.199
  635    H    ASP  79           H        ASP  79  13.068 -19.056  -5.014
  636    HA   ASP  79           HA       ASP  79  15.706 -18.407  -5.874
  637    HB2  ASP  79           HB2      ASP  79  14.865 -19.115  -8.123
  638    HB3  ASP  79           HB3      ASP  79  14.618 -20.307  -6.853
  639    H    GLN  80           H        GLN  80  12.515 -16.891  -6.355
  640    HA   GLN  80           HA       GLN  80  13.412 -15.015  -8.277
  641    HB2  GLN  80           HB2      GLN  80  10.949 -15.675  -7.264
  642    HB3  GLN  80           HB3      GLN  80  11.211 -14.073  -6.577
  643    HG2  GLN  80           HG2      GLN  80  11.830 -13.347  -8.937
  644    HG3  GLN  80           HG3      GLN  80  11.145 -14.878  -9.466
  645   HE21  GLN  80          HE21      GLN  80   9.920 -12.866  -6.837
  646   HE22  GLN  80          HE22      GLN  80   8.426 -12.486  -7.612
  647    H    GLU  81           H        GLU  81  13.155 -14.911  -4.760
  648    HA   GLU  81           HA       GLU  81  14.001 -12.237  -4.429
  649    HB2  GLU  81           HB2      GLU  81  14.372 -14.588  -2.558
  650    HB3  GLU  81           HB3      GLU  81  14.511 -12.891  -2.117
  651    HG2  GLU  81           HG2      GLU  81  12.159 -12.547  -2.644
  652    HG3  GLU  81           HG3      GLU  81  12.013 -14.237  -3.122
  653    H    LEU  82           H        LEU  82  15.680 -15.262  -4.851
  654    HA   LEU  82           HA       LEU  82  18.288 -14.349  -4.241
  655    HB2  LEU  82           HB2      LEU  82  17.606 -16.704  -4.193
  656    HB3  LEU  82           HB3      LEU  82  17.346 -16.682  -5.921
  657    HG   LEU  82           HG       LEU  82  19.472 -17.790  -4.989
  658   HD11  LEU  82          HD11      LEU  82  20.781 -17.094  -6.934
  659   HD12  LEU  82          HD12      LEU  82  19.653 -15.765  -7.207
  660   HD13  LEU  82          HD13      LEU  82  19.098 -17.435  -7.347
  661   HD21  LEU  82          HD21      LEU  82  21.379 -16.315  -4.675
  662   HD22  LEU  82          HD22      LEU  82  20.120 -15.970  -3.490
  663   HD23  LEU  82          HD23      LEU  82  20.339 -14.906  -4.880
  664    H    GLU  83           H        GLU  83  16.454 -14.623  -7.275
  665    HA   GLU  83           HA       GLU  83  18.423 -13.973  -9.117
  666    HB2  GLU  83           HB2      GLU  83  15.619 -12.871  -9.195
  667    HB3  GLU  83           HB3      GLU  83  16.693 -13.132 -10.555
  668    HG2  GLU  83           HG2      GLU  83  16.473 -15.507 -10.344
  669    HG3  GLU  83           HG3      GLU  83  15.534 -15.324  -8.858
  670    H    LEU  84           H        LEU  84  16.180 -11.762  -7.507
  671    HA   LEU  84           HA       LEU  84  17.341  -9.469  -8.729
  672    HB2  LEU  84           HB2      LEU  84  14.944  -9.690  -8.096
  673    HB3  LEU  84           HB3      LEU  84  15.418  -9.594  -6.410
  674    HG   LEU  84           HG       LEU  84  16.536  -7.360  -7.782
  675   HD11  LEU  84          HD11      LEU  84  14.760  -7.780  -9.446
  676   HD12  LEU  84          HD12      LEU  84  14.555  -6.253  -8.592
  677   HD13  LEU  84          HD13      LEU  84  13.557  -7.640  -8.165
  678   HD21  LEU  84          HD21      LEU  84  14.287  -7.546  -5.788
  679   HD22  LEU  84          HD22      LEU  84  15.270  -6.122  -6.138
  680   HD23  LEU  84          HD23      LEU  84  16.006  -7.542  -5.396
  681    H    GLN  85           H        GLN  85  17.685 -11.054  -5.613
  682    HA   GLN  85           HA       GLN  85  18.964  -9.026  -4.198
  683    HB2  GLN  85           HB2      GLN  85  18.207 -11.162  -3.205
  684    HB3  GLN  85           HB3      GLN  85  19.506 -11.999  -4.037
  685    HG2  GLN  85           HG2      GLN  85  20.523  -9.793  -2.482
  686    HG3  GLN  85           HG3      GLN  85  19.567 -10.889  -1.490
  687   HE21  GLN  85          HE21      GLN  85  21.350 -11.956  -4.301
  688   HE22  GLN  85          HE22      GLN  85  22.550 -12.850  -3.437
  689    H    ARG  86           H        ARG  86  20.375 -11.556  -6.267
  690    HA   ARG  86           HA       ARG  86  23.061 -10.681  -5.955
  691    HB2  ARG  86           HB2      ARG  86  21.874 -12.203  -8.281
  692    HB3  ARG  86           HB3      ARG  86  23.574 -12.111  -7.851
  693    HG2  ARG  86           HG2      ARG  86  23.075 -13.291  -5.746
  694    HG3  ARG  86           HG3      ARG  86  21.395 -13.445  -6.265
  695    HD2  ARG  86           HD2      ARG  86  23.815 -14.575  -7.665
  696    HD3  ARG  86           HD3      ARG  86  22.620 -15.486  -6.744
  697    HE   ARG  86           HE       ARG  86  21.239 -14.131  -8.734
  698   HH11  ARG  86          HH11      ARG  86  23.734 -16.575  -8.523
  699   HH12  ARG  86          HH12      ARG  86  23.284 -17.350 -10.004
  700   HH21  ARG  86          HH21      ARG  86  20.641 -15.149 -10.694
  701   HH22  ARG  86          HH22      ARG  86  21.524 -16.533 -11.248
  702    H    LEU  87           H        LEU  87  20.596 -10.146  -8.416
  703    HA   LEU  87           HA       LEU  87  22.216  -8.793 -10.265
  704    HB2  LEU  87           HB2      LEU  87  19.717  -9.790 -10.293
  705    HB3  LEU  87           HB3      LEU  87  19.351  -8.086 -10.118
  706    HG   LEU  87           HG       LEU  87  20.720  -7.643 -12.161
  707   HD11  LEU  87          HD11      LEU  87  21.218  -9.563 -13.621
  708   HD12  LEU  87          HD12      LEU  87  20.728 -10.654 -12.323
  709   HD13  LEU  87          HD13      LEU  87  22.135  -9.610 -12.115
  710   HD21  LEU  87          HD21      LEU  87  18.440  -9.579 -12.511
  711   HD22  LEU  87          HD22      LEU  87  19.031  -8.431 -13.712
  712   HD23  LEU  87          HD23      LEU  87  18.280  -7.849 -12.229
  713    H    PHE  88           H        PHE  88  20.197  -7.627  -7.615
  714    HA   PHE  88           HA       PHE  88  20.354  -4.890  -8.124
  715    HB2  PHE  88           HB2      PHE  88  18.794  -5.334  -6.516
  716    HB3  PHE  88           HB3      PHE  88  19.758  -6.599  -5.776
  717    HD1  PHE  88           HD1      PHE  88  19.605  -2.889  -6.136
  718    HD2  PHE  88           HD2      PHE  88  20.797  -6.222  -3.774
  719    HE1  PHE  88           HE1      PHE  88  20.206  -1.371  -4.295
  720    HE2  PHE  88           HE2      PHE  88  21.398  -4.714  -1.936
  721    HZ   PHE  88           HZ       PHE  88  21.111  -2.286  -2.193
  722    H    GLU  89           H        GLU  89  22.515  -6.969  -6.219
  723    HA   GLU  89           HA       GLU  89  24.262  -4.875  -5.420
  724    HB2  GLU  89           HB2      GLU  89  24.990  -7.767  -5.800
  725    HB3  GLU  89           HB3      GLU  89  25.753  -6.611  -4.728
  726    HG2  GLU  89           HG2      GLU  89  23.790  -6.552  -3.329
  727    HG3  GLU  89           HG3      GLU  89  22.930  -7.601  -4.454
  728    H    GLU  90           H        GLU  90  23.975  -6.836  -8.269
  729    HA   GLU  90           HA       GLU  90  26.636  -6.524  -9.198
  730    HB2  GLU  90           HB2      GLU  90  24.080  -7.479 -10.426
  731    HB3  GLU  90           HB3      GLU  90  25.547  -7.325 -11.383
  732    HG2  GLU  90           HG2      GLU  90  25.272  -8.993  -8.895
  733    HG3  GLU  90           HG3      GLU  90  25.172  -9.603 -10.545
  734    H    PHE  91           H        PHE  91  23.658  -4.725  -9.741
  735    HA   PHE  91           HA       PHE  91  25.163  -2.939 -11.540
  736    HB2  PHE  91           HB2      PHE  91  22.178  -3.406 -11.360
  737    HB3  PHE  91           HB3      PHE  91  22.954  -2.240 -12.425
  738    HD1  PHE  91           HD1      PHE  91  24.759  -3.218 -14.038
  739    HD2  PHE  91           HD2      PHE  91  21.722  -5.522 -12.140
  740    HE1  PHE  91           HE1      PHE  91  25.002  -4.956 -15.761
  741    HE2  PHE  91           HE2      PHE  91  21.970  -7.264 -13.857
  742    HZ   PHE  91           HZ       PHE  91  23.612  -6.985 -15.674
  743    H    ARG  92           H        ARG  92  24.775  -3.037  -8.490
  744    HA   ARG  92           HA       ARG  92  23.165  -0.818  -7.791
  745    HB2  ARG  92           HB2      ARG  92  23.742  -2.652  -6.235
  746    HB3  ARG  92           HB3      ARG  92  25.406  -2.083  -6.211
  747    HG2  ARG  92           HG2      ARG  92  24.794  -0.071  -5.122
  748    HG3  ARG  92           HG3      ARG  92  23.075  -0.379  -5.380
  749    HD2  ARG  92           HD2      ARG  92  23.176  -2.292  -3.890
  750    HD3  ARG  92           HD3      ARG  92  24.912  -2.056  -3.665
  751    HE   ARG  92           HE       ARG  92  23.359   0.271  -3.001
  752   HH11  ARG  92          HH11      ARG  92  24.505  -2.801  -1.765
  753   HH12  ARG  92          HH12      ARG  92  24.430  -2.303  -0.105
  754   HH21  ARG  92          HH21      ARG  92  23.245   0.924  -0.828
  755   HH22  ARG  92          HH22      ARG  92  23.711  -0.177   0.431
  756    H    ASP  93           H        ASP  93  26.537  -1.131  -8.667
  757    HA   ASP  93           HA       ASP  93  27.059   1.638  -7.917
  758    HB2  ASP  93           HB2      ASP  93  28.727  -0.167  -7.415
  759    HB3  ASP  93           HB3      ASP  93  28.970  -0.359  -9.148
  760    H    SER  94           H        SER  94  25.251   0.815 -10.153
  761    HA   SER  94           HA       SER  94  26.654   2.080 -12.405
  762    HB2  SER  94           HB2      SER  94  25.472  -0.152 -12.723
  763    HB3  SER  94           HB3      SER  94  23.955   0.707 -12.458
  764    HG   SER  94           HG       SER  94  25.744   0.848 -14.611
  765    H    ASP  95           H        ASP  95  24.691   3.315 -13.785
  766    HA   ASP  95           HA       ASP  95  24.085   5.527 -12.016
  767    HB2  ASP  95           HB2      ASP  95  23.519   6.784 -13.964
  768    HB3  ASP  95           HB3      ASP  95  24.961   5.857 -14.349
  769    H    ASP  96           H        ASP  96  22.476   2.837 -13.365
  770    HA   ASP  96           HA       ASP  96  20.178   3.422 -11.712
  771    HB2  ASP  96           HB2      ASP  96  19.436   4.429 -13.787
  772    HB3  ASP  96           HB3      ASP  96  19.895   2.991 -14.693
  773    H    VAL  97           H        VAL  97  20.147   1.670 -10.516
  774    HA   VAL  97           HA       VAL  97  21.255  -0.795 -11.444
  775    HB   VAL  97           HB       VAL  97  21.692  -0.302  -9.175
  776   HG11  VAL  97          HG11      VAL  97  19.869  -0.113  -7.472
  777   HG12  VAL  97          HG12      VAL  97  18.725   0.024  -8.805
  778   HG13  VAL  97          HG13      VAL  97  19.983   1.241  -8.593
  779   HG21  VAL  97          HG21      VAL  97  19.597  -2.462  -9.281
  780   HG22  VAL  97          HG22      VAL  97  20.753  -2.229  -7.969
  781   HG23  VAL  97          HG23      VAL  97  21.322  -2.654  -9.583
  782    H    LEU  98           H        LEU  98  17.963   0.373 -10.822
  783    HA   LEU  98           HA       LEU  98  16.860  -2.271 -11.022
  784    HB2  LEU  98           HB2      LEU  98  15.785   0.430 -10.502
  785    HB3  LEU  98           HB3      LEU  98  14.677  -0.733 -11.208
  786    HG   LEU  98           HG       LEU  98  15.226  -2.292  -9.339
  787   HD11  LEU  98          HD11      LEU  98  16.631   0.114  -8.205
  788   HD12  LEU  98          HD12      LEU  98  17.362  -1.430  -8.653
  789   HD13  LEU  98          HD13      LEU  98  16.227  -1.349  -7.305
  790   HD21  LEU  98          HD21      LEU  98  13.211  -0.905  -9.342
  791   HD22  LEU  98          HD22      LEU  98  14.096   0.368  -8.502
  792   HD23  LEU  98          HD23      LEU  98  13.823  -1.187  -7.714
  793    H    GLY  99           H        GLY  99  17.239   0.455 -13.207
  794    HA2  GLY  99           HA2      GLY  99  15.600  -0.510 -15.292
  795    HA3  GLY  99           HA3      GLY  99  16.988   0.561 -15.492
  796    H    HIS 100           H        HIS 100  18.828  -1.335 -14.265
  797    HA   HIS 100           HA       HIS 100  19.371  -2.886 -16.648
  798    HB2  HIS 100           HB2      HIS 100  20.918  -2.337 -14.125
  799    HB3  HIS 100           HB3      HIS 100  21.421  -3.609 -15.234
  800    HD1  HIS 100           HD1      HIS 100  23.060  -2.871 -16.927
  801    HD2  HIS 100           HD2      HIS 100  20.657   0.268 -15.633
  802    HE1  HIS 100           HE1      HIS 100  23.931  -0.828 -18.097
  803    HE2  HIS 100           HE2      HIS 100  22.331   1.012 -17.456
  804    H    ILE 101           H        ILE 101  18.292  -3.342 -13.367
  805    HA   ILE 101           HA       ILE 101  18.406  -6.128 -13.212
  806    HB   ILE 101           HB       ILE 101  16.459  -4.170 -11.994
  807   HG12  ILE 101          HG12      ILE 101  18.745  -5.780 -10.830
  808   HG13  ILE 101          HG13      ILE 101  18.770  -4.054 -11.176
  809   HG21  ILE 101          HG21      ILE 101  15.672  -5.974 -10.547
  810   HG22  ILE 101          HG22      ILE 101  16.656  -7.127 -11.444
  811   HG23  ILE 101          HG23      ILE 101  15.318  -6.305 -12.244
  812   HD11  ILE 101          HD11      ILE 101  17.011  -3.708  -9.506
  813   HD12  ILE 101          HD12      ILE 101  18.452  -4.450  -8.812
  814   HD13  ILE 101          HD13      ILE 101  17.027  -5.433  -9.148
  815    H    MET 102           H        MET 102  15.713  -4.042 -14.272
  816    HA   MET 102           HA       MET 102  13.924  -6.045 -14.945
  817    HB2  MET 102           HB2      MET 102  14.297  -3.287 -16.093
  818    HB3  MET 102           HB3      MET 102  12.960  -4.339 -16.542
  819    HG2  MET 102           HG2      MET 102  12.270  -4.426 -14.192
  820    HG3  MET 102           HG3      MET 102  13.570  -3.310 -13.785
  821    HE1  MET 102           HE1      MET 102  10.189  -3.284 -13.586
  822    HE2  MET 102           HE2      MET 102   9.918  -1.544 -13.692
  823    HE3  MET 102           HE3      MET 102  11.201  -2.174 -12.660
  824    H    LYS 103           H        LYS 103  16.413  -4.548 -16.969
  825    HA   LYS 103           HA       LYS 103  15.608  -5.942 -19.318
  826    HB2  LYS 103           HB2      LYS 103  17.864  -4.161 -18.581
  827    HB3  LYS 103           HB3      LYS 103  18.088  -5.209 -19.975
  828    HG2  LYS 103           HG2      LYS 103  17.273  -3.048 -20.679
  829    HG3  LYS 103           HG3      LYS 103  16.055  -4.284 -20.988
  830    HD2  LYS 103           HD2      LYS 103  14.949  -3.614 -18.846
  831    HD3  LYS 103           HD3      LYS 103  16.095  -2.277 -18.740
  832    HE2  LYS 103           HE2      LYS 103  14.069  -2.759 -20.918
  833    HE3  LYS 103           HE3      LYS 103  14.028  -1.486 -19.700
  834    HZ1  LYS 103           HZ1      LYS 103  16.062  -1.788 -21.840
  835    HZ2  LYS 103           HZ2      LYS 103  16.068  -0.583 -20.657
  836    HZ3  LYS 103           HZ3      LYS 103  14.825  -0.639 -21.799
  837    H    ASN 104           H        ASN 104  17.626  -6.785 -16.647
  838    HA   ASN 104           HA       ASN 104  18.729  -9.033 -18.205
  839    HB2  ASN 104           HB2      ASN 104  20.317  -7.317 -17.193
  840    HB3  ASN 104           HB3      ASN 104  19.854  -7.960 -15.623
  841   HD21  ASN 104          HD21      ASN 104  21.946  -8.656 -15.192
  842   HD22  ASN 104          HD22      ASN 104  22.643 -10.031 -15.974
  843    H    ILE 105           H        ILE 105  16.120  -8.741 -16.600
  844    HA   ILE 105           HA       ILE 105  16.563 -11.085 -14.873
  845    HB   ILE 105           HB       ILE 105  15.961  -8.995 -13.649
  846   HG12  ILE 105          HG12      ILE 105  14.221 -10.034 -12.224
  847   HG13  ILE 105          HG13      ILE 105  13.990 -11.270 -13.457
  848   HG21  ILE 105          HG21      ILE 105  14.439  -8.040 -15.298
  849   HG22  ILE 105          HG22      ILE 105  13.658  -8.187 -13.723
  850   HG23  ILE 105          HG23      ILE 105  13.296  -9.348 -15.000
  851   HD11  ILE 105          HD11      ILE 105  16.246 -12.065 -13.126
  852   HD12  ILE 105          HD12      ILE 105  15.383 -12.027 -11.590
  853   HD13  ILE 105          HD13      ILE 105  16.558 -10.768 -11.973
  854    H    THR 106           H        THR 106  14.657 -12.447 -14.569
  855    HA   THR 106           HA       THR 106  13.607 -13.141 -17.145
  856    HB   THR 106           HB       THR 106  14.539 -14.766 -15.498
  857    HG1  THR 106           HG1      THR 106  12.018 -15.792 -15.802
  858   HG21  THR 106          HG21      THR 106  13.573 -13.912 -13.449
  859   HG22  THR 106          HG22      THR 106  13.060 -15.581 -13.702
  860   HG23  THR 106          HG23      THR 106  11.947 -14.254 -14.042
  861    H    ALA 107           H        ALA 107  12.326 -11.834 -14.118
  862    HA   ALA 107           HA       ALA 107   9.659 -11.733 -15.359
  863    HB1  ALA 107           HB1      ALA 107   8.763 -11.470 -13.088
  864    HB2  ALA 107           HB2      ALA 107  10.396 -11.577 -12.434
  865    HB3  ALA 107           HB3      ALA 107   9.682 -12.969 -13.255
  866    H    LYS 108           H        LYS 108   8.897  -9.793 -15.930
  867    HA   LYS 108           HA       LYS 108  10.358  -7.421 -15.151
  868    HB2  LYS 108           HB2      LYS 108   8.172  -8.010 -17.092
  869    HB3  LYS 108           HB3      LYS 108   8.308  -6.365 -16.484
  870    HG2  LYS 108           HG2      LYS 108   9.500  -6.607 -18.577
  871    HG3  LYS 108           HG3      LYS 108  10.625  -6.267 -17.262
  872    HD2  LYS 108           HD2      LYS 108  11.054  -8.737 -17.121
  873    HD3  LYS 108           HD3      LYS 108  10.100  -8.919 -18.594
  874    HE2  LYS 108           HE2      LYS 108  12.584  -7.232 -18.320
  875    HE3  LYS 108           HE3      LYS 108  12.519  -8.838 -19.041
  876    HZ1  LYS 108           HZ1      LYS 108  12.468  -7.165 -20.745
  877    HZ2  LYS 108           HZ2      LYS 108  11.134  -6.410 -20.035
  878    HZ3  LYS 108           HZ3      LYS 108  10.972  -7.954 -20.702
  879    H    ARG 109           H        ARG 109  10.070  -6.872 -13.132
  880    HA   ARG 109           HA       ARG 109   7.330  -6.657 -12.104
  881    HB2  ARG 109           HB2      ARG 109   8.542  -6.866  -9.811
  882    HB3  ARG 109           HB3      ARG 109   8.216  -8.312 -10.754
  883    HG2  ARG 109           HG2      ARG 109  10.543  -8.215 -11.615
  884    HG3  ARG 109           HG3      ARG 109  10.843  -6.855 -10.531
  885    HD2  ARG 109           HD2      ARG 109  10.476  -8.195  -8.609
  886    HD3  ARG 109           HD3      ARG 109   9.829  -9.522  -9.564
  887    HE   ARG 109           HE       ARG 109  12.660  -8.721  -9.407
  888   HH11  ARG 109          HH11      ARG 109  10.229 -11.022 -10.401
  889   HH12  ARG 109          HH12      ARG 109  11.354 -12.328 -10.593
  890   HH21  ARG 109          HH21      ARG 109  14.153 -10.472  -9.656
  891   HH22  ARG 109          HH22      ARG 109  13.570 -12.033 -10.168
  892    H    SER 110           H        SER 110   6.825  -4.878 -10.863
  893    HA   SER 110           HA       SER 110   7.882  -2.507 -11.964
  894    HB2  SER 110           HB2      SER 110   5.520  -2.757 -11.293
  895    HB3  SER 110           HB3      SER 110   6.011  -2.841  -9.604
  896    HG   SER 110           HG       SER 110   6.462  -0.634 -11.340
  897    H    ARG 111           H        ARG 111   8.937  -0.760 -10.966
  898    HA   ARG 111           HA       ARG 111  11.106  -1.580  -9.345
  899    HB2  ARG 111           HB2      ARG 111  10.198   1.188 -10.123
  900    HB3  ARG 111           HB3      ARG 111  11.730   0.818  -9.339
  901    HG2  ARG 111           HG2      ARG 111  12.321  -0.610 -11.265
  902    HG3  ARG 111           HG3      ARG 111  10.823  -0.109 -12.052
  903    HD2  ARG 111           HD2      ARG 111  11.564   2.211 -11.991
  904    HD3  ARG 111           HD3      ARG 111  13.056   1.716 -11.190
  905    HE   ARG 111           HE       ARG 111  12.804   0.258 -13.566
  906   HH11  ARG 111          HH11      ARG 111  13.351   3.545 -12.511
  907   HH12  ARG 111          HH12      ARG 111  14.246   3.988 -13.929
  908   HH21  ARG 111          HH21      ARG 111  13.981   0.849 -15.448
  909   HH22  ARG 111          HH22      ARG 111  14.613   2.458 -15.580
  910    H    ALA 112           H        ALA 112   8.162   0.253  -8.672
  911    HA   ALA 112           HA       ALA 112   8.759   0.938  -6.020
  912    HB1  ALA 112           HB1      ALA 112   6.369   1.236  -5.709
  913    HB2  ALA 112           HB2      ALA 112   6.039   0.299  -7.166
  914    HB3  ALA 112           HB3      ALA 112   6.848   1.860  -7.288
  915    H    ARG 113           H        ARG 113   7.683  -2.011  -7.494
  916    HA   ARG 113           HA       ARG 113   7.100  -3.391  -5.040
  917    HB2  ARG 113           HB2      ARG 113   7.573  -4.362  -7.859
  918    HB3  ARG 113           HB3      ARG 113   7.159  -5.422  -6.522
  919    HG2  ARG 113           HG2      ARG 113   5.017  -4.386  -6.280
  920    HG3  ARG 113           HG3      ARG 113   5.433  -3.146  -7.469
  921    HD2  ARG 113           HD2      ARG 113   5.302  -4.608  -9.233
  922    HD3  ARG 113           HD3      ARG 113   5.643  -6.008  -8.235
  923    HE   ARG 113           HE       ARG 113   3.303  -5.624  -7.339
  924   HH11  ARG 113          HH11      ARG 113   4.208  -4.701 -10.604
  925   HH12  ARG 113          HH12      ARG 113   2.620  -4.948 -11.244
  926   HH21  ARG 113          HH21      ARG 113   1.214  -5.969  -8.207
  927   HH22  ARG 113          HH22      ARG 113   0.925  -5.659  -9.891
  928    H    ILE 114           H        ILE 114   9.777  -3.204  -7.319
  929    HA   ILE 114           HA       ILE 114  11.403  -5.198  -6.237
  930    HB   ILE 114           HB       ILE 114  12.147  -2.691  -7.747
  931   HG12  ILE 114          HG12      ILE 114  12.005  -5.572  -8.658
  932   HG13  ILE 114          HG13      ILE 114  10.745  -4.373  -8.938
  933   HG21  ILE 114          HG21      ILE 114  14.068  -3.411  -6.443
  934   HG22  ILE 114          HG22      ILE 114  14.327  -3.759  -8.154
  935   HG23  ILE 114          HG23      ILE 114  13.881  -5.057  -7.050
  936   HD11  ILE 114          HD11      ILE 114  12.140  -4.675 -10.910
  937   HD12  ILE 114          HD12      ILE 114  13.569  -4.235  -9.977
  938   HD13  ILE 114          HD13      ILE 114  12.307  -3.039 -10.267
  939    H    VAL 115           H        VAL 115  11.526  -1.667  -5.743
  940    HA   VAL 115           HA       VAL 115  13.640  -1.733  -3.888
  941    HB   VAL 115           HB       VAL 115  13.091   0.558  -3.340
  942   HG11  VAL 115          HG11      VAL 115  13.163   1.549  -5.571
  943   HG12  VAL 115          HG12      VAL 115  12.659   0.011  -6.271
  944   HG13  VAL 115          HG13      VAL 115  14.219   0.142  -5.460
  945   HG21  VAL 115          HG21      VAL 115  10.553   0.183  -4.920
  946   HG22  VAL 115          HG22      VAL 115  11.115   1.681  -4.174
  947   HG23  VAL 115          HG23      VAL 115  10.652   0.310  -3.164
  948    H    ASP 116           H        ASP 116  10.156  -1.958  -3.503
  949    HA   ASP 116           HA       ASP 116  10.095  -1.762  -0.686
  950    HB2  ASP 116           HB2      ASP 116   8.087  -1.496  -2.042
  951    HB3  ASP 116           HB3      ASP 116   8.221  -3.161  -2.596
  952    H    LYS 117           H        LYS 117  10.602  -4.429  -2.911
  953    HA   LYS 117           HA       LYS 117  10.557  -6.486  -0.954
  954    HB2  LYS 117           HB2      LYS 117  10.238  -7.081  -3.261
  955    HB3  LYS 117           HB3      LYS 117  11.777  -6.364  -3.712
  956    HG2  LYS 117           HG2      LYS 117  12.324  -8.576  -3.693
  957    HG3  LYS 117           HG3      LYS 117  12.755  -8.116  -2.050
  958    HD2  LYS 117           HD2      LYS 117  10.195  -9.486  -2.903
  959    HD3  LYS 117           HD3      LYS 117  11.575 -10.245  -2.110
  960    HE2  LYS 117           HE2      LYS 117  10.329  -9.920  -0.266
  961    HE3  LYS 117           HE3      LYS 117  11.089  -8.332  -0.322
  962    HZ1  LYS 117           HZ1      LYS 117   8.395  -9.033  -1.358
  963    HZ2  LYS 117           HZ2      LYS 117   9.119  -7.511  -1.506
  964    HZ3  LYS 117           HZ3      LYS 117   8.730  -8.115   0.021
  965    H    LEU 118           H        LEU 118  13.118  -4.500  -2.365
  966    HA   LEU 118           HA       LEU 118  15.364  -5.627  -1.176
  967    HB2  LEU 118           HB2      LEU 118  14.605  -2.975  -2.181
  968    HB3  LEU 118           HB3      LEU 118  15.874  -2.954  -0.973
  969    HG   LEU 118           HG       LEU 118  17.171  -4.543  -2.395
  970   HD11  LEU 118          HD11      LEU 118  14.996  -3.949  -4.396
  971   HD12  LEU 118          HD12      LEU 118  15.326  -5.512  -3.648
  972   HD13  LEU 118          HD13      LEU 118  16.510  -4.789  -4.739
  973   HD21  LEU 118          HD21      LEU 118  17.867  -2.848  -3.980
  974   HD22  LEU 118          HD22      LEU 118  17.568  -2.133  -2.392
  975   HD23  LEU 118          HD23      LEU 118  16.381  -1.945  -3.687
  976    H    LEU 119           H        LEU 119  13.138  -3.208   0.085
  977    HA   LEU 119           HA       LEU 119  14.415  -2.771   2.551
  978    HB2  LEU 119           HB2      LEU 119  11.686  -2.278   1.440
  979    HB3  LEU 119           HB3      LEU 119  11.934  -2.103   3.167
  980    HG   LEU 119           HG       LEU 119  12.101   0.044   1.901
  981   HD11  LEU 119          HD11      LEU 119  13.117  -0.215   4.089
  982   HD12  LEU 119          HD12      LEU 119  14.107   0.819   3.059
  983   HD13  LEU 119          HD13      LEU 119  14.585  -0.854   3.348
  984   HD21  LEU 119          HD21      LEU 119  14.612  -1.210   0.781
  985   HD22  LEU 119          HD22      LEU 119  14.196   0.500   0.663
  986   HD23  LEU 119          HD23      LEU 119  13.187  -0.711  -0.130
  987    H    ALA 120           H        ALA 120  12.263  -5.262   1.437
  988    HA   ALA 120           HA       ALA 120  11.575  -6.132   4.114
  989    HB1  ALA 120           HB1      ALA 120  10.987  -7.483   1.489
  990    HB2  ALA 120           HB2      ALA 120   9.994  -6.205   2.190
  991    HB3  ALA 120           HB3      ALA 120  10.179  -7.745   3.036
  992    H    LEU 121           H        LEU 121  13.727  -7.044   1.504
  993    HA   LEU 121           HA       LEU 121  14.650  -9.469   2.711
  994    HB2  LEU 121           HB2      LEU 121  15.898  -7.699   0.613
  995    HB3  LEU 121           HB3      LEU 121  16.490  -9.285   1.056
  996    HG   LEU 121           HG       LEU 121  13.784  -8.736  -0.167
  997   HD11  LEU 121          HD11      LEU 121  16.308  -9.844  -1.387
  998   HD12  LEU 121          HD12      LEU 121  15.610  -8.258  -1.713
  999   HD13  LEU 121          HD13      LEU 121  14.740  -9.719  -2.188
 1000   HD21  LEU 121          HD21      LEU 121  13.712 -11.168  -0.475
 1001   HD22  LEU 121          HD22      LEU 121  13.804 -10.732   1.232
 1002   HD23  LEU 121          HD23      LEU 121  15.239 -11.320   0.393
 1003    H    GLY 122           H        GLY 122  15.341  -6.126   3.059
 1004    HA2  GLY 122           HA2      GLY 122  16.661  -5.069   4.636
 1005    HA3  GLY 122           HA3      GLY 122  17.279  -6.642   5.137
 1006    H    LEU 123           H        LEU 123  17.241  -5.458   1.833
 1007    HA   LEU 123           HA       LEU 123  20.094  -5.851   1.618
 1008    HB2  LEU 123           HB2      LEU 123  18.022  -4.873  -0.346
 1009    HB3  LEU 123           HB3      LEU 123  19.714  -5.106  -0.744
 1010    HG   LEU 123           HG       LEU 123  17.790  -7.269   0.122
 1011   HD11  LEU 123          HD11      LEU 123  17.298  -6.530  -2.115
 1012   HD12  LEU 123          HD12      LEU 123  18.111  -8.094  -2.189
 1013   HD13  LEU 123          HD13      LEU 123  19.002  -6.616  -2.559
 1014   HD21  LEU 123          HD21      LEU 123  20.052  -7.733   0.881
 1015   HD22  LEU 123          HD22      LEU 123  20.671  -7.438  -0.743
 1016   HD23  LEU 123          HD23      LEU 123  19.607  -8.812  -0.441
 1017    H    VAL 124           H        VAL 124  17.835  -3.316   2.033
 1018    HA   VAL 124           HA       VAL 124  19.967  -1.390   2.518
 1019    HB   VAL 124           HB       VAL 124  18.720   0.379   1.276
 1020   HG11  VAL 124          HG11      VAL 124  19.659  -1.920  -0.437
 1021   HG12  VAL 124          HG12      VAL 124  20.693  -0.690   0.287
 1022   HG13  VAL 124          HG13      VAL 124  19.514  -0.239  -0.945
 1023   HG21  VAL 124          HG21      VAL 124  17.173  -1.977   0.221
 1024   HG22  VAL 124          HG22      VAL 124  17.094  -0.344  -0.437
 1025   HG23  VAL 124          HG23      VAL 124  16.545  -0.659   1.208
 1026    H    ALA 125           H        ALA 125  18.888   0.682   3.418
 1027    HA   ALA 125           HA       ALA 125  16.697  -0.156   5.215
 1028    HB1  ALA 125           HB1      ALA 125  18.747   0.439   6.376
 1029    HB2  ALA 125           HB2      ALA 125  17.473   1.601   6.736
 1030    HB3  ALA 125           HB3      ALA 125  18.752   2.017   5.593
 1031    H    GLU 126           H        GLU 126  17.371   1.646   2.527
 1032    HA   GLU 126           HA       GLU 126  14.827   2.960   2.553
 1033    HB2  GLU 126           HB2      GLU 126  15.660   5.234   2.377
 1034    HB3  GLU 126           HB3      GLU 126  16.183   4.526   3.898
 1035    HG2  GLU 126           HG2      GLU 126  18.385   4.102   2.964
 1036    HG3  GLU 126           HG3      GLU 126  17.870   4.760   1.418
 1037    H    ARG 127           H        ARG 127  14.658   4.385   0.482
 1038    HA   ARG 127           HA       ARG 127  15.606   2.786  -1.703
 1039    HB2  ARG 127           HB2      ARG 127  13.908   5.253  -1.534
 1040    HB3  ARG 127           HB3      ARG 127  14.517   4.694  -3.082
 1041    HG2  ARG 127           HG2      ARG 127  12.360   3.808  -2.901
 1042    HG3  ARG 127           HG3      ARG 127  13.444   2.465  -2.552
 1043    HD2  ARG 127           HD2      ARG 127  13.046   2.705  -0.189
 1044    HD3  ARG 127           HD3      ARG 127  12.087   4.159  -0.463
 1045    HE   ARG 127           HE       ARG 127  10.816   2.248  -1.923
 1046   HH11  ARG 127          HH11      ARG 127  11.762   2.541   1.428
 1047   HH12  ARG 127          HH12      ARG 127  10.450   1.572   2.019
 1048   HH21  ARG 127          HH21      ARG 127   9.083   0.971  -1.152
 1049   HH22  ARG 127          HH22      ARG 127   8.944   0.659   0.552
 1050    H    ARG 128           H        ARG 128  16.726   5.607  -0.096
 1051    HA   ARG 128           HA       ARG 128  18.150   6.872  -2.132
 1052    HB2  ARG 128           HB2      ARG 128  18.040   8.193  -0.290
 1053    HB3  ARG 128           HB3      ARG 128  18.228   6.850   0.824
 1054    HG2  ARG 128           HG2      ARG 128  20.608   6.808   0.442
 1055    HG3  ARG 128           HG3      ARG 128  20.460   8.073  -0.785
 1056    HD2  ARG 128           HD2      ARG 128  19.653   9.626   0.895
 1057    HD3  ARG 128           HD3      ARG 128  19.715   8.361   2.120
 1058    HE   ARG 128           HE       ARG 128  21.990   9.750   0.918
 1059   HH11  ARG 128          HH11      ARG 128  20.776   7.302   3.117
 1060   HH12  ARG 128          HH12      ARG 128  22.232   7.264   4.073
 1061   HH21  ARG 128          HH21      ARG 128  23.904   9.711   2.178
 1062   HH22  ARG 128          HH22      ARG 128  24.010   8.639   3.540
 1063    H    GLU 129           H        GLU 129  19.029   4.043  -0.230
 1064    HA   GLU 129           HA       GLU 129  21.810   4.176  -0.851
 1065    HB2  GLU 129           HB2      GLU 129  20.176   1.815   0.075
 1066    HB3  GLU 129           HB3      GLU 129  21.931   1.901   0.057
 1067    HG2  GLU 129           HG2      GLU 129  21.748   3.855   1.616
 1068    HG3  GLU 129           HG3      GLU 129  20.029   3.484   1.748
 1069    H    LEU 130           H        LEU 130  19.169   3.360  -2.734
 1070    HA   LEU 130           HA       LEU 130  20.828   1.712  -4.511
 1071    HB2  LEU 130           HB2      LEU 130  18.408   1.294  -5.541
 1072    HB3  LEU 130           HB3      LEU 130  19.075   0.314  -4.254
 1073    HG   LEU 130           HG       LEU 130  17.408   2.693  -3.548
 1074   HD11  LEU 130          HD11      LEU 130  16.093   1.556  -5.218
 1075   HD12  LEU 130          HD12      LEU 130  15.418   1.265  -3.615
 1076   HD13  LEU 130          HD13      LEU 130  16.365   0.010  -4.415
 1077   HD21  LEU 130          HD21      LEU 130  17.932  -0.005  -2.301
 1078   HD22  LEU 130          HD22      LEU 130  16.754   1.154  -1.685
 1079   HD23  LEU 130          HD23      LEU 130  18.469   1.574  -1.715
 1080    H    TYR 131           H        TYR 131  20.085   4.779  -4.114
 1081    HA   TYR 131           HA       TYR 131  20.171   5.294  -7.015
 1082    HB2  TYR 131           HB2      TYR 131  18.873   6.971  -4.856
 1083    HB3  TYR 131           HB3      TYR 131  19.188   7.555  -6.485
 1084    HD1  TYR 131           HD1      TYR 131  16.889   5.855  -4.377
 1085    HD2  TYR 131           HD2      TYR 131  18.119   6.247  -8.423
 1086    HE1  TYR 131           HE1      TYR 131  14.735   4.941  -5.110
 1087    HE2  TYR 131           HE2      TYR 131  15.967   5.330  -9.172
 1088    HH   TYR 131           HH       TYR 131  14.141   4.029  -8.380
 1089    H    LYS 132           H        LYS 132  21.960   6.321  -7.670
 1090    HA   LYS 132           HA       LYS 132  24.173   6.420  -6.051
 1091    HB2  LYS 132           HB2      LYS 132  23.568   7.652  -8.701
 1092    HB3  LYS 132           HB3      LYS 132  25.074   8.047  -7.887
 1093    HG2  LYS 132           HG2      LYS 132  24.159   5.270  -8.603
 1094    HG3  LYS 132           HG3      LYS 132  25.339   6.227  -9.498
 1095    HD2  LYS 132           HD2      LYS 132  26.777   6.287  -7.495
 1096    HD3  LYS 132           HD3      LYS 132  25.610   5.276  -6.645
 1097    HE2  LYS 132           HE2      LYS 132  27.396   3.893  -7.445
 1098    HE3  LYS 132           HE3      LYS 132  25.933   3.532  -8.358
 1099    HZ1  LYS 132           HZ1      LYS 132  26.748   4.891 -10.162
 1100    HZ2  LYS 132           HZ2      LYS 132  27.880   3.691  -9.785
 1101    HZ3  LYS 132           HZ3      LYS 132  28.138   5.285  -9.285
 1102    H    LYS 133           H        LYS 133  24.297   7.478  -4.274
 1103    HA   LYS 133           HA       LYS 133  24.152  10.415  -4.398
 1104    HB2  LYS 133           HB2      LYS 133  23.663   8.606  -2.017
 1105    HB3  LYS 133           HB3      LYS 133  23.712  10.360  -1.955
 1106    HG2  LYS 133           HG2      LYS 133  21.717   8.760  -3.537
 1107    HG3  LYS 133           HG3      LYS 133  21.434   9.420  -1.927
 1108    HD2  LYS 133           HD2      LYS 133  21.935  11.689  -2.870
 1109    HD3  LYS 133           HD3      LYS 133  21.951  10.947  -4.472
 1110    HE2  LYS 133           HE2      LYS 133  19.637  10.974  -2.538
 1111    HE3  LYS 133           HE3      LYS 133  19.779  11.938  -4.006
 1112    HZ1  LYS 133           HZ1      LYS 133  19.764   9.924  -5.309
 1113    HZ2  LYS 133           HZ2      LYS 133  18.388   9.983  -4.329
 1114    HZ3  LYS 133           HZ3      LYS 133  19.680   8.974  -3.912
 1115    H    ARG 134           H        ARG 134  25.733  11.412  -2.824
 1116    HA   ARG 134           HA       ARG 134  28.206   9.879  -2.879
 1117    HB2  ARG 134           HB2      ARG 134  27.736  12.736  -2.005
 1118    HB3  ARG 134           HB3      ARG 134  29.301  11.957  -2.191
 1119    HG2  ARG 134           HG2      ARG 134  27.336  12.691  -4.340
 1120    HG3  ARG 134           HG3      ARG 134  28.981  13.287  -4.112
 1121    HD2  ARG 134           HD2      ARG 134  29.776  10.934  -4.506
 1122    HD3  ARG 134           HD3      ARG 134  28.121  10.526  -4.965
 1123    HE   ARG 134           HE       ARG 134  29.082  12.763  -6.437
 1124   HH11  ARG 134          HH11      ARG 134  29.241   9.265  -6.246
 1125   HH12  ARG 134          HH12      ARG 134  29.685   9.066  -7.910
 1126   HH21  ARG 134          HH21      ARG 134  29.663  12.497  -8.629
 1127   HH22  ARG 134          HH22      ARG 134  29.919  10.909  -9.269
 1128    H    GLN 135           H        GLN 135  27.554   8.320  -1.376
 1129    HA   GLN 135           HA       GLN 135  26.925   9.205   1.317
 1130    HB2  GLN 135           HB2      GLN 135  27.059   6.426   0.144
 1131    HB3  GLN 135           HB3      GLN 135  26.559   6.810   1.784
 1132    HG2  GLN 135           HG2      GLN 135  24.704   8.165   0.839
 1133    HG3  GLN 135           HG3      GLN 135  25.176   7.613  -0.765
 1134   HE21  GLN 135          HE21      GLN 135  25.321   5.593   2.086
 1135   HE22  GLN 135          HE22      GLN 135  24.037   4.533   1.635
 1136    H    LYS 136           H        LYS 136  28.054   8.558   3.133
 1137    HA   LYS 136           HA       LYS 136  30.920   8.186   2.662
 1138    HB2  LYS 136           HB2      LYS 136  29.333   9.272   4.992
 1139    HB3  LYS 136           HB3      LYS 136  31.035   8.866   5.133
 1140    HG2  LYS 136           HG2      LYS 136  30.756  11.242   4.771
 1141    HG3  LYS 136           HG3      LYS 136  31.578  10.503   3.402
 1142    HD2  LYS 136           HD2      LYS 136  29.944  12.140   2.649
 1143    HD3  LYS 136           HD3      LYS 136  29.477  10.520   2.138
 1144    HE2  LYS 136           HE2      LYS 136  27.525  11.679   2.916
 1145    HE3  LYS 136           HE3      LYS 136  27.929  10.412   4.071
 1146    HZ1  LYS 136           HZ1      LYS 136  28.481  13.311   4.359
 1147    HZ2  LYS 136           HZ2      LYS 136  29.017  12.128   5.436
 1148    HZ3  LYS 136           HZ3      LYS 136  27.364  12.400   5.239
 1149    H    LYS 137           H        LYS 137  31.946   6.920   4.683
 1150    HA   LYS 137           HA       LYS 137  30.849   4.309   4.547
 1151    HB2  LYS 137           HB2      LYS 137  32.665   3.562   5.880
 1152    HB3  LYS 137           HB3      LYS 137  33.291   4.788   4.801
 1153    HG2  LYS 137           HG2      LYS 137  32.628   5.242   7.702
 1154    HG3  LYS 137           HG3      LYS 137  34.231   4.861   7.088
 1155    HD2  LYS 137           HD2      LYS 137  34.518   7.076   6.988
 1156    HD3  LYS 137           HD3      LYS 137  33.512   7.006   5.542
 1157    HE2  LYS 137           HE2      LYS 137  31.535   7.520   6.833
 1158    HE3  LYS 137           HE3      LYS 137  32.459   7.421   8.336
 1159    HZ1  LYS 137           HZ1      LYS 137  32.892   9.425   6.185
 1160    HZ2  LYS 137           HZ2      LYS 137  33.765   9.322   7.626
 1161    HZ3  LYS 137           HZ3      LYS 137  32.124   9.713   7.663
 1162    H    LEU 138           H        LEU 138  28.817   4.283   5.288
 1163    HA   LEU 138           HA       LEU 138  28.468   4.548   8.182
 1164    HB2  LEU 138           HB2      LEU 138  27.777   6.624   6.880
 1165    HB3  LEU 138           HB3      LEU 138  26.507   5.648   6.162
 1166    HG   LEU 138           HG       LEU 138  26.685   5.911   9.149
 1167   HD11  LEU 138          HD11      LEU 138  25.232   7.864   9.028
 1168   HD12  LEU 138          HD12      LEU 138  25.348   7.852   7.269
 1169   HD13  LEU 138          HD13      LEU 138  26.778   8.185   8.245
 1170   HD21  LEU 138          HD21      LEU 138  24.391   5.530   7.225
 1171   HD22  LEU 138          HD22      LEU 138  24.254   5.632   8.980
 1172   HD23  LEU 138          HD23      LEU 138  25.115   4.283   8.240
 1173    H    ALA 139           H        ALA 139  26.777   3.222   9.014
 1174    HA   ALA 139           HA       ALA 139  26.375   0.777   7.593
 1175    HB1  ALA 139           HB1      ALA 139  26.611   1.018  10.082
 1176    HB2  ALA 139           HB2      ALA 139  25.253   0.026   9.565
 1177    HB3  ALA 139           HB3      ALA 139  24.977   1.681  10.111
 1178    H    SER 140           H        SER 140  23.657   0.219   8.406
 1179    HA   SER 140           HA       SER 140  22.182   1.138   6.216
 1180    HB2  SER 140           HB2      SER 140  21.226   0.059   8.879
 1181    HB3  SER 140           HB3      SER 140  20.227   0.219   7.439
 1182    HG   SER 140           HG       SER 140  21.468  -1.316   6.409
 1183    H    SER 141           H        SER 141  21.533   3.138   5.820
 1184    HA   SER 141           HA       SER 141  21.551   5.184   7.786
 1185    HB2  SER 141           HB2      SER 141  20.603   5.139   4.911
 1186    HB3  SER 141           HB3      SER 141  20.587   6.591   5.912
 1187    HG   SER 141           HG       SER 141  22.829   5.042   5.117
  Start of MODEL    3
    1    H1   ASP   1           HT1      ASP   1 -17.894  11.001 -10.753
    2    H2   ASP   1           HT2      ASP   1 -17.691   9.817  -9.564
    3    H3   ASP   1           HT3      ASP   1 -17.030  11.354  -9.342
    4    HA   ASP   1           HA       ASP   1 -19.018  11.070  -8.017
    5    HB2  ASP   1           HB2      ASP   1 -18.339  13.276  -9.205
    6    HB3  ASP   1           HB3      ASP   1 -19.689  12.940 -10.283
    7    HA   PRO   2           HA       PRO   2 -21.584   8.106 -10.109
    8    HB2  PRO   2           HB2      PRO   2 -23.238   7.548  -8.029
    9    HB3  PRO   2           HB3      PRO   2 -21.584   6.936  -8.145
   10    HG2  PRO   2           HG2      PRO   2 -22.641   9.258  -6.581
   11    HG3  PRO   2           HG3      PRO   2 -21.463   8.023  -6.097
   12    HD2  PRO   2           HD2      PRO   2 -20.739  10.511  -6.901
   13    HD3  PRO   2           HD3      PRO   2 -19.726   9.079  -7.172
   14    H    SER   3           H        SER   3 -23.224  10.548  -8.105
   15    HA   SER   3           HA       SER   3 -25.087  11.076 -10.271
   16    HB2  SER   3           HB2      SER   3 -26.185   9.273  -8.968
   17    HB3  SER   3           HB3      SER   3 -26.029  10.243  -7.505
   18    HG   SER   3           HG       SER   3 -27.290  11.430  -9.688
   19    H    ARG   4           H        ARG   4 -24.541  11.687  -6.828
   20    HA   ARG   4           HA       ARG   4 -24.019  14.498  -7.428
   21    HB2  ARG   4           HB2      ARG   4 -25.854  13.485  -5.241
   22    HB3  ARG   4           HB3      ARG   4 -25.223  15.122  -5.305
   23    HG2  ARG   4           HG2      ARG   4 -26.341  15.363  -7.538
   24    HG3  ARG   4           HG3      ARG   4 -27.118  13.807  -7.236
   25    HD2  ARG   4           HD2      ARG   4 -28.130  14.694  -5.207
   26    HD3  ARG   4           HD3      ARG   4 -27.325  16.237  -5.467
   27    HE   ARG   4           HE       ARG   4 -29.357  15.138  -7.298
   28   HH11  ARG   4          HH11      ARG   4 -27.870  17.833  -5.626
   29   HH12  ARG   4          HH12      ARG   4 -28.993  18.999  -6.245
   30   HH21  ARG   4          HH21      ARG   4 -30.844  16.672  -8.100
   31   HH22  ARG   4          HH22      ARG   4 -30.697  18.337  -7.629
   32    H    ARG   5           H        ARG   5 -23.266  15.439  -5.076
   33    HA   ARG   5           HA       ARG   5 -20.846  14.113  -4.488
   34    HB2  ARG   5           HB2      ARG   5 -21.662  16.607  -4.070
   35    HB3  ARG   5           HB3      ARG   5 -22.097  15.959  -2.496
   36    HG2  ARG   5           HG2      ARG   5 -19.341  15.822  -3.705
   37    HG3  ARG   5           HG3      ARG   5 -19.878  17.040  -2.552
   38    HD2  ARG   5           HD2      ARG   5 -20.284  15.310  -0.888
   39    HD3  ARG   5           HD3      ARG   5 -19.804  14.069  -2.046
   40    HE   ARG   5           HE       ARG   5 -17.769  16.032  -1.679
   41   HH11  ARG   5          HH11      ARG   5 -19.185  13.175  -0.212
   42   HH12  ARG   5          HH12      ARG   5 -17.719  12.716   0.596
   43   HH21  ARG   5          HH21      ARG   5 -15.852  15.435  -0.605
   44   HH22  ARG   5          HH22      ARG   5 -15.827  14.011   0.382
   45    H    ALA   6           H        ALA   6 -20.645  12.253  -3.434
   46    HA   ALA   6           HA       ALA   6 -22.733  10.936  -2.146
   47    HB1  ALA   6           HB1      ALA   6 -21.071   9.344  -1.366
   48    HB2  ALA   6           HB2      ALA   6 -19.778  10.450  -1.838
   49    HB3  ALA   6           HB3      ALA   6 -20.828   9.742  -3.068
   50    HA   PRO   7           HA       PRO   7 -22.824  12.768   1.794
   51    HB2  PRO   7           HB2      PRO   7 -24.280  10.972   3.110
   52    HB3  PRO   7           HB3      PRO   7 -24.934  11.821   1.705
   53    HG2  PRO   7           HG2      PRO   7 -23.736   9.076   1.825
   54    HG3  PRO   7           HG3      PRO   7 -25.273   9.583   1.097
   55    HD2  PRO   7           HD2      PRO   7 -22.990   9.272  -0.337
   56    HD3  PRO   7           HD3      PRO   7 -24.247  10.453  -0.762
   57    H    THR   8           H        THR   8 -22.310  12.432   4.074
   58    HA   THR   8           HA       THR   8 -19.866  10.960   4.417
   59    HB   THR   8           HB       THR   8 -20.290  11.868   6.870
   60    HG1  THR   8           HG1      THR   8 -22.332  12.693   6.666
   61   HG21  THR   8          HG21      THR   8 -19.587  13.638   4.524
   62   HG22  THR   8          HG22      THR   8 -18.475  12.582   5.396
   63   HG23  THR   8          HG23      THR   8 -19.198  13.971   6.210
   64    H    TRP   9           H        TRP   9 -19.506   9.330   5.986
   65    HA   TRP   9           HA       TRP   9 -21.639   7.412   5.989
   66    HB2  TRP   9           HB2      TRP   9 -18.804   7.315   7.016
   67    HB3  TRP   9           HB3      TRP   9 -19.923   5.965   7.163
   68    HD1  TRP   9           HD1      TRP   9 -18.364   8.145   4.370
   69    HE1  TRP   9           HE1      TRP   9 -18.103   6.682   2.282
   70    HE3  TRP   9           HE3      TRP   9 -20.520   3.839   6.106
   71    HZ2  TRP   9           HZ2      TRP   9 -18.721   4.052   1.469
   72    HZ3  TRP   9           HZ3      TRP   9 -20.648   1.897   4.594
   73    HH2  TRP   9           HH2      TRP   9 -19.762   2.010   2.326
   74    H    SER  10           H        SER  10 -22.921   6.802   7.576
   75    HA   SER  10           HA       SER  10 -22.751   8.128  10.156
   76    HB2  SER  10           HB2      SER  10 -24.884   6.787  10.571
   77    HB3  SER  10           HB3      SER  10 -24.960   7.955   9.252
   78    HG   SER  10           HG       SER  10 -24.634   6.248   7.789
   79    HA   PRO  11           HA       PRO  11 -20.695   5.005  12.534
   80    HB2  PRO  11           HB2      PRO  11 -23.151   4.729  14.202
   81    HB3  PRO  11           HB3      PRO  11 -21.485   5.035  14.701
   82    HG2  PRO  11           HG2      PRO  11 -23.269   6.998  14.705
   83    HG3  PRO  11           HG3      PRO  11 -21.602   7.293  14.174
   84    HD2  PRO  11           HD2      PRO  11 -24.087   6.993  12.546
   85    HD3  PRO  11           HD3      PRO  11 -22.687   8.053  12.287
   86    H    GLU  12           H        GLU  12 -24.094   4.239  11.876
   87    HA   GLU  12           HA       GLU  12 -23.722   1.401  12.108
   88    HB2  GLU  12           HB2      GLU  12 -26.000   2.963  10.876
   89    HB3  GLU  12           HB3      GLU  12 -26.026   1.254  11.283
   90    HG2  GLU  12           HG2      GLU  12 -25.756   1.813  13.645
   91    HG3  GLU  12           HG3      GLU  12 -25.745   3.528  13.232
   92    H    GLU  13           H        GLU  13 -23.088   3.672   9.707
   93    HA   GLU  13           HA       GLU  13 -23.635   1.963   7.435
   94    HB2  GLU  13           HB2      GLU  13 -23.783   4.583   7.709
   95    HB3  GLU  13           HB3      GLU  13 -22.084   4.508   7.284
   96    HG2  GLU  13           HG2      GLU  13 -22.608   3.482   5.175
   97    HG3  GLU  13           HG3      GLU  13 -24.319   3.398   5.608
   98    H    GLU  14           H        GLU  14 -20.786   3.493   8.936
   99    HA   GLU  14           HA       GLU  14 -18.803   2.271   7.382
  100    HB2  GLU  14           HB2      GLU  14 -18.668   3.060  10.303
  101    HB3  GLU  14           HB3      GLU  14 -17.285   2.721   9.274
  102    HG2  GLU  14           HG2      GLU  14 -17.869   4.626   7.860
  103    HG3  GLU  14           HG3      GLU  14 -19.253   4.966   8.901
  104    H    ALA  15           H        ALA  15 -20.507   1.160  10.269
  105    HA   ALA  15           HA       ALA  15 -18.953  -1.170  10.692
  106    HB1  ALA  15           HB1      ALA  15 -21.816  -0.687  11.481
  107    HB2  ALA  15           HB2      ALA  15 -20.406  -0.161  12.402
  108    HB3  ALA  15           HB3      ALA  15 -20.714  -1.880  12.166
  109    H    HIS  16           H        HIS  16 -21.897  -0.553   8.878
  110    HA   HIS  16           HA       HIS  16 -22.471  -3.189   8.132
  111    HB2  HIS  16           HB2      HIS  16 -24.009  -1.149   7.992
  112    HB3  HIS  16           HB3      HIS  16 -23.155  -0.729   6.515
  113    HD1  HIS  16           HD1      HIS  16 -26.180  -1.346   6.504
  114    HD2  HIS  16           HD2      HIS  16 -23.218  -4.144   5.713
  115    HE1  HIS  16           HE1      HIS  16 -27.290  -3.141   5.137
  116    HE2  HIS  16           HE2      HIS  16 -25.513  -4.890   4.783
  117    H    LEU  17           H        LEU  17 -20.384  -0.716   6.871
  118    HA   LEU  17           HA       LEU  17 -19.744  -1.737   4.364
  119    HB2  LEU  17           HB2      LEU  17 -19.064   0.468   5.215
  120    HB3  LEU  17           HB3      LEU  17 -17.985  -0.307   6.358
  121    HG   LEU  17           HG       LEU  17 -16.775  -1.275   4.351
  122   HD11  LEU  17          HD11      LEU  17 -17.045  -0.051   2.259
  123   HD12  LEU  17          HD12      LEU  17 -18.422   0.803   2.950
  124   HD13  LEU  17          HD13      LEU  17 -18.501  -0.940   2.702
  125   HD21  LEU  17          HD21      LEU  17 -16.799   1.713   4.684
  126   HD22  LEU  17          HD22      LEU  17 -15.483   0.737   4.031
  127   HD23  LEU  17          HD23      LEU  17 -15.943   0.575   5.724
  128    H    ARG  18           H        ARG  18 -18.026  -2.202   7.452
  129    HA   ARG  18           HA       ARG  18 -16.397  -4.294   6.398
  130    HB2  ARG  18           HB2      ARG  18 -15.634  -4.579   8.726
  131    HB3  ARG  18           HB3      ARG  18 -15.547  -2.907   8.195
  132    HG2  ARG  18           HG2      ARG  18 -17.702  -2.495   9.371
  133    HG3  ARG  18           HG3      ARG  18 -17.597  -4.135  10.018
  134    HD2  ARG  18           HD2      ARG  18 -15.479  -3.588  11.093
  135    HD3  ARG  18           HD3      ARG  18 -15.541  -1.962  10.412
  136    HE   ARG  18           HE       ARG  18 -17.594  -2.947  12.281
  137   HH11  ARG  18          HH11      ARG  18 -15.238  -0.522  11.324
  138   HH12  ARG  18          HH12      ARG  18 -15.711   0.596  12.567
  139   HH21  ARG  18          HH21      ARG  18 -18.216  -1.465  13.894
  140   HH22  ARG  18          HH22      ARG  18 -17.403   0.064  14.016
  141    H    GLU  19           H        GLU  19 -19.417  -4.067   8.108
  142    HA   GLU  19           HA       GLU  19 -19.767  -6.578   9.113
  143    HB2  GLU  19           HB2      GLU  19 -21.359  -4.690   9.358
  144    HB3  GLU  19           HB3      GLU  19 -21.871  -4.949   7.698
  145    HG2  GLU  19           HG2      GLU  19 -23.457  -5.904   9.246
  146    HG3  GLU  19           HG3      GLU  19 -22.686  -7.163   8.286
  147    H    LEU  20           H        LEU  20 -20.466  -5.415   5.873
  148    HA   LEU  20           HA       LEU  20 -21.330  -7.947   4.875
  149    HB2  LEU  20           HB2      LEU  20 -21.256  -5.214   4.015
  150    HB3  LEU  20           HB3      LEU  20 -20.629  -6.248   2.745
  151    HG   LEU  20           HG       LEU  20 -23.240  -6.862   4.088
  152   HD11  LEU  20          HD11      LEU  20 -23.223  -4.521   3.158
  153   HD12  LEU  20          HD12      LEU  20 -24.406  -5.611   2.443
  154   HD13  LEU  20          HD13      LEU  20 -22.922  -5.234   1.575
  155   HD21  LEU  20          HD21      LEU  20 -22.047  -7.524   1.398
  156   HD22  LEU  20          HD22      LEU  20 -23.631  -8.045   1.980
  157   HD23  LEU  20          HD23      LEU  20 -22.164  -8.616   2.778
  158    H    TYR  21           H        TYR  21 -18.309  -6.248   5.044
  159    HA   TYR  21           HA       TYR  21 -16.933  -7.760   3.064
  160    HB2  TYR  21           HB2      TYR  21 -16.080  -5.585   3.811
  161    HB3  TYR  21           HB3      TYR  21 -15.871  -6.212   5.441
  162    HD1  TYR  21           HD1      TYR  21 -14.811  -6.967   1.942
  163    HD2  TYR  21           HD2      TYR  21 -13.785  -6.949   6.067
  164    HE1  TYR  21           HE1      TYR  21 -12.525  -7.691   1.371
  165    HE2  TYR  21           HE2      TYR  21 -11.504  -7.672   5.515
  166    HH   TYR  21           HH       TYR  21 -10.317  -7.719   2.277
  167    H    LEU  22           H        LEU  22 -17.108  -7.896   6.581
  168    HA   LEU  22           HA       LEU  22 -15.362 -10.079   6.916
  169    HB2  LEU  22           HB2      LEU  22 -17.612  -9.273   8.753
  170    HB3  LEU  22           HB3      LEU  22 -16.137 -10.114   9.185
  171    HG   LEU  22           HG       LEU  22 -16.280  -7.264   8.207
  172   HD11  LEU  22          HD11      LEU  22 -17.253  -7.509  10.420
  173   HD12  LEU  22          HD12      LEU  22 -15.723  -6.636  10.478
  174   HD13  LEU  22          HD13      LEU  22 -15.793  -8.326  10.977
  175   HD21  LEU  22          HD21      LEU  22 -13.951  -8.810   9.321
  176   HD22  LEU  22          HD22      LEU  22 -13.950  -7.115   8.831
  177   HD23  LEU  22          HD23      LEU  22 -14.184  -8.384   7.627
  178    H    ALA  23           H        ALA  23 -18.681  -9.863   6.030
  179    HA   ALA  23           HA       ALA  23 -19.386 -12.557   6.694
  180    HB1  ALA  23           HB1      ALA  23 -21.447 -12.117   5.537
  181    HB2  ALA  23           HB2      ALA  23 -20.760 -10.683   4.776
  182    HB3  ALA  23           HB3      ALA  23 -21.031 -10.710   6.513
  183    H    ASN  24           H        ASN  24 -18.092 -10.945   3.836
  184    HA   ASN  24           HA       ASN  24 -18.416 -13.469   2.358
  185    HB2  ASN  24           HB2      ASN  24 -18.438 -10.639   1.299
  186    HB3  ASN  24           HB3      ASN  24 -18.511 -12.089   0.302
  187   HD21  ASN  24          HD21      ASN  24 -20.222 -10.032   2.510
  188   HD22  ASN  24          HD22      ASN  24 -21.790 -10.717   2.240
  189    H    LYS  25           H        LYS  25 -16.101 -12.131   3.976
  190    HA   LYS  25           HA       LYS  25 -14.058 -11.675   2.036
  191    HB2  LYS  25           HB2      LYS  25 -12.520 -11.690   4.002
  192    HB3  LYS  25           HB3      LYS  25 -13.870 -10.575   4.154
  193    HG2  LYS  25           HG2      LYS  25 -15.033 -12.188   5.590
  194    HG3  LYS  25           HG3      LYS  25 -13.659 -13.287   5.452
  195    HD2  LYS  25           HD2      LYS  25 -13.496 -10.487   6.572
  196    HD3  LYS  25           HD3      LYS  25 -13.679 -11.940   7.555
  197    HE2  LYS  25           HE2      LYS  25 -11.566 -12.802   6.602
  198    HE3  LYS  25           HE3      LYS  25 -11.381 -11.295   5.710
  199    HZ1  LYS  25           HZ1      LYS  25 -10.091 -11.300   7.757
  200    HZ2  LYS  25           HZ2      LYS  25 -11.494 -11.539   8.666
  201    HZ3  LYS  25           HZ3      LYS  25 -11.281 -10.102   7.800
  202    H    ASP  26           H        ASP  26 -15.429 -14.486   3.305
  203    HA   ASP  26           HA       ASP  26 -13.129 -16.077   2.371
  204    HB2  ASP  26           HB2      ASP  26 -13.781 -17.834   3.911
  205    HB3  ASP  26           HB3      ASP  26 -13.591 -16.328   4.803
  206    H    VAL  27           H        VAL  27 -15.840 -14.958   1.249
  207    HA   VAL  27           HA       VAL  27 -16.946 -17.483   0.238
  208    HB   VAL  27           HB       VAL  27 -18.098 -14.691   0.071
  209   HG11  VAL  27          HG11      VAL  27 -19.315 -17.355  -0.671
  210   HG12  VAL  27          HG12      VAL  27 -18.802 -16.097  -1.797
  211   HG13  VAL  27          HG13      VAL  27 -20.144 -15.798  -0.695
  212   HG21  VAL  27          HG21      VAL  27 -18.933 -17.017   1.800
  213   HG22  VAL  27          HG22      VAL  27 -19.699 -15.430   1.738
  214   HG23  VAL  27          HG23      VAL  27 -18.055 -15.594   2.357
  215    H    GLU  28           H        GLU  28 -15.980 -18.154  -1.510
  216    HA   GLU  28           HA       GLU  28 -15.121 -16.204  -3.512
  217    HB2  GLU  28           HB2      GLU  28 -14.487 -19.147  -3.236
  218    HB3  GLU  28           HB3      GLU  28 -13.861 -18.091  -4.499
  219    HG2  GLU  28           HG2      GLU  28 -12.775 -16.710  -2.792
  220    HG3  GLU  28           HG3      GLU  28 -13.382 -17.794  -1.542
  221    H    GLY  29           H        GLY  29 -15.521 -16.727  -5.779
  222    HA2  GLY  29           HA2      GLY  29 -16.979 -17.461  -7.490
  223    HA3  GLY  29           HA3      GLY  29 -18.027 -18.164  -6.259
  224    H    GLN  30           H        GLN  30 -17.176 -15.333  -5.076
  225    HA   GLN  30           HA       GLN  30 -19.013 -13.606  -6.519
  226    HB2  GLN  30           HB2      GLN  30 -20.438 -14.612  -4.823
  227    HB3  GLN  30           HB3      GLN  30 -19.236 -14.306  -3.580
  228    HG2  GLN  30           HG2      GLN  30 -19.572 -11.812  -4.301
  229    HG3  GLN  30           HG3      GLN  30 -21.119 -12.414  -4.896
  230   HE21  GLN  30          HE21      GLN  30 -19.135 -11.847  -2.114
  231   HE22  GLN  30          HE22      GLN  30 -20.378 -12.054  -0.933
  232    H    ASP  31           H        ASP  31 -18.363 -11.442  -6.351
  233    HA   ASP  31           HA       ASP  31 -15.777 -10.941  -5.206
  234    HB2  ASP  31           HB2      ASP  31 -17.846  -9.085  -6.380
  235    HB3  ASP  31           HB3      ASP  31 -16.301  -8.535  -5.743
  236    H    VAL  32           H        VAL  32 -15.363 -10.424  -3.141
  237    HA   VAL  32           HA       VAL  32 -17.349 -10.002  -1.207
  238    HB   VAL  32           HB       VAL  32 -14.933 -10.617  -0.750
  239   HG11  VAL  32          HG11      VAL  32 -13.361  -8.745  -0.379
  240   HG12  VAL  32          HG12      VAL  32 -14.535  -7.650  -1.115
  241   HG13  VAL  32          HG13      VAL  32 -13.810  -8.941  -2.072
  242   HG21  VAL  32          HG21      VAL  32 -16.161  -8.362   0.826
  243   HG22  VAL  32          HG22      VAL  32 -14.864  -9.413   1.401
  244   HG23  VAL  32          HG23      VAL  32 -16.454 -10.089   1.045
  245    H    VAL  33           H        VAL  33 -15.541  -7.821  -3.253
  246    HA   VAL  33           HA       VAL  33 -16.311  -5.353  -2.230
  247    HB   VAL  33           HB       VAL  33 -16.162  -5.694  -5.185
  248   HG11  VAL  33          HG11      VAL  33 -14.904  -3.736  -3.275
  249   HG12  VAL  33          HG12      VAL  33 -16.372  -3.483  -4.214
  250   HG13  VAL  33          HG13      VAL  33 -14.824  -3.659  -5.036
  251   HG21  VAL  33          HG21      VAL  33 -13.877  -6.256  -3.319
  252   HG22  VAL  33          HG22      VAL  33 -13.636  -5.747  -4.990
  253   HG23  VAL  33          HG23      VAL  33 -14.488  -7.251  -4.642
  254    H    GLU  34           H        GLU  34 -17.684  -7.138  -4.971
  255    HA   GLU  34           HA       GLU  34 -19.839  -5.489  -5.501
  256    HB2  GLU  34           HB2      GLU  34 -19.014  -7.310  -6.963
  257    HB3  GLU  34           HB3      GLU  34 -19.698  -8.484  -5.850
  258    HG2  GLU  34           HG2      GLU  34 -21.922  -7.692  -6.312
  259    HG3  GLU  34           HG3      GLU  34 -21.281  -6.407  -7.335
  260    H    ALA  35           H        ALA  35 -19.555  -8.172  -3.235
  261    HA   ALA  35           HA       ALA  35 -22.229  -8.380  -2.465
  262    HB1  ALA  35           HB1      ALA  35 -20.526  -9.989  -1.795
  263    HB2  ALA  35           HB2      ALA  35 -21.392  -9.360  -0.393
  264    HB3  ALA  35           HB3      ALA  35 -19.772  -8.771  -0.768
  265    H    ILE  36           H        ILE  36 -19.625  -6.404  -1.115
  266    HA   ILE  36           HA       ILE  36 -21.219  -5.148   0.853
  267    HB   ILE  36           HB       ILE  36 -18.699  -4.066  -0.396
  268   HG12  ILE  36          HG12      ILE  36 -18.909  -5.804   2.061
  269   HG13  ILE  36          HG13      ILE  36 -18.561  -6.456   0.463
  270   HG21  ILE  36          HG21      ILE  36 -18.435  -2.955   1.775
  271   HG22  ILE  36          HG22      ILE  36 -19.977  -3.629   2.302
  272   HG23  ILE  36          HG23      ILE  36 -19.929  -2.470   0.974
  273   HD11  ILE  36          HD11      ILE  36 -16.571  -5.009   0.360
  274   HD12  ILE  36          HD12      ILE  36 -16.528  -6.172   1.681
  275   HD13  ILE  36          HD13      ILE  36 -16.911  -4.483   2.008
  276    H    LEU  37           H        LEU  37 -19.991  -4.039  -2.296
  277    HA   LEU  37           HA       LEU  37 -20.992  -1.455  -2.305
  278    HB2  LEU  37           HB2      LEU  37 -21.066  -3.151  -4.774
  279    HB3  LEU  37           HB3      LEU  37 -20.782  -1.441  -4.653
  280    HG   LEU  37           HG       LEU  37 -18.826  -3.512  -3.672
  281   HD11  LEU  37          HD11      LEU  37 -19.165  -3.758  -6.078
  282   HD12  LEU  37          HD12      LEU  37 -17.579  -3.076  -5.724
  283   HD13  LEU  37          HD13      LEU  37 -18.878  -2.034  -6.299
  284   HD21  LEU  37          HD21      LEU  37 -18.526  -0.580  -4.278
  285   HD22  LEU  37          HD22      LEU  37 -17.250  -1.667  -3.736
  286   HD23  LEU  37          HD23      LEU  37 -18.606  -1.297  -2.672
  287    H    ALA  38           H        ALA  38 -22.630  -4.451  -3.109
  288    HA   ALA  38           HA       ALA  38 -24.925  -3.053  -4.201
  289    HB1  ALA  38           HB1      ALA  38 -25.699  -5.248  -4.870
  290    HB2  ALA  38           HB2      ALA  38 -24.396  -6.003  -3.950
  291    HB3  ALA  38           HB3      ALA  38 -24.021  -5.002  -5.351
  292    H    HIS  39           H        HIS  39 -24.236  -5.153  -1.393
  293    HA   HIS  39           HA       HIS  39 -27.040  -5.499  -0.895
  294    HB2  HIS  39           HB2      HIS  39 -24.593  -6.397   0.588
  295    HB3  HIS  39           HB3      HIS  39 -26.206  -6.624   1.252
  296    HD1  HIS  39           HD1      HIS  39 -27.818  -8.210  -0.147
  297    HD2  HIS  39           HD2      HIS  39 -23.842  -8.208  -1.322
  298    HE1  HIS  39           HE1      HIS  39 -27.543 -10.245  -1.590
  299    HE2  HIS  39           HE2      HIS  39 -25.192 -10.079  -2.477
  300    H    LEU  40           H        LEU  40 -24.829  -3.048   0.001
  301    HA   LEU  40           HA       LEU  40 -26.815  -2.180   1.972
  302    HB2  LEU  40           HB2      LEU  40 -25.059  -0.284   2.387
  303    HB3  LEU  40           HB3      LEU  40 -24.888  -1.852   3.137
  304    HG   LEU  40           HG       LEU  40 -23.320  -2.383   1.137
  305   HD11  LEU  40          HD11      LEU  40 -22.131  -0.465   0.238
  306   HD12  LEU  40          HD12      LEU  40 -23.211   0.630   1.102
  307   HD13  LEU  40          HD13      LEU  40 -23.841  -0.395  -0.192
  308   HD21  LEU  40          HD21      LEU  40 -22.578  -2.226   3.425
  309   HD22  LEU  40          HD22      LEU  40 -22.559  -0.464   3.330
  310   HD23  LEU  40          HD23      LEU  40 -21.426  -1.413   2.367
  311    H    ASN  41           H        ASN  41 -28.351  -1.730   0.421
  312    HA   ASN  41           HA       ASN  41 -27.825   0.252  -1.616
  313    HB2  ASN  41           HB2      ASN  41 -30.160  -0.116  -2.287
  314    HB3  ASN  41           HB3      ASN  41 -29.297  -1.639  -2.131
  315   HD21  ASN  41          HD21      ASN  41 -32.128  -1.145  -2.094
  316   HD22  ASN  41          HD22      ASN  41 -32.721  -1.737  -0.581
  317    H    THR  42           H        THR  42 -27.315   1.250   0.845
  318    HA   THR  42           HA       THR  42 -29.599   2.948   1.559
  319    HB   THR  42           HB       THR  42 -28.573   1.615   3.377
  320    HG1  THR  42           HG1      THR  42 -28.508   4.430   3.424
  321   HG21  THR  42          HG21      THR  42 -26.282   1.510   2.562
  322   HG22  THR  42          HG22      THR  42 -26.315   2.195   4.188
  323   HG23  THR  42          HG23      THR  42 -26.100   3.251   2.789
  324    H    VAL  43           H        VAL  43 -27.114   3.080  -0.516
  325    HA   VAL  43           HA       VAL  43 -26.776   5.931  -0.289
  326    HB   VAL  43           HB       VAL  43 -25.192   5.193   1.379
  327   HG11  VAL  43          HG11      VAL  43 -24.780   2.931   0.637
  328   HG12  VAL  43          HG12      VAL  43 -23.252   3.799   0.771
  329   HG13  VAL  43          HG13      VAL  43 -23.971   3.523  -0.814
  330   HG21  VAL  43          HG21      VAL  43 -24.557   7.139   0.155
  331   HG22  VAL  43          HG22      VAL  43 -23.922   6.163  -1.168
  332   HG23  VAL  43          HG23      VAL  43 -23.112   6.153   0.402
  333    HA   PRO  44           HA       PRO  44 -25.607   5.229  -4.593
  334    HB2  PRO  44           HB2      PRO  44 -25.951   7.993  -5.118
  335    HB3  PRO  44           HB3      PRO  44 -27.071   6.689  -5.510
  336    HG2  PRO  44           HG2      PRO  44 -27.513   8.730  -3.650
  337    HG3  PRO  44           HG3      PRO  44 -28.443   7.232  -3.798
  338    HD2  PRO  44           HD2      PRO  44 -26.279   7.942  -1.876
  339    HD3  PRO  44           HD3      PRO  44 -27.704   6.904  -1.650
  340    H    ARG  45           H        ARG  45 -23.407   4.850  -3.928
  341    HA   ARG  45           HA       ARG  45 -21.725   7.224  -4.321
  342    HB2  ARG  45           HB2      ARG  45 -20.040   6.220  -2.740
  343    HB3  ARG  45           HB3      ARG  45 -21.507   6.831  -1.980
  344    HG2  ARG  45           HG2      ARG  45 -22.382   4.546  -1.832
  345    HG3  ARG  45           HG3      ARG  45 -20.906   3.941  -2.586
  346    HD2  ARG  45           HD2      ARG  45 -21.174   3.916   0.014
  347    HD3  ARG  45           HD3      ARG  45 -19.630   4.320  -0.719
  348    HE   ARG  45           HE       ARG  45 -20.175   6.663  -0.337
  349   HH11  ARG  45          HH11      ARG  45 -21.902   4.272   1.555
  350   HH12  ARG  45          HH12      ARG  45 -22.374   5.393   2.798
  351   HH21  ARG  45          HH21      ARG  45 -20.763   8.135   1.315
  352   HH22  ARG  45          HH22      ARG  45 -21.698   7.575   2.664
  353    H    THR  46           H        THR  46 -19.564   6.703  -5.111
  354    HA   THR  46           HA       THR  46 -19.654   4.736  -7.158
  355    HB   THR  46           HB       THR  46 -18.335   6.717  -7.557
  356    HG1  THR  46           HG1      THR  46 -17.299   5.247  -8.693
  357   HG21  THR  46          HG21      THR  46 -17.664   7.307  -5.301
  358   HG22  THR  46          HG22      THR  46 -16.230   7.146  -6.312
  359   HG23  THR  46          HG23      THR  46 -16.665   5.859  -5.191
  360    H    ARG  47           H        ARG  47 -18.399   2.856  -7.348
  361    HA   ARG  47           HA       ARG  47 -18.444   1.238  -5.052
  362    HB2  ARG  47           HB2      ARG  47 -16.899   0.735  -7.603
  363    HB3  ARG  47           HB3      ARG  47 -17.401  -0.472  -6.428
  364    HG2  ARG  47           HG2      ARG  47 -19.109   1.087  -8.340
  365    HG3  ARG  47           HG3      ARG  47 -18.904  -0.658  -8.226
  366    HD2  ARG  47           HD2      ARG  47 -19.860  -0.234  -5.789
  367    HD3  ARG  47           HD3      ARG  47 -20.555   1.177  -6.571
  368    HE   ARG  47           HE       ARG  47 -21.050  -1.143  -8.114
  369   HH11  ARG  47          HH11      ARG  47 -22.097   0.528  -5.227
  370   HH12  ARG  47          HH12      ARG  47 -23.642  -0.250  -5.170
  371   HH21  ARG  47          HH21      ARG  47 -23.084  -2.191  -8.049
  372   HH22  ARG  47          HH22      ARG  47 -24.211  -1.792  -6.796
  373    H    LYS  48           H        LYS  48 -16.072   3.300  -6.391
  374    HA   LYS  48           HA       LYS  48 -13.700   2.289  -5.323
  375    HB2  LYS  48           HB2      LYS  48 -13.798   4.036  -7.028
  376    HB3  LYS  48           HB3      LYS  48 -14.537   5.136  -5.877
  377    HG2  LYS  48           HG2      LYS  48 -12.469   5.041  -4.523
  378    HG3  LYS  48           HG3      LYS  48 -11.740   4.032  -5.775
  379    HD2  LYS  48           HD2      LYS  48 -11.046   6.306  -6.119
  380    HD3  LYS  48           HD3      LYS  48 -12.156   5.860  -7.412
  381    HE2  LYS  48           HE2      LYS  48 -13.990   6.975  -6.143
  382    HE3  LYS  48           HE3      LYS  48 -12.794   7.504  -4.962
  383    HZ1  LYS  48           HZ1      LYS  48 -13.244   9.238  -6.570
  384    HZ2  LYS  48           HZ2      LYS  48 -12.822   8.216  -7.849
  385    HZ3  LYS  48           HZ3      LYS  48 -11.649   8.705  -6.732
  386    H    GLN  49           H        GLN  49 -16.253   4.212  -3.851
  387    HA   GLN  49           HA       GLN  49 -14.758   5.146  -1.641
  388    HB2  GLN  49           HB2      GLN  49 -17.735   4.750  -1.953
  389    HB3  GLN  49           HB3      GLN  49 -16.991   5.502  -0.550
  390    HG2  GLN  49           HG2      GLN  49 -15.901   7.023  -2.445
  391    HG3  GLN  49           HG3      GLN  49 -17.375   6.549  -3.284
  392   HE21  GLN  49          HE21      GLN  49 -16.589   9.171  -2.287
  393   HE22  GLN  49          HE22      GLN  49 -17.832   9.655  -1.184
  394    H    ILE  50           H        ILE  50 -16.957   2.379  -1.993
  395    HA   ILE  50           HA       ILE  50 -16.879   1.457   0.622
  396    HB   ILE  50           HB       ILE  50 -17.276   0.029  -1.986
  397   HG12  ILE  50          HG12      ILE  50 -19.492  -0.422  -0.488
  398   HG13  ILE  50          HG13      ILE  50 -18.968   1.116   0.185
  399   HG21  ILE  50          HG21      ILE  50 -17.848  -2.023  -0.773
  400   HG22  ILE  50          HG22      ILE  50 -17.299  -1.276   0.728
  401   HG23  ILE  50          HG23      ILE  50 -16.151  -1.588  -0.574
  402   HD11  ILE  50          HD11      ILE  50 -20.539   1.567  -1.532
  403   HD12  ILE  50          HD12      ILE  50 -19.702   0.507  -2.671
  404   HD13  ILE  50          HD13      ILE  50 -18.951   2.027  -2.148
  405    H    ILE  51           H        ILE  51 -14.810   0.463  -2.092
  406    HA   ILE  51           HA       ILE  51 -13.135  -1.303  -0.754
  407    HB   ILE  51           HB       ILE  51 -12.401   0.595  -2.983
  408   HG12  ILE  51          HG12      ILE  51 -13.305  -2.283  -3.109
  409   HG13  ILE  51          HG13      ILE  51 -14.337  -0.895  -3.439
  410   HG21  ILE  51          HG21      ILE  51 -10.582  -0.943  -3.485
  411   HG22  ILE  51          HG22      ILE  51 -11.042  -1.957  -2.119
  412   HG23  ILE  51          HG23      ILE  51 -10.431  -0.327  -1.840
  413   HD11  ILE  51          HD11      ILE  51 -13.529  -1.916  -5.486
  414   HD12  ILE  51          HD12      ILE  51 -11.864  -1.654  -4.969
  415   HD13  ILE  51          HD13      ILE  51 -12.910  -0.275  -5.306
  416    H    HIS  52           H        HIS  52 -12.766   2.172  -1.249
  417    HA   HIS  52           HA       HIS  52 -10.253   2.419  -0.052
  418    HB2  HIS  52           HB2      HIS  52 -12.428   4.271  -0.830
  419    HB3  HIS  52           HB3      HIS  52 -11.266   4.874   0.348
  420    HD1  HIS  52           HD1      HIS  52  -9.494   6.156  -0.753
  421    HD2  HIS  52           HD2      HIS  52 -10.784   2.982  -3.113
  422    HE1  HIS  52           HE1      HIS  52  -8.065   6.219  -2.810
  423    HE2  HIS  52           HE2      HIS  52  -8.965   4.392  -4.290
  424    H    HIS  53           H        HIS  53 -13.502   2.703   1.364
  425    HA   HIS  53           HA       HIS  53 -12.494   3.674   3.856
  426    HB2  HIS  53           HB2      HIS  53 -15.198   2.501   3.192
  427    HB3  HIS  53           HB3      HIS  53 -14.795   3.321   4.696
  428    HD1  HIS  53           HD1      HIS  53 -13.371   5.790   3.705
  429    HD2  HIS  53           HD2      HIS  53 -16.825   4.258   1.940
  430    HE1  HIS  53           HE1      HIS  53 -14.345   7.691   2.385
  431    HE2  HIS  53           HE2      HIS  53 -16.322   6.708   1.189
  432    H    LEU  54           H        LEU  54 -13.015   0.540   2.528
  433    HA   LEU  54           HA       LEU  54 -12.948  -0.953   4.961
  434    HB2  LEU  54           HB2      LEU  54 -12.390  -1.667   2.093
  435    HB3  LEU  54           HB3      LEU  54 -12.289  -2.838   3.391
  436    HG   LEU  54           HG       LEU  54 -14.805  -1.282   2.841
  437   HD11  LEU  54          HD11      LEU  54 -14.084  -2.508   0.819
  438   HD12  LEU  54          HD12      LEU  54 -15.579  -3.127   1.511
  439   HD13  LEU  54          HD13      LEU  54 -14.066  -3.996   1.764
  440   HD21  LEU  54          HD21      LEU  54 -14.623  -2.370   5.035
  441   HD22  LEU  54          HD22      LEU  54 -14.272  -3.908   4.245
  442   HD23  LEU  54          HD23      LEU  54 -15.849  -3.148   4.033
  443    H    VAL  55           H        VAL  55 -10.602  -0.282   2.446
  444    HA   VAL  55           HA       VAL  55  -8.377  -1.470   3.654
  445    HB   VAL  55           HB       VAL  55  -9.004   0.353   1.424
  446   HG11  VAL  55          HG11      VAL  55  -6.993   1.318   2.403
  447   HG12  VAL  55          HG12      VAL  55  -6.754   0.680   0.778
  448   HG13  VAL  55          HG13      VAL  55  -6.179  -0.230   2.179
  449   HG21  VAL  55          HG21      VAL  55  -7.973  -1.372   0.083
  450   HG22  VAL  55          HG22      VAL  55  -9.233  -2.021   1.134
  451   HG23  VAL  55          HG23      VAL  55  -7.532  -2.244   1.551
  452    H    GLN  56           H        GLN  56  -9.747   1.763   3.724
  453    HA   GLN  56           HA       GLN  56  -7.612   2.988   5.155
  454    HB2  GLN  56           HB2      GLN  56 -10.360   3.722   4.321
  455    HB3  GLN  56           HB3      GLN  56  -9.677   4.622   5.660
  456    HG2  GLN  56           HG2      GLN  56  -7.814   5.324   4.290
  457    HG3  GLN  56           HG3      GLN  56  -8.377   4.315   2.956
  458   HE21  GLN  56          HE21      GLN  56 -10.123   4.947   1.766
  459   HE22  GLN  56          HE22      GLN  56 -10.759   6.553   1.799
  460    H    MET  57           H        MET  57 -10.212   0.952   6.104
  461    HA   MET  57           HA       MET  57 -10.277   1.968   8.824
  462    HB2  MET  57           HB2      MET  57 -12.294   1.062   7.496
  463    HB3  MET  57           HB3      MET  57 -11.652  -0.529   7.874
  464    HG2  MET  57           HG2      MET  57 -11.771   0.036  10.273
  465    HG3  MET  57           HG3      MET  57 -12.518   1.571   9.844
  466    HE1  MET  57           HE1      MET  57 -14.764   1.653   8.330
  467    HE2  MET  57           HE2      MET  57 -15.832   0.271   8.096
  468    HE3  MET  57           HE3      MET  57 -14.287   0.342   7.248
  469    H    GLY  58           H        GLY  58  -8.250   0.033   7.134
  470    HA2  GLY  58           HA2      GLY  58  -6.373  -1.053   7.978
  471    HA3  GLY  58           HA3      GLY  58  -7.096  -1.010   9.579
  472    H    LEU  59           H        LEU  59  -9.464  -2.169   7.671
  473    HA   LEU  59           HA       LEU  59  -8.874  -4.898   8.477
  474    HB2  LEU  59           HB2      LEU  59 -11.220  -5.360   7.830
  475    HB3  LEU  59           HB3      LEU  59 -11.058  -4.123   9.060
  476    HG   LEU  59           HG       LEU  59 -11.201  -2.490   7.015
  477   HD11  LEU  59          HD11      LEU  59 -11.131  -4.237   5.320
  478   HD12  LEU  59          HD12      LEU  59 -12.637  -3.320   5.253
  479   HD13  LEU  59          HD13      LEU  59 -12.617  -4.931   5.971
  480   HD21  LEU  59          HD21      LEU  59 -13.624  -2.395   7.306
  481   HD22  LEU  59          HD22      LEU  59 -12.791  -2.570   8.851
  482   HD23  LEU  59          HD23      LEU  59 -13.591  -3.960   8.117
  483    H    ALA  60           H        ALA  60  -8.548  -2.953   5.795
  484    HA   ALA  60           HA       ALA  60  -7.904  -5.296   4.165
  485    HB1  ALA  60           HB1      ALA  60  -9.493  -2.921   3.306
  486    HB2  ALA  60           HB2      ALA  60  -9.922  -4.629   3.202
  487    HB3  ALA  60           HB3      ALA  60  -8.659  -3.970   2.166
  488    H    ASP  61           H        ASP  61  -6.247  -4.911   2.537
  489    HA   ASP  61           HA       ASP  61  -4.186  -3.242   3.702
  490    HB2  ASP  61           HB2      ASP  61  -3.434  -5.393   3.045
  491    HB3  ASP  61           HB3      ASP  61  -4.164  -5.248   1.450
  492    H    SER  62           H        SER  62  -5.565  -3.534   0.416
  493    HA   SER  62           HA       SER  62  -5.420  -0.709   0.002
  494    HB2  SER  62           HB2      SER  62  -3.026  -1.403  -0.289
  495    HB3  SER  62           HB3      SER  62  -3.554  -2.420  -1.629
  496    HG   SER  62           HG       SER  62  -2.941  -0.518  -2.558
  497    H    VAL  63           H        VAL  63  -6.034  -0.130  -2.242
  498    HA   VAL  63           HA       VAL  63  -8.250  -1.609  -3.184
  499    HB   VAL  63           HB       VAL  63  -6.638   0.498  -4.645
  500   HG11  VAL  63          HG11      VAL  63  -8.083  -0.782  -6.143
  501   HG12  VAL  63          HG12      VAL  63  -8.666   0.872  -5.953
  502   HG13  VAL  63          HG13      VAL  63  -9.466  -0.448  -5.103
  503   HG21  VAL  63          HG21      VAL  63  -7.445   1.315  -2.500
  504   HG22  VAL  63          HG22      VAL  63  -9.076   0.776  -2.895
  505   HG23  VAL  63          HG23      VAL  63  -8.329   2.075  -3.824
  506    H    LYS  64           H        LYS  64  -4.905  -1.893  -3.634
  507    HA   LYS  64           HA       LYS  64  -4.581  -3.051  -6.125
  508    HB2  LYS  64           HB2      LYS  64  -2.499  -3.658  -5.356
  509    HB3  LYS  64           HB3      LYS  64  -2.942  -2.498  -4.120
  510    HG2  LYS  64           HG2      LYS  64  -3.704  -4.380  -2.706
  511    HG3  LYS  64           HG3      LYS  64  -3.088  -5.488  -3.929
  512    HD2  LYS  64           HD2      LYS  64  -0.851  -4.307  -3.639
  513    HD3  LYS  64           HD3      LYS  64  -1.551  -3.588  -2.185
  514    HE2  LYS  64           HE2      LYS  64  -1.115  -6.504  -2.778
  515    HE3  LYS  64           HE3      LYS  64  -0.355  -5.537  -1.517
  516    HZ1  LYS  64           HZ1      LYS  64  -3.238  -6.237  -1.655
  517    HZ2  LYS  64           HZ2      LYS  64  -2.507  -5.306  -0.441
  518    HZ3  LYS  64           HZ3      LYS  64  -2.104  -6.944  -0.620
  519    H    ASP  65           H        ASP  65  -5.788  -4.329  -3.180
  520    HA   ASP  65           HA       ASP  65  -5.699  -7.092  -4.040
  521    HB2  ASP  65           HB2      ASP  65  -5.143  -6.227  -1.722
  522    HB3  ASP  65           HB3      ASP  65  -6.856  -5.923  -1.513
  523    H    PHE  66           H        PHE  66  -7.835  -4.479  -4.159
  524    HA   PHE  66           HA       PHE  66 -10.230  -6.159  -4.302
  525    HB2  PHE  66           HB2      PHE  66  -9.750  -3.217  -3.944
  526    HB3  PHE  66           HB3      PHE  66 -11.320  -3.802  -4.490
  527    HD1  PHE  66           HD1      PHE  66  -8.841  -4.067  -1.755
  528    HD2  PHE  66           HD2      PHE  66 -12.887  -4.556  -2.961
  529    HE1  PHE  66           HE1      PHE  66  -9.499  -4.377   0.585
  530    HE2  PHE  66           HE2      PHE  66 -13.559  -4.881  -0.624
  531    HZ   PHE  66           HZ       PHE  66 -11.852  -4.765   1.171
  532    H    GLN  67           H        GLN  67  -8.468  -3.705  -6.181
  533    HA   GLN  67           HA       GLN  67  -9.863  -4.608  -8.584
  534    HB2  GLN  67           HB2      GLN  67  -9.794  -1.798  -7.522
  535    HB3  GLN  67           HB3      GLN  67 -10.034  -2.129  -9.238
  536    HG2  GLN  67           HG2      GLN  67 -12.009  -3.492  -8.658
  537    HG3  GLN  67           HG3      GLN  67 -11.779  -3.051  -6.967
  538   HE21  GLN  67          HE21      GLN  67 -14.059  -2.542  -8.652
  539   HE22  GLN  67          HE22      GLN  67 -14.258  -0.825  -8.694
  540    H    ARG  68           H        ARG  68  -7.755  -1.870  -7.975
  541    HA   ARG  68           HA       ARG  68  -6.061  -2.830 -10.177
  542    HB2  ARG  68           HB2      ARG  68  -6.350  -0.005  -9.141
  543    HB3  ARG  68           HB3      ARG  68  -5.482  -0.511 -10.585
  544    HG2  ARG  68           HG2      ARG  68  -7.607  -1.254 -11.579
  545    HG3  ARG  68           HG3      ARG  68  -8.458  -0.685 -10.140
  546    HD2  ARG  68           HD2      ARG  68  -8.601   0.966 -11.912
  547    HD3  ARG  68           HD3      ARG  68  -7.636   1.585 -10.574
  548    HE   ARG  68           HE       ARG  68  -6.024   0.346 -12.572
  549   HH11  ARG  68          HH11      ARG  68  -7.732   3.299 -11.793
  550   HH12  ARG  68          HH12      ARG  68  -6.701   4.294 -12.768
  551   HH21  ARG  68          HH21      ARG  68  -4.672   1.643 -13.839
  552   HH22  ARG  68          HH22      ARG  68  -4.941   3.356 -13.918
  553    H    LYS  69           H        LYS  69  -3.943  -3.260  -9.806
  554    HA   LYS  69           HA       LYS  69  -3.064  -3.374  -7.125
  555    HB2  LYS  69           HB2      LYS  69  -0.821  -4.012  -8.144
  556    HB3  LYS  69           HB3      LYS  69  -2.185  -5.072  -8.445
  557    HG2  LYS  69           HG2      LYS  69  -2.429  -4.193 -10.673
  558    HG3  LYS  69           HG3      LYS  69  -1.159  -3.005 -10.372
  559    HD2  LYS  69           HD2      LYS  69   0.514  -4.646 -10.282
  560    HD3  LYS  69           HD3      LYS  69  -0.656  -5.949 -10.074
  561    HE2  LYS  69           HE2      LYS  69  -0.391  -4.280 -12.569
  562    HE3  LYS  69           HE3      LYS  69   0.376  -5.850 -12.337
  563    HZ1  LYS  69           HZ1      LYS  69  -2.552  -5.350 -12.248
  564    HZ2  LYS  69           HZ2      LYS  69  -1.791  -6.852 -12.087
  565    HZ3  LYS  69           HZ3      LYS  69  -1.712  -6.021 -13.554
  566    H    GLY  70           H        GLY  70  -3.036  -1.425  -6.201
  567    HA2  GLY  70           HA2      GLY  70  -0.735   0.252  -6.966
  568    HA3  GLY  70           HA3      GLY  70  -2.237   0.943  -6.360
  569    H    THR  71           H        THR  71   0.750   0.490  -5.421
  570    HA   THR  71           HA       THR  71   0.332  -0.806  -2.875
  571    HB   THR  71           HB       THR  71   2.745  -0.068  -2.495
  572    HG1  THR  71           HG1      THR  71   3.843   0.459  -4.510
  573   HG21  THR  71          HG21      THR  71   2.135  -2.334  -3.147
  574   HG22  THR  71          HG22      THR  71   3.616  -1.836  -3.965
  575   HG23  THR  71          HG23      THR  71   2.087  -1.849  -4.842
  576    H    HIS  72           H        HIS  72  -0.556   0.192  -1.209
  577    HA   HIS  72           HA       HIS  72  -0.608   2.979  -0.799
  578    HB2  HIS  72           HB2      HIS  72  -1.121   2.386   1.578
  579    HB3  HIS  72           HB3      HIS  72  -2.099   1.467   0.442
  580    HD1  HIS  72           HD1      HIS  72  -0.241   1.003   3.431
  581    HD2  HIS  72           HD2      HIS  72  -0.675  -1.221  -0.036
  582    HE1  HIS  72           HE1      HIS  72   0.693  -1.265   3.930
  583    HE2  HIS  72           HE2      HIS  72  -0.186  -2.683   2.037
  584    H    ILE  73           H        ILE  73   1.030   1.846   2.018
  585    HA   ILE  73           HA       ILE  73   2.968   0.404   0.753
  586    HB   ILE  73           HB       ILE  73   3.646   3.105   0.635
  587   HG12  ILE  73          HG12      ILE  73   3.915   1.249  -0.948
  588   HG13  ILE  73          HG13      ILE  73   5.388   2.211  -0.765
  589   HG21  ILE  73          HG21      ILE  73   5.892   3.115   1.646
  590   HG22  ILE  73          HG22      ILE  73   5.586   1.525   2.350
  591   HG23  ILE  73          HG23      ILE  73   4.647   2.923   2.880
  592   HD11  ILE  73          HD11      ILE  73   6.079   0.382   0.908
  593   HD12  ILE  73          HD12      ILE  73   6.123   0.004  -0.812
  594   HD13  ILE  73          HD13      ILE  73   4.782  -0.565   0.179
  595    H    VAL  74           H        VAL  74   4.249  -0.771   2.060
  596    HA   VAL  74           HA       VAL  74   3.723  -0.767   4.881
  597    HB   VAL  74           HB       VAL  74   4.216  -2.907   4.148
  598   HG11  VAL  74          HG11      VAL  74   6.097  -3.457   2.609
  599   HG12  VAL  74          HG12      VAL  74   6.365  -1.725   2.414
  600   HG13  VAL  74          HG13      VAL  74   4.835  -2.445   1.899
  601   HG21  VAL  74          HG21      VAL  74   6.446  -3.553   4.965
  602   HG22  VAL  74          HG22      VAL  74   5.611  -2.464   6.072
  603   HG23  VAL  74          HG23      VAL  74   6.894  -1.849   5.029
  604    H    LEU  75           H        LEU  75   4.814   0.407   6.364
  605    HA   LEU  75           HA       LEU  75   6.148   2.681   5.653
  606    HB2  LEU  75           HB2      LEU  75   6.825   2.904   7.985
  607    HB3  LEU  75           HB3      LEU  75   5.159   2.381   7.844
  608    HG   LEU  75           HG       LEU  75   7.117   0.199   8.155
  609   HD11  LEU  75          HD11      LEU  75   7.411   0.577  10.545
  610   HD12  LEU  75          HD12      LEU  75   6.564   2.118  10.412
  611   HD13  LEU  75          HD13      LEU  75   8.113   1.892   9.603
  612   HD21  LEU  75          HD21      LEU  75   4.755  -0.265   8.169
  613   HD22  LEU  75          HD22      LEU  75   4.490   0.910   9.456
  614   HD23  LEU  75          HD23      LEU  75   5.408  -0.560   9.778
  615    H    TRP  76           H        TRP  76   7.895   2.729   4.413
  616    HA   TRP  76           HA       TRP  76  10.062   0.840   4.915
  617    HB2  TRP  76           HB2      TRP  76   9.328   2.543   2.556
  618    HB3  TRP  76           HB3      TRP  76  10.953   1.883   2.713
  619    HD1  TRP  76           HD1      TRP  76   7.766   1.085   1.194
  620    HE1  TRP  76           HE1      TRP  76   7.595  -1.412   0.600
  621    HE3  TRP  76           HE3      TRP  76  11.677  -0.661   3.956
  622    HZ2  TRP  76           HZ2      TRP  76   8.929  -3.807   1.237
  623    HZ3  TRP  76           HZ3      TRP  76  12.164  -3.071   3.912
  624    HH2  TRP  76           HH2      TRP  76  10.816  -4.609   2.586
  625    H    THR  77           H        THR  77  11.560   1.472   6.247
  626    HA   THR  77           HA       THR  77  12.507   4.243   6.174
  627    HB   THR  77           HB       THR  77  13.815   3.576   8.199
  628    HG1  THR  77           HG1      THR  77  12.819   1.480   9.123
  629   HG21  THR  77          HG21      THR  77  10.836   3.069   8.360
  630   HG22  THR  77          HG22      THR  77  11.631   4.641   8.465
  631   HG23  THR  77          HG23      THR  77  11.887   3.439   9.728
  632    H    GLY  78           H        GLY  78  15.008   4.369   6.399
  633    HA2  GLY  78           HA2      GLY  78  16.228   3.109   4.188
  634    HA3  GLY  78           HA3      GLY  78  17.071   3.971   5.470
  635    H    ASP  79           H        ASP  79  15.968   2.240   7.552
  636    HA   ASP  79           HA       ASP  79  18.020   0.240   7.476
  637    HB2  ASP  79           HB2      ASP  79  17.265   1.483   9.534
  638    HB3  ASP  79           HB3      ASP  79  15.796   0.511   9.501
  639    H    GLN  80           H        GLN  80  14.425   0.129   7.451
  640    HA   GLN  80           HA       GLN  80  14.352  -2.705   7.206
  641    HB2  GLN  80           HB2      GLN  80  12.397  -1.180   7.909
  642    HB3  GLN  80           HB3      GLN  80  12.149  -0.902   6.182
  643    HG2  GLN  80           HG2      GLN  80  11.978  -3.375   5.897
  644    HG3  GLN  80           HG3      GLN  80  12.034  -3.531   7.648
  645   HE21  GLN  80          HE21      GLN  80  10.352  -1.014   5.846
  646   HE22  GLN  80          HE22      GLN  80   8.769  -1.467   6.359
  647    H    GLU  81           H        GLU  81  14.785  -0.096   4.973
  648    HA   GLU  81           HA       GLU  81  14.315  -1.423   2.542
  649    HB2  GLU  81           HB2      GLU  81  14.686   0.997   2.693
  650    HB3  GLU  81           HB3      GLU  81  16.341   0.726   3.209
  651    HG2  GLU  81           HG2      GLU  81  16.793  -0.353   1.026
  652    HG3  GLU  81           HG3      GLU  81  15.159   0.073   0.522
  653    H    LEU  82           H        LEU  82  17.247  -1.077   4.493
  654    HA   LEU  82           HA       LEU  82  18.923  -2.686   2.908
  655    HB2  LEU  82           HB2      LEU  82  19.809  -1.171   4.582
  656    HB3  LEU  82           HB3      LEU  82  19.005  -2.068   5.857
  657    HG   LEU  82           HG       LEU  82  20.423  -4.062   5.123
  658   HD11  LEU  82          HD11      LEU  82  21.944  -1.844   3.767
  659   HD12  LEU  82          HD12      LEU  82  21.150  -3.209   2.980
  660   HD13  LEU  82          HD13      LEU  82  22.540  -3.484   4.029
  661   HD21  LEU  82          HD21      LEU  82  22.258  -3.361   6.511
  662   HD22  LEU  82          HD22      LEU  82  20.733  -2.769   7.178
  663   HD23  LEU  82          HD23      LEU  82  21.801  -1.669   6.304
  664    H    GLU  83           H        GLU  83  16.850  -3.391   5.671
  665    HA   GLU  83           HA       GLU  83  17.455  -6.053   6.117
  666    HB2  GLU  83           HB2      GLU  83  16.011  -4.859   7.614
  667    HB3  GLU  83           HB3      GLU  83  14.838  -4.563   6.342
  668    HG2  GLU  83           HG2      GLU  83  15.380  -7.394   6.839
  669    HG3  GLU  83           HG3      GLU  83  14.678  -6.532   8.207
  670    H    LEU  84           H        LEU  84  14.897  -4.755   4.023
  671    HA   LEU  84           HA       LEU  84  14.150  -7.210   2.887
  672    HB2  LEU  84           HB2      LEU  84  12.831  -5.083   2.887
  673    HB3  LEU  84           HB3      LEU  84  13.920  -4.453   1.675
  674    HG   LEU  84           HG       LEU  84  11.627  -5.356   0.922
  675   HD11  LEU  84          HD11      LEU  84  13.406  -4.736  -0.615
  676   HD12  LEU  84          HD12      LEU  84  12.516  -6.148  -1.182
  677   HD13  LEU  84          HD13      LEU  84  14.111  -6.346  -0.456
  678   HD21  LEU  84          HD21      LEU  84  11.532  -7.738   0.436
  679   HD22  LEU  84          HD22      LEU  84  11.707  -7.457   2.170
  680   HD23  LEU  84          HD23      LEU  84  13.096  -7.974   1.214
  681    H    GLN  85           H        GLN  85  16.517  -4.784   1.931
  682    HA   GLN  85           HA       GLN  85  17.204  -5.768  -0.582
  683    HB2  GLN  85           HB2      GLN  85  17.909  -3.582   0.379
  684    HB3  GLN  85           HB3      GLN  85  19.031  -4.431   1.422
  685    HG2  GLN  85           HG2      GLN  85  19.185  -4.758  -1.544
  686    HG3  GLN  85           HG3      GLN  85  19.860  -3.333  -0.773
  687   HE21  GLN  85          HE21      GLN  85  20.796  -4.684   1.597
  688   HE22  GLN  85          HE22      GLN  85  22.135  -5.658   1.118
  689    H    ARG  86           H        ARG  86  18.812  -6.432   2.556
  690    HA   ARG  86           HA       ARG  86  20.570  -8.372   1.467
  691    HB2  ARG  86           HB2      ARG  86  19.749  -7.600   4.227
  692    HB3  ARG  86           HB3      ARG  86  20.618  -9.109   3.994
  693    HG2  ARG  86           HG2      ARG  86  22.313  -7.667   2.688
  694    HG3  ARG  86           HG3      ARG  86  21.535  -6.309   3.504
  695    HD2  ARG  86           HD2      ARG  86  23.560  -7.264   4.668
  696    HD3  ARG  86           HD3      ARG  86  22.098  -7.145   5.647
  697    HE   ARG  86           HE       ARG  86  22.132  -9.689   4.510
  698   HH11  ARG  86          HH11      ARG  86  24.091  -7.848   6.742
  699   HH12  ARG  86          HH12      ARG  86  24.526  -9.228   7.695
  700   HH21  ARG  86          HH21      ARG  86  22.691 -11.504   5.728
  701   HH22  ARG  86          HH22      ARG  86  23.734 -11.325   7.109
  702    H    LEU  87           H        LEU  87  17.485  -8.640   3.158
  703    HA   LEU  87           HA       LEU  87  17.471 -11.423   3.479
  704    HB2  LEU  87           HB2      LEU  87  15.923  -9.555   4.434
  705    HB3  LEU  87           HB3      LEU  87  14.964  -9.861   2.999
  706    HG   LEU  87           HG       LEU  87  14.972 -12.319   3.753
  707   HD11  LEU  87          HD11      LEU  87  15.185 -12.600   6.196
  708   HD12  LEU  87          HD12      LEU  87  15.815 -10.955   6.303
  709   HD13  LEU  87          HD13      LEU  87  16.710 -12.188   5.413
  710   HD21  LEU  87          HD21      LEU  87  13.514 -10.219   5.339
  711   HD22  LEU  87          HD22      LEU  87  13.056 -11.918   5.218
  712   HD23  LEU  87          HD23      LEU  87  13.017 -10.888   3.788
  713    H    PHE  88           H        PHE  88  16.164  -9.376   0.910
  714    HA   PHE  88           HA       PHE  88  14.965 -11.266  -0.701
  715    HB2  PHE  88           HB2      PHE  88  14.609  -9.098  -1.398
  716    HB3  PHE  88           HB3      PHE  88  16.285  -8.634  -1.171
  717    HD1  PHE  88           HD1      PHE  88  13.991 -10.477  -3.422
  718    HD2  PHE  88           HD2      PHE  88  17.793  -8.625  -2.942
  719    HE1  PHE  88           HE1      PHE  88  14.377 -10.640  -5.851
  720    HE2  PHE  88           HE2      PHE  88  18.186  -8.789  -5.360
  721    HZ   PHE  88           HZ       PHE  88  16.477  -9.790  -6.814
  722    H    GLU  89           H        GLU  89  18.362 -10.204  -0.792
  723    HA   GLU  89           HA       GLU  89  19.188 -11.875  -2.883
  724    HB2  GLU  89           HB2      GLU  89  20.800 -10.896  -0.530
  725    HB3  GLU  89           HB3      GLU  89  21.452 -11.509  -2.042
  726    HG2  GLU  89           HG2      GLU  89  20.435  -9.642  -3.236
  727    HG3  GLU  89           HG3      GLU  89  19.776  -9.038  -1.715
  728    H    GLU  90           H        GLU  90  19.128 -12.361   0.610
  729    HA   GLU  90           HA       GLU  90  20.698 -14.734   0.514
  730    HB2  GLU  90           HB2      GLU  90  19.107 -13.338   2.636
  731    HB3  GLU  90           HB3      GLU  90  19.885 -14.891   2.950
  732    HG2  GLU  90           HG2      GLU  90  22.047 -13.856   2.252
  733    HG3  GLU  90           HG3      GLU  90  21.211 -12.308   2.147
  734    H    PHE  91           H        PHE  91  17.345 -14.085   0.109
  735    HA   PHE  91           HA       PHE  91  16.772 -16.947   0.391
  736    HB2  PHE  91           HB2      PHE  91  14.990 -14.542   0.550
  737    HB3  PHE  91           HB3      PHE  91  14.333 -16.155   0.287
  738    HD1  PHE  91           HD1      PHE  91  15.680 -13.842   2.689
  739    HD2  PHE  91           HD2      PHE  91  14.758 -17.933   1.993
  740    HE1  PHE  91           HE1      PHE  91  15.775 -14.273   5.108
  741    HE2  PHE  91           HE2      PHE  91  14.850 -18.371   4.412
  742    HZ   PHE  91           HZ       PHE  91  15.359 -16.541   5.973
  743    H    ARG  92           H        ARG  92  17.698 -14.939  -2.000
  744    HA   ARG  92           HA       ARG  92  16.040 -15.822  -4.151
  745    HB2  ARG  92           HB2      ARG  92  18.969 -15.041  -4.177
  746    HB3  ARG  92           HB3      ARG  92  17.983 -15.286  -5.608
  747    HG2  ARG  92           HG2      ARG  92  16.539 -13.424  -4.885
  748    HG3  ARG  92           HG3      ARG  92  17.630 -13.158  -3.521
  749    HD2  ARG  92           HD2      ARG  92  18.383 -13.021  -6.438
  750    HD3  ARG  92           HD3      ARG  92  18.107 -11.636  -5.385
  751    HE   ARG  92           HE       ARG  92  20.162 -13.496  -4.511
  752   HH11  ARG  92          HH11      ARG  92  19.432 -10.520  -6.230
  753   HH12  ARG  92          HH12      ARG  92  21.055  -9.923  -6.132
  754   HH21  ARG  92          HH21      ARG  92  22.289 -12.712  -4.398
  755   HH22  ARG  92          HH22      ARG  92  22.678 -11.172  -5.101
  756    H    ASP  93           H        ASP  93  18.316 -17.219  -2.155
  757    HA   ASP  93           HA       ASP  93  19.208 -19.350  -3.863
  758    HB2  ASP  93           HB2      ASP  93  20.541 -18.261  -2.025
  759    HB3  ASP  93           HB3      ASP  93  19.462 -19.028  -0.869
  760    H    SER  94           H        SER  94  16.335 -18.747  -2.410
  761    HA   SER  94           HA       SER  94  15.819 -21.544  -1.678
  762    HB2  SER  94           HB2      SER  94  14.186 -19.065  -1.077
  763    HB3  SER  94           HB3      SER  94  13.869 -20.691  -0.470
  764    HG   SER  94           HG       SER  94  16.409 -19.974   0.061
  765    H    ASP  95           H        ASP  95  13.207 -21.852  -2.017
  766    HA   ASP  95           HA       ASP  95  12.939 -21.987  -4.884
  767    HB2  ASP  95           HB2      ASP  95  10.944 -23.320  -4.424
  768    HB3  ASP  95           HB3      ASP  95  12.274 -23.874  -3.413
  769    H    ASP  96           H        ASP  96  11.798 -19.966  -2.356
  770    HA   ASP  96           HA       ASP  96  10.659 -18.193  -4.332
  771    HB2  ASP  96           HB2      ASP  96   8.735 -19.669  -3.602
  772    HB3  ASP  96           HB3      ASP  96   8.943 -19.025  -1.976
  773    H    VAL  97           H        VAL  97  11.815 -16.459  -3.868
  774    HA   VAL  97           HA       VAL  97  13.036 -16.028  -1.381
  775    HB   VAL  97           HB       VAL  97  14.181 -15.040  -3.141
  776   HG11  VAL  97          HG11      VAL  97  11.569 -13.857  -4.025
  777   HG12  VAL  97          HG12      VAL  97  12.613 -14.985  -4.893
  778   HG13  VAL  97          HG13      VAL  97  13.125 -13.314  -4.647
  779   HG21  VAL  97          HG21      VAL  97  12.696 -12.778  -1.816
  780   HG22  VAL  97          HG22      VAL  97  14.219 -12.634  -2.693
  781   HG23  VAL  97          HG23      VAL  97  14.145 -13.578  -1.206
  782    H    LEU  98           H        LEU  98  10.053 -14.684  -2.773
  783    HA   LEU  98           HA       LEU  98   9.716 -12.853  -0.580
  784    HB2  LEU  98           HB2      LEU  98   8.068 -13.573  -2.964
  785    HB3  LEU  98           HB3      LEU  98   7.334 -12.693  -1.638
  786    HG   LEU  98           HG       LEU  98   9.229 -11.010  -1.923
  787   HD11  LEU  98          HD11      LEU  98  10.741 -12.250  -3.274
  788   HD12  LEU  98          HD12      LEU  98  10.134 -10.899  -4.233
  789   HD13  LEU  98          HD13      LEU  98   9.506 -12.525  -4.501
  790   HD21  LEU  98          HD21      LEU  98   7.181 -11.343  -4.104
  791   HD22  LEU  98          HD22      LEU  98   8.042  -9.852  -3.717
  792   HD23  LEU  98          HD23      LEU  98   6.929 -10.557  -2.545
  793    H    GLY  99           H        GLY  99   8.395 -15.977  -1.523
  794    HA2  GLY  99           HA2      GLY  99   6.475 -16.222   0.519
  795    HA3  GLY  99           HA3      GLY  99   7.297 -17.566  -0.276
  796    H    HIS 100           H        HIS 100   9.941 -16.674   0.509
  797    HA   HIS 100           HA       HIS 100   9.927 -17.788   3.183
  798    HB2  HIS 100           HB2      HIS 100  12.116 -17.151   1.218
  799    HB3  HIS 100           HB3      HIS 100  12.476 -17.567   2.890
  800    HD1  HIS 100           HD1      HIS 100  13.253 -19.915   2.939
  801    HD2  HIS 100           HD2      HIS 100  10.089 -19.399   0.288
  802    HE1  HIS 100           HE1      HIS 100  12.784 -22.194   1.994
  803    HE2  HIS 100           HE2      HIS 100  10.959 -21.839   0.290
  804    H    ILE 101           H        ILE 101  10.397 -14.716   1.601
  805    HA   ILE 101           HA       ILE 101  11.474 -13.247   3.720
  806    HB   ILE 101           HB       ILE 101   9.556 -12.429   1.526
  807   HG12  ILE 101          HG12      ILE 101  12.475 -11.812   2.055
  808   HG13  ILE 101          HG13      ILE 101  11.861 -12.939   0.854
  809   HG21  ILE 101          HG21      ILE 101   9.925 -10.094   2.189
  810   HG22  ILE 101          HG22      ILE 101  10.822 -10.638   3.607
  811   HG23  ILE 101          HG23      ILE 101   9.103 -11.004   3.458
  812   HD11  ILE 101          HD11      ILE 101  11.385  -9.966   0.871
  813   HD12  ILE 101          HD12      ILE 101  10.817 -11.104  -0.352
  814   HD13  ILE 101          HD13      ILE 101  12.547 -10.824  -0.143
  815    H    MET 102           H        MET 102   8.062 -13.785   2.872
  816    HA   MET 102           HA       MET 102   6.910 -12.391   4.985
  817    HB2  MET 102           HB2      MET 102   5.900 -14.827   3.523
  818    HB3  MET 102           HB3      MET 102   4.925 -13.835   4.598
  819    HG2  MET 102           HG2      MET 102   5.216 -11.927   3.143
  820    HG3  MET 102           HG3      MET 102   6.255 -12.880   2.077
  821    HE1  MET 102           HE1      MET 102   3.003 -11.366   2.175
  822    HE2  MET 102           HE2      MET 102   2.469 -12.112   0.665
  823    HE3  MET 102           HE3      MET 102   4.078 -11.395   0.776
  824    H    LYS 103           H        LYS 103   7.703 -15.837   4.783
  825    HA   LYS 103           HA       LYS 103   6.561 -16.458   7.307
  826    HB2  LYS 103           HB2      LYS 103   8.270 -17.945   5.348
  827    HB3  LYS 103           HB3      LYS 103   7.987 -18.617   6.946
  828    HG2  LYS 103           HG2      LYS 103   6.438 -19.502   5.257
  829    HG3  LYS 103           HG3      LYS 103   5.605 -18.658   6.562
  830    HD2  LYS 103           HD2      LYS 103   5.361 -16.685   5.143
  831    HD3  LYS 103           HD3      LYS 103   6.235 -17.499   3.845
  832    HE2  LYS 103           HE2      LYS 103   3.648 -18.484   5.037
  833    HE3  LYS 103           HE3      LYS 103   3.761 -17.507   3.574
  834    HZ1  LYS 103           HZ1      LYS 103   3.572 -19.864   3.074
  835    HZ2  LYS 103           HZ2      LYS 103   4.982 -20.186   3.946
  836    HZ3  LYS 103           HZ3      LYS 103   5.055 -19.252   2.537
  837    H    ASN 104           H        ASN 104   9.597 -15.143   6.396
  838    HA   ASN 104           HA       ASN 104  10.632 -15.769   9.090
  839    HB2  ASN 104           HB2      ASN 104  12.157 -15.303   6.524
  840    HB3  ASN 104           HB3      ASN 104  12.914 -15.402   8.108
  841   HD21  ASN 104          HD21      ASN 104  11.343 -17.136   5.568
  842   HD22  ASN 104          HD22      ASN 104  11.713 -18.728   6.142
  843    H    ILE 105           H        ILE 105   9.018 -13.379   7.895
  844    HA   ILE 105           HA       ILE 105  10.941 -11.312   8.708
  845    HB   ILE 105           HB       ILE 105   9.974 -11.201   6.365
  846   HG12  ILE 105          HG12      ILE 105   9.753  -8.740   6.429
  847   HG13  ILE 105          HG13      ILE 105   9.664  -8.819   8.185
  848   HG21  ILE 105          HG21      ILE 105   7.521 -10.314   7.872
  849   HG22  ILE 105          HG22      ILE 105   7.662 -11.696   6.782
  850   HG23  ILE 105          HG23      ILE 105   7.785 -10.051   6.147
  851   HD11  ILE 105          HD11      ILE 105  11.897  -9.593   8.346
  852   HD12  ILE 105          HD12      ILE 105  11.894  -8.210   7.256
  853   HD13  ILE 105          HD13      ILE 105  11.997  -9.844   6.606
  854    H    THR 106           H        THR 106  10.123  -9.463   9.808
  855    HA   THR 106           HA       THR 106   8.254 -10.237  11.902
  856    HB   THR 106           HB       THR 106  10.614  -9.233  12.215
  857    HG1  THR 106           HG1      THR 106   8.650  -9.347  13.762
  858   HG21  THR 106          HG21      THR 106   9.043  -6.716  11.650
  859   HG22  THR 106          HG22      THR 106  10.378  -7.349  10.687
  860   HG23  THR 106          HG23      THR 106  10.668  -6.768  12.328
  861    H    ALA 107           H        ALA 107   8.415  -8.349   9.089
  862    HA   ALA 107           HA       ALA 107   6.356  -6.458   9.876
  863    HB1  ALA 107           HB1      ALA 107   8.284  -5.641   8.616
  864    HB2  ALA 107           HB2      ALA 107   6.793  -5.436   7.696
  865    HB3  ALA 107           HB3      ALA 107   7.897  -6.752   7.300
  866    H    LYS 108           H        LYS 108   4.273  -6.477   9.051
  867    HA   LYS 108           HA       LYS 108   3.474  -8.767   7.495
  868    HB2  LYS 108           HB2      LYS 108   1.913  -6.259   8.147
  869    HB3  LYS 108           HB3      LYS 108   1.250  -7.739   7.477
  870    HG2  LYS 108           HG2      LYS 108   2.670  -7.858  10.088
  871    HG3  LYS 108           HG3      LYS 108   1.045  -7.184  10.032
  872    HD2  LYS 108           HD2      LYS 108   0.820  -9.489  10.557
  873    HD3  LYS 108           HD3      LYS 108   0.316  -9.298   8.880
  874    HE2  LYS 108           HE2      LYS 108   2.335 -10.246   8.080
  875    HE3  LYS 108           HE3      LYS 108   3.097 -10.158   9.669
  876    HZ1  LYS 108           HZ1      LYS 108   1.487 -11.797  10.458
  877    HZ2  LYS 108           HZ2      LYS 108   2.389 -12.403   9.162
  878    HZ3  LYS 108           HZ3      LYS 108   0.799 -11.886   8.914
  879    H    ARG 109           H        ARG 109   4.289  -8.812   5.524
  880    HA   ARG 109           HA       ARG 109   4.073  -6.404   3.858
  881    HB2  ARG 109           HB2      ARG 109   6.418  -7.401   4.917
  882    HB3  ARG 109           HB3      ARG 109   6.360  -8.141   3.326
  883    HG2  ARG 109           HG2      ARG 109   6.656  -6.186   2.237
  884    HG3  ARG 109           HG3      ARG 109   5.830  -5.240   3.480
  885    HD2  ARG 109           HD2      ARG 109   8.263  -4.792   3.352
  886    HD3  ARG 109           HD3      ARG 109   7.748  -5.373   4.928
  887    HE   ARG 109           HE       ARG 109   8.723  -7.441   3.180
  888   HH11  ARG 109          HH11      ARG 109   9.598  -5.067   5.611
  889   HH12  ARG 109          HH12      ARG 109  11.142  -5.797   5.960
  890   HH21  ARG 109          HH21      ARG 109  10.782  -8.393   3.650
  891   HH22  ARG 109          HH22      ARG 109  11.820  -7.650   4.839
  892    H    SER 110           H        SER 110   2.984  -6.831   2.055
  893    HA   SER 110           HA       SER 110   2.479  -9.614   1.380
  894    HB2  SER 110           HB2      SER 110   0.607  -8.804   0.049
  895    HB3  SER 110           HB3      SER 110   0.524  -8.147   1.679
  896    HG   SER 110           HG       SER 110   0.687  -6.862  -0.673
  897    H    ARG 111           H        ARG 111   2.266 -10.092  -1.028
  898    HA   ARG 111           HA       ARG 111   4.862 -10.010  -2.034
  899    HB2  ARG 111           HB2      ARG 111   2.393 -10.500  -3.700
  900    HB3  ARG 111           HB3      ARG 111   4.019 -11.083  -4.013
  901    HG2  ARG 111           HG2      ARG 111   2.240 -11.930  -1.739
  902    HG3  ARG 111           HG3      ARG 111   2.590 -12.859  -3.190
  903    HD2  ARG 111           HD2      ARG 111   4.712 -11.953  -1.262
  904    HD3  ARG 111           HD3      ARG 111   3.878 -13.495  -1.112
  905    HE   ARG 111           HE       ARG 111   5.732 -12.725  -3.253
  906   HH11  ARG 111          HH11      ARG 111   3.795 -15.154  -1.649
  907   HH12  ARG 111          HH12      ARG 111   4.643 -16.488  -2.364
  908   HH21  ARG 111          HH21      ARG 111   6.829 -14.495  -4.233
  909   HH22  ARG 111          HH22      ARG 111   6.384 -16.119  -3.815
  910    H    ALA 112           H        ALA 112   2.016  -8.154  -3.050
  911    HA   ALA 112           HA       ALA 112   3.131  -6.961  -5.306
  912    HB1  ALA 112           HB1      ALA 112   1.287  -5.410  -5.232
  913    HB2  ALA 112           HB2      ALA 112   0.984  -5.808  -3.540
  914    HB3  ALA 112           HB3      ALA 112   0.724  -7.023  -4.790
  915    H    ARG 113           H        ARG 113   3.295  -5.918  -1.924
  916    HA   ARG 113           HA       ARG 113   4.458  -3.387  -2.750
  917    HB2  ARG 113           HB2      ARG 113   4.642  -3.071  -0.170
  918    HB3  ARG 113           HB3      ARG 113   3.080  -2.955  -0.965
  919    HG2  ARG 113           HG2      ARG 113   2.612  -5.288  -0.318
  920    HG3  ARG 113           HG3      ARG 113   4.144  -5.322   0.559
  921    HD2  ARG 113           HD2      ARG 113   3.406  -3.752   2.136
  922    HD3  ARG 113           HD3      ARG 113   2.076  -3.215   1.111
  923    HE   ARG 113           HE       ARG 113   1.332  -5.710   1.542
  924   HH11  ARG 113          HH11      ARG 113   2.615  -3.361   3.806
  925   HH12  ARG 113          HH12      ARG 113   1.809  -4.045   5.174
  926   HH21  ARG 113          HH21      ARG 113   0.244  -6.598   3.350
  927   HH22  ARG 113          HH22      ARG 113   0.446  -5.878   4.911
  928    H    ILE 114           H        ILE 114   5.534  -6.481  -1.736
  929    HA   ILE 114           HA       ILE 114   8.171  -5.650  -0.991
  930    HB   ILE 114           HB       ILE 114   7.114  -8.348  -1.846
  931   HG12  ILE 114          HG12      ILE 114   7.939  -7.321   0.875
  932   HG13  ILE 114          HG13      ILE 114   6.274  -7.450   0.318
  933   HG21  ILE 114          HG21      ILE 114   9.231  -9.260  -0.973
  934   HG22  ILE 114          HG22      ILE 114   9.835  -7.615  -0.781
  935   HG23  ILE 114          HG23      ILE 114   9.462  -8.235  -2.391
  936   HD11  ILE 114          HD11      ILE 114   8.201  -9.733   0.701
  937   HD12  ILE 114          HD12      ILE 114   6.546  -9.877   0.110
  938   HD13  ILE 114          HD13      ILE 114   6.851  -9.315   1.753
  939    H    VAL 115           H        VAL 115   6.653  -6.937  -3.925
  940    HA   VAL 115           HA       VAL 115   9.043  -7.051  -5.429
  941    HB   VAL 115           HB       VAL 115   7.682  -7.393  -7.374
  942   HG11  VAL 115          HG11      VAL 115   6.367  -9.294  -6.695
  943   HG12  VAL 115          HG12      VAL 115   6.337  -8.716  -5.031
  944   HG13  VAL 115          HG13      VAL 115   7.858  -9.239  -5.755
  945   HG21  VAL 115          HG21      VAL 115   6.039  -5.627  -7.063
  946   HG22  VAL 115          HG22      VAL 115   5.325  -6.510  -5.714
  947   HG23  VAL 115          HG23      VAL 115   5.239  -7.171  -7.346
  948    H    ASP 116           H        ASP 116   6.654  -4.541  -4.905
  949    HA   ASP 116           HA       ASP 116   7.524  -2.775  -6.939
  950    HB2  ASP 116           HB2      ASP 116   5.322  -2.659  -5.719
  951    HB3  ASP 116           HB3      ASP 116   6.198  -2.043  -4.324
  952    H    LYS 117           H        LYS 117   8.555  -3.405  -3.655
  953    HA   LYS 117           HA       LYS 117  10.258  -1.146  -3.403
  954    HB2  LYS 117           HB2      LYS 117   9.390  -2.539  -1.500
  955    HB3  LYS 117           HB3      LYS 117  10.522  -3.796  -1.977
  956    HG2  LYS 117           HG2      LYS 117  11.417  -2.511  -0.139
  957    HG3  LYS 117           HG3      LYS 117  12.387  -2.255  -1.591
  958    HD2  LYS 117           HD2      LYS 117  11.291  -0.134  -1.992
  959    HD3  LYS 117           HD3      LYS 117  10.221  -0.397  -0.615
  960    HE2  LYS 117           HE2      LYS 117  12.144  -0.358   0.887
  961    HE3  LYS 117           HE3      LYS 117  13.221  -0.118  -0.486
  962    HZ1  LYS 117           HZ1      LYS 117  12.124   1.980  -0.941
  963    HZ2  LYS 117           HZ2      LYS 117  12.732   1.970   0.636
  964    HZ3  LYS 117           HZ3      LYS 117  11.077   1.753   0.363
  965    H    LEU 118           H        LEU 118  10.792  -4.494  -4.487
  966    HA   LEU 118           HA       LEU 118  13.572  -4.412  -4.793
  967    HB2  LEU 118           HB2      LEU 118  11.637  -5.778  -6.656
  968    HB3  LEU 118           HB3      LEU 118  13.344  -6.118  -6.508
  969    HG   LEU 118           HG       LEU 118  11.136  -6.806  -4.598
  970   HD11  LEU 118          HD11      LEU 118  12.067  -9.050  -4.951
  971   HD12  LEU 118          HD12      LEU 118  13.277  -8.361  -6.043
  972   HD13  LEU 118          HD13      LEU 118  11.565  -8.293  -6.465
  973   HD21  LEU 118          HD21      LEU 118  13.021  -5.870  -3.299
  974   HD22  LEU 118          HD22      LEU 118  14.103  -7.024  -4.078
  975   HD23  LEU 118          HD23      LEU 118  12.806  -7.599  -3.032
  976    H    LEU 119           H        LEU 119  11.019  -3.601  -7.060
  977    HA   LEU 119           HA       LEU 119  12.622  -2.912  -9.249
  978    HB2  LEU 119           HB2      LEU 119   9.826  -2.316  -8.379
  979    HB3  LEU 119           HB3      LEU 119  10.490  -1.452  -9.757
  980    HG   LEU 119           HG       LEU 119   9.147  -3.430 -10.416
  981   HD11  LEU 119          HD11      LEU 119  12.068  -3.610 -11.120
  982   HD12  LEU 119          HD12      LEU 119  10.885  -2.541 -11.873
  983   HD13  LEU 119          HD13      LEU 119  10.727  -4.289 -12.043
  984   HD21  LEU 119          HD21      LEU 119  11.321  -4.975  -8.997
  985   HD22  LEU 119          HD22      LEU 119  10.198  -5.692 -10.151
  986   HD23  LEU 119          HD23      LEU 119   9.592  -4.991  -8.649
  987    H    ALA 120           H        ALA 120  11.652  -1.154  -6.428
  988    HA   ALA 120           HA       ALA 120  12.309   1.441  -7.394
  989    HB1  ALA 120           HB1      ALA 120  10.712   0.963  -5.566
  990    HB2  ALA 120           HB2      ALA 120  11.938   2.159  -5.134
  991    HB3  ALA 120           HB3      ALA 120  12.073   0.502  -4.545
  992    H    LEU 121           H        LEU 121  13.988  -0.995  -5.457
  993    HA   LEU 121           HA       LEU 121  16.384   0.534  -5.144
  994    HB2  LEU 121           HB2      LEU 121  15.603  -2.319  -4.716
  995    HB3  LEU 121           HB3      LEU 121  17.297  -1.883  -4.707
  996    HG   LEU 121           HG       LEU 121  16.943  -0.404  -2.821
  997   HD11  LEU 121          HD11      LEU 121  14.812  -0.277  -1.671
  998   HD12  LEU 121          HD12      LEU 121  14.066  -1.288  -2.909
  999   HD13  LEU 121          HD13      LEU 121  14.661   0.320  -3.322
 1000   HD21  LEU 121          HD21      LEU 121  15.773  -3.154  -2.482
 1001   HD22  LEU 121          HD22      LEU 121  16.353  -2.131  -1.163
 1002   HD23  LEU 121          HD23      LEU 121  17.478  -2.712  -2.394
 1003    H    GLY 122           H        GLY 122  15.066  -1.478  -7.597
 1004    HA2  GLY 122           HA2      GLY 122  15.865  -1.873  -9.743
 1005    HA3  GLY 122           HA3      GLY 122  17.391  -1.120  -9.290
 1006    H    LEU 123           H        LEU 123  15.843  -3.675  -7.447
 1007    HA   LEU 123           HA       LEU 123  18.214  -5.294  -7.613
 1008    HB2  LEU 123           HB2      LEU 123  15.531  -5.748  -6.320
 1009    HB3  LEU 123           HB3      LEU 123  16.858  -6.894  -6.229
 1010    HG   LEU 123           HG       LEU 123  16.932  -4.065  -5.172
 1011   HD11  LEU 123          HD11      LEU 123  16.614  -6.699  -3.744
 1012   HD12  LEU 123          HD12      LEU 123  15.438  -5.387  -3.832
 1013   HD13  LEU 123          HD13      LEU 123  16.950  -5.158  -2.956
 1014   HD21  LEU 123          HD21      LEU 123  18.917  -6.325  -4.938
 1015   HD22  LEU 123          HD22      LEU 123  19.025  -4.775  -4.105
 1016   HD23  LEU 123          HD23      LEU 123  19.126  -4.837  -5.864
 1017    H    VAL 124           H        VAL 124  15.106  -5.116  -9.031
 1018    HA   VAL 124           HA       VAL 124  15.912  -7.036 -11.084
 1019    HB   VAL 124           HB       VAL 124  13.625  -8.018 -11.126
 1020   HG11  VAL 124          HG11      VAL 124  15.117  -8.427  -8.536
 1021   HG12  VAL 124          HG12      VAL 124  15.463  -9.231 -10.066
 1022   HG13  VAL 124          HG13      VAL 124  13.936  -9.533  -9.237
 1023   HG21  VAL 124          HG21      VAL 124  12.460  -6.228  -9.979
 1024   HG22  VAL 124          HG22      VAL 124  13.337  -6.583  -8.495
 1025   HG23  VAL 124          HG23      VAL 124  12.201  -7.756  -9.149
 1026    H    ALA 125           H        ALA 125  14.265  -6.944 -12.912
 1027    HA   ALA 125           HA       ALA 125  13.433  -4.133 -13.300
 1028    HB1  ALA 125           HB1      ALA 125  13.756  -4.486 -15.679
 1029    HB2  ALA 125           HB2      ALA 125  14.167  -6.178 -15.390
 1030    HB3  ALA 125           HB3      ALA 125  15.228  -4.899 -14.797
 1031    H    GLU 126           H        GLU 126  12.301  -7.256 -12.869
 1032    HA   GLU 126           HA       GLU 126   9.605  -6.458 -13.521
 1033    HB2  GLU 126           HB2      GLU 126   9.190  -8.440 -14.939
 1034    HB3  GLU 126           HB3      GLU 126  10.337  -7.321 -15.665
 1035    HG2  GLU 126           HG2      GLU 126  12.180  -8.757 -14.839
 1036    HG3  GLU 126           HG3      GLU 126  10.974  -9.909 -14.273
 1037    H    ARG 127           H        ARG 127   8.064  -8.288 -12.934
 1038    HA   ARG 127           HA       ARG 127   8.782  -9.050 -10.255
 1039    HB2  ARG 127           HB2      ARG 127   6.282  -8.878 -11.820
 1040    HB3  ARG 127           HB3      ARG 127   6.309 -10.070 -10.528
 1041    HG2  ARG 127           HG2      ARG 127   5.394  -7.964  -9.753
 1042    HG3  ARG 127           HG3      ARG 127   6.901  -8.340  -8.926
 1043    HD2  ARG 127           HD2      ARG 127   6.873  -6.003  -9.483
 1044    HD3  ARG 127           HD3      ARG 127   8.080  -6.815 -10.478
 1045    HE   ARG 127           HE       ARG 127   5.827  -6.810 -12.018
 1046   HH11  ARG 127          HH11      ARG 127   7.614  -4.316 -10.346
 1047   HH12  ARG 127          HH12      ARG 127   7.274  -3.092 -11.523
 1048   HH21  ARG 127          HH21      ARG 127   5.364  -5.209 -13.574
 1049   HH22  ARG 127          HH22      ARG 127   5.988  -3.605 -13.372
 1050    H    ARG 128           H        ARG 128   8.541 -10.665 -13.307
 1051    HA   ARG 128           HA       ARG 128   7.999 -13.267 -12.436
 1052    HB2  ARG 128           HB2      ARG 128   7.787 -13.028 -14.715
 1053    HB3  ARG 128           HB3      ARG 128   9.271 -12.098 -14.866
 1054    HG2  ARG 128           HG2      ARG 128  10.591 -14.110 -14.534
 1055    HG3  ARG 128           HG3      ARG 128   9.119 -15.054 -14.306
 1056    HD2  ARG 128           HD2      ARG 128  10.251 -15.125 -16.592
 1057    HD3  ARG 128           HD3      ARG 128   8.509 -14.859 -16.549
 1058    HE   ARG 128           HE       ARG 128  10.043 -12.424 -16.600
 1059   HH11  ARG 128          HH11      ARG 128   8.717 -14.984 -18.609
 1060   HH12  ARG 128          HH12      ARG 128   8.551 -13.969 -20.005
 1061   HH21  ARG 128          HH21      ARG 128   9.825 -11.109 -18.397
 1062   HH22  ARG 128          HH22      ARG 128   9.207 -11.753 -19.895
 1063    H    GLU 129           H        GLU 129  11.054 -11.535 -12.602
 1064    HA   GLU 129           HA       GLU 129  12.677 -13.859 -12.514
 1065    HB2  GLU 129           HB2      GLU 129  13.338 -10.965 -11.996
 1066    HB3  GLU 129           HB3      GLU 129  14.527 -12.248 -12.203
 1067    HG2  GLU 129           HG2      GLU 129  12.494 -11.355 -14.236
 1068    HG3  GLU 129           HG3      GLU 129  14.228 -11.019 -14.274
 1069    H    LEU 130           H        LEU 130  10.896 -12.423 -10.099
 1070    HA   LEU 130           HA       LEU 130  12.726 -13.365  -8.009
 1071    HB2  LEU 130           HB2      LEU 130  10.718 -12.173  -6.634
 1072    HB3  LEU 130           HB3      LEU 130  12.194 -11.373  -7.134
 1073    HG   LEU 130           HG       LEU 130   9.894 -11.354  -9.022
 1074   HD11  LEU 130          HD11      LEU 130   9.047  -9.313  -7.928
 1075   HD12  LEU 130          HD12      LEU 130  10.095  -9.657  -6.550
 1076   HD13  LEU 130          HD13      LEU 130   8.800 -10.777  -6.978
 1077   HD21  LEU 130          HD21      LEU 130  10.799  -9.069  -9.435
 1078   HD22  LEU 130          HD22      LEU 130  11.943 -10.370  -9.772
 1079   HD23  LEU 130          HD23      LEU 130  12.090  -9.428  -8.283
 1080    H    TYR 131           H        TYR 131  10.679 -14.796  -9.837
 1081    HA   TYR 131           HA       TYR 131   9.576 -16.447  -7.657
 1082    HB2  TYR 131           HB2      TYR 131   8.426 -15.975 -10.421
 1083    HB3  TYR 131           HB3      TYR 131   7.833 -17.185  -9.295
 1084    HD1  TYR 131           HD1      TYR 131   6.711 -16.464  -7.187
 1085    HD2  TYR 131           HD2      TYR 131   7.797 -13.687 -10.226
 1086    HE1  TYR 131           HE1      TYR 131   5.148 -14.818  -6.238
 1087    HE2  TYR 131           HE2      TYR 131   6.246 -12.036  -9.279
 1088    HH   TYR 131           HH       TYR 131   4.154 -12.081  -7.902
 1089    H    LYS 132           H        LYS 132  10.599 -18.355  -7.547
 1090    HA   LYS 132           HA       LYS 132  12.382 -19.156  -9.642
 1091    HB2  LYS 132           HB2      LYS 132  12.177 -19.654  -6.903
 1092    HB3  LYS 132           HB3      LYS 132  11.877 -21.211  -7.663
 1093    HG2  LYS 132           HG2      LYS 132  14.278 -19.462  -8.146
 1094    HG3  LYS 132           HG3      LYS 132  14.234 -20.892  -7.115
 1095    HD2  LYS 132           HD2      LYS 132  13.738 -22.296  -9.016
 1096    HD3  LYS 132           HD3      LYS 132  13.635 -20.885 -10.071
 1097    HE2  LYS 132           HE2      LYS 132  16.093 -21.811  -8.589
 1098    HE3  LYS 132           HE3      LYS 132  15.782 -22.033 -10.311
 1099    HZ1  LYS 132           HZ1      LYS 132  16.075 -19.424  -8.921
 1100    HZ2  LYS 132           HZ2      LYS 132  15.752 -19.626 -10.568
 1101    HZ3  LYS 132           HZ3      LYS 132  17.224 -20.149  -9.926
 1102    H    LYS 133           H        LYS 133  11.325 -19.717 -11.459
 1103    HA   LYS 133           HA       LYS 133   9.653 -22.130 -11.333
 1104    HB2  LYS 133           HB2      LYS 133   9.029 -19.638 -12.937
 1105    HB3  LYS 133           HB3      LYS 133   8.152 -21.157 -13.047
 1106    HG2  LYS 133           HG2      LYS 133   7.353 -20.933 -10.798
 1107    HG3  LYS 133           HG3      LYS 133   8.366 -19.513 -10.535
 1108    HD2  LYS 133           HD2      LYS 133   6.080 -18.827 -10.933
 1109    HD3  LYS 133           HD3      LYS 133   7.095 -18.318 -12.282
 1110    HE2  LYS 133           HE2      LYS 133   6.309 -20.192 -13.612
 1111    HE3  LYS 133           HE3      LYS 133   5.353 -20.781 -12.253
 1112    HZ1  LYS 133           HZ1      LYS 133   4.015 -19.558 -13.864
 1113    HZ2  LYS 133           HZ2      LYS 133   4.953 -18.176 -13.615
 1114    HZ3  LYS 133           HZ3      LYS 133   4.013 -18.793 -12.355
 1115    H    ARG 134           H        ARG 134   9.389 -23.062 -13.594
 1116    HA   ARG 134           HA       ARG 134  11.918 -23.025 -14.988
 1117    HB2  ARG 134           HB2      ARG 134   9.370 -24.395 -15.865
 1118    HB3  ARG 134           HB3      ARG 134  11.012 -24.764 -16.376
 1119    HG2  ARG 134           HG2      ARG 134   9.874 -25.176 -13.626
 1120    HG3  ARG 134           HG3      ARG 134  10.188 -26.429 -14.825
 1121    HD2  ARG 134           HD2      ARG 134  12.541 -26.079 -14.681
 1122    HD3  ARG 134           HD3      ARG 134  12.324 -24.622 -13.710
 1123    HE   ARG 134           HE       ARG 134  11.249 -27.049 -12.560
 1124   HH11  ARG 134          HH11      ARG 134  14.053 -24.961 -12.786
 1125   HH12  ARG 134          HH12      ARG 134  14.672 -25.422 -11.232
 1126   HH21  ARG 134          HH21      ARG 134  12.062 -27.645 -10.520
 1127   HH22  ARG 134          HH22      ARG 134  13.534 -26.932  -9.941
 1128    H    GLN 135           H        GLN 135  12.085 -20.957 -15.740
 1129    HA   GLN 135           HA       GLN 135   9.961 -19.988 -17.521
 1130    HB2  GLN 135           HB2      GLN 135  10.765 -17.709 -16.935
 1131    HB3  GLN 135           HB3      GLN 135  10.151 -18.605 -15.555
 1132    HG2  GLN 135           HG2      GLN 135  12.673 -19.246 -15.237
 1133    HG3  GLN 135           HG3      GLN 135  12.943 -17.799 -16.201
 1134   HE21  GLN 135          HE21      GLN 135  12.490 -15.782 -15.316
 1135   HE22  GLN 135          HE22      GLN 135  12.133 -15.571 -13.641
 1136    H    LYS 136           H        LYS 136  10.462 -19.135 -19.474
 1137    HA   LYS 136           HA       LYS 136  13.235 -19.480 -20.355
 1138    HB2  LYS 136           HB2      LYS 136  12.211 -19.345 -22.699
 1139    HB3  LYS 136           HB3      LYS 136  11.945 -20.816 -21.784
 1140    HG2  LYS 136           HG2      LYS 136   9.887 -18.672 -21.675
 1141    HG3  LYS 136           HG3      LYS 136  10.011 -19.675 -23.118
 1142    HD2  LYS 136           HD2      LYS 136   9.816 -21.685 -21.684
 1143    HD3  LYS 136           HD3      LYS 136   9.559 -20.635 -20.292
 1144    HE2  LYS 136           HE2      LYS 136   7.423 -21.373 -21.087
 1145    HE3  LYS 136           HE3      LYS 136   7.597 -19.661 -21.467
 1146    HZ1  LYS 136           HZ1      LYS 136   7.952 -21.930 -23.352
 1147    HZ2  LYS 136           HZ2      LYS 136   8.260 -20.313 -23.733
 1148    HZ3  LYS 136           HZ3      LYS 136   6.691 -20.804 -23.351
 1149    H    LYS 137           H        LYS 137  14.166 -17.663 -19.867
 1150    HA   LYS 137           HA       LYS 137  13.226 -15.164 -21.002
 1151    HB2  LYS 137           HB2      LYS 137  12.083 -15.174 -18.858
 1152    HB3  LYS 137           HB3      LYS 137  13.560 -15.633 -18.027
 1153    HG2  LYS 137           HG2      LYS 137  13.229 -13.341 -17.590
 1154    HG3  LYS 137           HG3      LYS 137  14.537 -13.427 -18.775
 1155    HD2  LYS 137           HD2      LYS 137  12.863 -12.989 -20.557
 1156    HD3  LYS 137           HD3      LYS 137  11.645 -12.753 -19.302
 1157    HE2  LYS 137           HE2      LYS 137  12.958 -10.929 -18.358
 1158    HE3  LYS 137           HE3      LYS 137  14.197 -11.174 -19.588
 1159    HZ1  LYS 137           HZ1      LYS 137  11.404 -10.296 -20.043
 1160    HZ2  LYS 137           HZ2      LYS 137  12.494 -10.663 -21.277
 1161    HZ3  LYS 137           HZ3      LYS 137  12.800  -9.368 -20.236
 1162    H    LEU 138           H        LEU 138  14.897 -13.680 -21.262
 1163    HA   LEU 138           HA       LEU 138  17.575 -14.217 -21.304
 1164    HB2  LEU 138           HB2      LEU 138  16.651 -12.143 -22.109
 1165    HB3  LEU 138           HB3      LEU 138  16.083 -11.713 -20.511
 1166    HG   LEU 138           HG       LEU 138  18.590 -11.683 -19.877
 1167   HD11  LEU 138          HD11      LEU 138  19.460 -12.702 -21.898
 1168   HD12  LEU 138          HD12      LEU 138  20.064 -11.053 -21.733
 1169   HD13  LEU 138          HD13      LEU 138  18.765 -11.405 -22.872
 1170   HD21  LEU 138          HD21      LEU 138  18.702  -9.352 -20.472
 1171   HD22  LEU 138          HD22      LEU 138  17.060  -9.769 -19.969
 1172   HD23  LEU 138          HD23      LEU 138  17.439  -9.572 -21.683
 1173    H    ALA 139           H        ALA 139  19.311 -13.514 -19.702
 1174    HA   ALA 139           HA       ALA 139  18.957 -14.811 -17.242
 1175    HB1  ALA 139           HB1      ALA 139  21.113 -13.882 -16.611
 1176    HB2  ALA 139           HB2      ALA 139  21.017 -12.718 -17.930
 1177    HB3  ALA 139           HB3      ALA 139  21.158 -14.439 -18.284
 1178    H    SER 140           H        SER 140  18.757 -13.971 -15.119
 1179    HA   SER 140           HA       SER 140  16.487 -12.485 -14.900
 1180    HB2  SER 140           HB2      SER 140  18.619 -13.005 -12.833
 1181    HB3  SER 140           HB3      SER 140  17.035 -12.314 -12.458
 1182    HG   SER 140           HG       SER 140  16.194 -14.245 -13.632
 1183    H    SER 141           H        SER 141  15.997 -10.512 -15.217
 1184    HA   SER 141           HA       SER 141  18.063  -8.464 -15.269
 1185    HB2  SER 141           HB2      SER 141  16.491  -8.867 -17.215
 1186    HB3  SER 141           HB3      SER 141  15.186  -8.269 -16.193
 1187    HG   SER 141           HG       SER 141  17.411  -6.639 -16.329
  Start of MODEL    4
    1    H1   ASP   1           HT1      ASP   1 -33.907  12.888  -9.290
    2    H2   ASP   1           HT2      ASP   1 -33.223  13.306  -7.806
    3    H3   ASP   1           HT3      ASP   1 -34.251  11.971  -7.914
    4    HA   ASP   1           HA       ASP   1 -32.684  10.824  -9.313
    5    HB2  ASP   1           HB2      ASP   1 -31.710  12.873 -10.329
    6    HB3  ASP   1           HB3      ASP   1 -30.903  13.216  -8.804
    7    HA   PRO   2           HA       PRO   2 -31.527   9.520  -5.191
    8    HB2  PRO   2           HB2      PRO   2 -30.869   6.981  -5.810
    9    HB3  PRO   2           HB3      PRO   2 -32.550   7.524  -5.750
   10    HG2  PRO   2           HG2      PRO   2 -30.778   7.096  -8.119
   11    HG3  PRO   2           HG3      PRO   2 -32.496   6.708  -7.920
   12    HD2  PRO   2           HD2      PRO   2 -31.551   8.926  -9.239
   13    HD3  PRO   2           HD3      PRO   2 -33.155   8.823  -8.490
   14    H    SER   3           H        SER   3 -29.545   9.263  -8.042
   15    HA   SER   3           HA       SER   3 -27.146   8.547  -6.591
   16    HB2  SER   3           HB2      SER   3 -26.157   8.642  -8.924
   17    HB3  SER   3           HB3      SER   3 -27.427   7.449  -8.667
   18    HG   SER   3           HG       SER   3 -28.276   9.963  -9.502
   19    H    ARG   4           H        ARG   4 -28.027  10.934  -5.701
   20    HA   ARG   4           HA       ARG   4 -26.698  13.087  -7.113
   21    HB2  ARG   4           HB2      ARG   4 -27.617  14.492  -5.286
   22    HB3  ARG   4           HB3      ARG   4 -28.854  13.547  -6.103
   23    HG2  ARG   4           HG2      ARG   4 -28.791  11.913  -4.277
   24    HG3  ARG   4           HG3      ARG   4 -27.583  12.899  -3.451
   25    HD2  ARG   4           HD2      ARG   4 -30.413  13.701  -4.128
   26    HD3  ARG   4           HD3      ARG   4 -29.781  13.336  -2.525
   27    HE   ARG   4           HE       ARG   4 -28.217  15.393  -3.472
   28   HH11  ARG   4          HH11      ARG   4 -31.613  14.887  -2.803
   29   HH12  ARG   4          HH12      ARG   4 -31.947  16.567  -2.537
   30   HH21  ARG   4          HH21      ARG   4 -28.633  17.607  -3.089
   31   HH22  ARG   4          HH22      ARG   4 -30.237  18.121  -2.665
   32    H    ARG   5           H        ARG   5 -25.785  14.639  -5.005
   33    HA   ARG   5           HA       ARG   5 -23.181  13.889  -4.647
   34    HB2  ARG   5           HB2      ARG   5 -24.454  16.086  -4.035
   35    HB3  ARG   5           HB3      ARG   5 -24.629  15.346  -2.456
   36    HG2  ARG   5           HG2      ARG   5 -21.973  15.782  -3.801
   37    HG3  ARG   5           HG3      ARG   5 -22.715  16.933  -2.692
   38    HD2  ARG   5           HD2      ARG   5 -22.658  15.315  -0.909
   39    HD3  ARG   5           HD3      ARG   5 -22.054  14.075  -2.010
   40    HE   ARG   5           HE       ARG   5 -20.482  16.510  -1.548
   41   HH11  ARG   5          HH11      ARG   5 -20.882  13.064  -1.135
   42   HH12  ARG   5          HH12      ARG   5 -19.196  12.766  -0.848
   43   HH21  ARG   5          HH21      ARG   5 -18.250  16.131  -1.119
   44   HH22  ARG   5          HH22      ARG   5 -17.704  14.511  -0.827
   45    H    ALA   6           H        ALA   6 -22.266  12.216  -3.690
   46    HA   ALA   6           HA       ALA   6 -23.584  10.228  -2.336
   47    HB1  ALA   6           HB1      ALA   6 -21.392   9.399  -1.646
   48    HB2  ALA   6           HB2      ALA   6 -20.669  10.942  -2.101
   49    HB3  ALA   6           HB3      ALA   6 -21.392   9.910  -3.336
   50    HA   PRO   7           HA       PRO   7 -24.449  11.953   1.657
   51    HB2  PRO   7           HB2      PRO   7 -24.588   9.117   2.478
   52    HB3  PRO   7           HB3      PRO   7 -25.818  10.380   2.588
   53    HG2  PRO   7           HG2      PRO   7 -26.020   8.414   0.800
   54    HG3  PRO   7           HG3      PRO   7 -26.515  10.071   0.404
   55    HD2  PRO   7           HD2      PRO   7 -24.020   8.604  -0.353
   56    HD3  PRO   7           HD3      PRO   7 -25.026   9.706  -1.319
   57    H    THR   8           H        THR   8 -23.752  11.575   3.960
   58    HA   THR   8           HA       THR   8 -20.909  10.937   4.068
   59    HB   THR   8           HB       THR   8 -21.418  11.800   6.548
   60    HG1  THR   8           HG1      THR   8 -23.403  12.528   6.670
   61   HG21  THR   8          HG21      THR   8 -20.825  14.067   5.781
   62   HG22  THR   8          HG22      THR   8 -21.150  13.575   4.119
   63   HG23  THR   8          HG23      THR   8 -19.830  12.828   5.018
   64    H    TRP   9           H        TRP   9 -20.109   9.590   5.862
   65    HA   TRP   9           HA       TRP   9 -21.899   7.323   6.269
   66    HB2  TRP   9           HB2      TRP   9 -18.939   7.659   6.765
   67    HB3  TRP   9           HB3      TRP   9 -19.839   6.205   7.183
   68    HD1  TRP   9           HD1      TRP   9 -18.471   8.130   4.201
   69    HE1  TRP   9           HE1      TRP   9 -18.502   6.605   2.139
   70    HE3  TRP   9           HE3      TRP   9 -21.084   4.182   6.147
   71    HZ2  TRP   9           HZ2      TRP   9 -19.495   4.059   1.426
   72    HZ3  TRP   9           HZ3      TRP   9 -21.538   2.242   4.689
   73    HH2  TRP   9           HH2      TRP   9 -20.760   2.192   2.382
   74    H    SER  10           H        SER  10 -21.851   6.249   8.377
   75    HA   SER  10           HA       SER  10 -21.329   7.994  10.659
   76    HB2  SER  10           HB2      SER  10 -23.503   7.195  11.666
   77    HB3  SER  10           HB3      SER  10 -23.712   8.252  10.270
   78    HG   SER  10           HG       SER  10 -24.653   6.675   9.254
   79    HA   PRO  11           HA       PRO  11 -19.254   4.558  12.545
   80    HB2  PRO  11           HB2      PRO  11 -21.308   4.896  14.705
   81    HB3  PRO  11           HB3      PRO  11 -19.560   4.664  14.845
   82    HG2  PRO  11           HG2      PRO  11 -20.634   7.090  15.105
   83    HG3  PRO  11           HG3      PRO  11 -19.087   6.859  14.271
   84    HD2  PRO  11           HD2      PRO  11 -21.749   7.514  13.154
   85    HD3  PRO  11           HD3      PRO  11 -20.135   7.867  12.510
   86    H    GLU  12           H        GLU  12 -22.807   4.457  12.828
   87    HA   GLU  12           HA       GLU  12 -22.976   1.652  13.140
   88    HB2  GLU  12           HB2      GLU  12 -25.376   1.938  12.616
   89    HB3  GLU  12           HB3      GLU  12 -24.813   3.078  13.829
   90    HG2  GLU  12           HG2      GLU  12 -24.791   4.861  12.245
   91    HG3  GLU  12           HG3      GLU  12 -25.084   3.749  10.911
   92    H    GLU  13           H        GLU  13 -23.132   3.749  10.291
   93    HA   GLU  13           HA       GLU  13 -23.862   1.600   8.532
   94    HB2  GLU  13           HB2      GLU  13 -24.448   4.055   8.227
   95    HB3  GLU  13           HB3      GLU  13 -22.782   4.294   7.723
   96    HG2  GLU  13           HG2      GLU  13 -24.157   4.073   5.781
   97    HG3  GLU  13           HG3      GLU  13 -23.135   2.641   5.914
   98    H    GLU  14           H        GLU  14 -20.892   3.206   9.494
   99    HA   GLU  14           HA       GLU  14 -19.214   2.046   7.515
  100    HB2  GLU  14           HB2      GLU  14 -18.519   2.983  10.307
  101    HB3  GLU  14           HB3      GLU  14 -17.362   2.639   9.029
  102    HG2  GLU  14           HG2      GLU  14 -18.334   4.439   7.683
  103    HG3  GLU  14           HG3      GLU  14 -19.460   4.793   8.993
  104    H    ALA  15           H        ALA  15 -20.243   1.038  10.738
  105    HA   ALA  15           HA       ALA  15 -18.720  -1.334  10.867
  106    HB1  ALA  15           HB1      ALA  15 -20.317  -2.041  12.583
  107    HB2  ALA  15           HB2      ALA  15 -21.386  -0.711  12.135
  108    HB3  ALA  15           HB3      ALA  15 -19.799  -0.375  12.827
  109    H    HIS  16           H        HIS  16 -21.672  -0.487   9.287
  110    HA   HIS  16           HA       HIS  16 -22.479  -3.142   8.612
  111    HB2  HIS  16           HB2      HIS  16 -24.118  -1.316   8.838
  112    HB3  HIS  16           HB3      HIS  16 -23.369  -0.479   7.484
  113    HD1  HIS  16           HD1      HIS  16 -25.247  -0.537   5.853
  114    HD2  HIS  16           HD2      HIS  16 -24.376  -4.290   7.421
  115    HE1  HIS  16           HE1      HIS  16 -26.628  -2.182   4.525
  116    HE2  HIS  16           HE2      HIS  16 -26.239  -4.406   5.634
  117    H    LEU  17           H        LEU  17 -20.537  -0.623   7.174
  118    HA   LEU  17           HA       LEU  17 -20.352  -1.647   4.563
  119    HB2  LEU  17           HB2      LEU  17 -19.591   0.614   5.302
  120    HB3  LEU  17           HB3      LEU  17 -18.240  -0.144   6.122
  121    HG   LEU  17           HG       LEU  17 -17.435  -0.993   3.930
  122   HD11  LEU  17          HD11      LEU  17 -19.713   0.666   2.874
  123   HD12  LEU  17          HD12      LEU  17 -19.487  -1.073   2.695
  124   HD13  LEU  17          HD13      LEU  17 -18.389   0.047   1.892
  125   HD21  LEU  17          HD21      LEU  17 -16.553   1.074   4.885
  126   HD22  LEU  17          HD22      LEU  17 -17.825   1.993   4.080
  127   HD23  LEU  17          HD23      LEU  17 -16.607   1.148   3.124
  128    H    ARG  18           H        ARG  18 -18.338  -2.137   7.440
  129    HA   ARG  18           HA       ARG  18 -16.792  -4.176   6.160
  130    HB2  ARG  18           HB2      ARG  18 -15.756  -4.505   8.350
  131    HB3  ARG  18           HB3      ARG  18 -15.774  -2.807   7.904
  132    HG2  ARG  18           HG2      ARG  18 -17.752  -2.498   9.365
  133    HG3  ARG  18           HG3      ARG  18 -17.579  -4.178   9.882
  134    HD2  ARG  18           HD2      ARG  18 -15.321  -3.693  10.691
  135    HD3  ARG  18           HD3      ARG  18 -15.496  -2.019  10.178
  136    HE   ARG  18           HE       ARG  18 -17.212  -3.230  12.250
  137   HH11  ARG  18          HH11      ARG  18 -15.224  -0.601  11.057
  138   HH12  ARG  18          HH12      ARG  18 -15.448   0.377  12.471
  139   HH21  ARG  18          HH21      ARG  18 -17.482  -1.953  14.125
  140   HH22  ARG  18          HH22      ARG  18 -16.727  -0.396  14.224
  141    H    GLU  19           H        GLU  19 -19.701  -3.982   7.996
  142    HA   GLU  19           HA       GLU  19 -19.994  -6.519   9.000
  143    HB2  GLU  19           HB2      GLU  19 -21.631  -4.770   9.397
  144    HB3  GLU  19           HB3      GLU  19 -22.085  -4.783   7.700
  145    HG2  GLU  19           HG2      GLU  19 -23.738  -5.923   9.026
  146    HG3  GLU  19           HG3      GLU  19 -22.931  -7.051   7.938
  147    H    LEU  20           H        LEU  20 -20.916  -5.334   5.806
  148    HA   LEU  20           HA       LEU  20 -21.673  -7.883   4.799
  149    HB2  LEU  20           HB2      LEU  20 -21.873  -5.183   4.030
  150    HB3  LEU  20           HB3      LEU  20 -21.006  -5.991   2.741
  151    HG   LEU  20           HG       LEU  20 -23.595  -7.090   3.789
  152   HD11  LEU  20          HD11      LEU  20 -24.757  -5.890   2.042
  153   HD12  LEU  20          HD12      LEU  20 -23.261  -5.096   1.559
  154   HD13  LEU  20          HD13      LEU  20 -23.969  -4.754   3.135
  155   HD21  LEU  20          HD21      LEU  20 -23.684  -8.058   1.533
  156   HD22  LEU  20          HD22      LEU  20 -22.258  -8.577   2.432
  157   HD23  LEU  20          HD23      LEU  20 -22.109  -7.341   1.183
  158    H    TYR  21           H        TYR  21 -18.695  -6.068   4.885
  159    HA   TYR  21           HA       TYR  21 -17.297  -7.507   2.876
  160    HB2  TYR  21           HB2      TYR  21 -16.494  -5.329   3.688
  161    HB3  TYR  21           HB3      TYR  21 -16.246  -6.010   5.290
  162    HD1  TYR  21           HD1      TYR  21 -15.071  -6.198   1.771
  163    HD2  TYR  21           HD2      TYR  21 -14.241  -7.106   5.839
  164    HE1  TYR  21           HE1      TYR  21 -12.770  -6.804   1.157
  165    HE2  TYR  21           HE2      TYR  21 -11.939  -7.719   5.239
  166    HH   TYR  21           HH       TYR  21 -10.705  -8.476   3.237
  167    H    LEU  22           H        LEU  22 -17.293  -7.671   6.400
  168    HA   LEU  22           HA       LEU  22 -15.582  -9.881   6.644
  169    HB2  LEU  22           HB2      LEU  22 -17.755  -9.068   8.574
  170    HB3  LEU  22           HB3      LEU  22 -16.293  -9.957   8.941
  171    HG   LEU  22           HG       LEU  22 -16.374  -7.087   8.023
  172   HD11  LEU  22          HD11      LEU  22 -15.727  -6.534  10.313
  173   HD12  LEU  22          HD12      LEU  22 -15.928  -8.225  10.772
  174   HD13  LEU  22          HD13      LEU  22 -17.321  -7.285  10.233
  175   HD21  LEU  22          HD21      LEU  22 -14.059  -8.650   9.139
  176   HD22  LEU  22          HD22      LEU  22 -14.049  -6.994   8.524
  177   HD23  LEU  22          HD23      LEU  22 -14.320  -8.345   7.424
  178    H    ALA  23           H        ALA  23 -18.937  -9.652   5.881
  179    HA   ALA  23           HA       ALA  23 -19.614 -12.330   6.650
  180    HB1  ALA  23           HB1      ALA  23 -21.259 -10.514   6.668
  181    HB2  ALA  23           HB2      ALA  23 -21.772 -11.864   5.656
  182    HB3  ALA  23           HB3      ALA  23 -21.135 -10.397   4.913
  183    H    ASN  24           H        ASN  24 -18.385 -10.826   3.725
  184    HA   ASN  24           HA       ASN  24 -18.793 -13.396   2.338
  185    HB2  ASN  24           HB2      ASN  24 -19.030 -10.601   1.218
  186    HB3  ASN  24           HB3      ASN  24 -18.929 -12.043   0.211
  187   HD21  ASN  24          HD21      ASN  24 -20.904 -10.196   2.387
  188   HD22  ASN  24          HD22      ASN  24 -22.375 -11.070   2.112
  189    H    LYS  25           H        LYS  25 -16.431 -11.867   3.769
  190    HA   LYS  25           HA       LYS  25 -14.511 -11.645   1.634
  191    HB2  LYS  25           HB2      LYS  25 -12.870 -11.204   3.401
  192    HB3  LYS  25           HB3      LYS  25 -14.303 -10.205   3.592
  193    HG2  LYS  25           HG2      LYS  25 -15.116 -11.685   5.351
  194    HG3  LYS  25           HG3      LYS  25 -13.695 -12.711   5.152
  195    HD2  LYS  25           HD2      LYS  25 -13.512  -9.784   5.835
  196    HD3  LYS  25           HD3      LYS  25 -13.622 -11.044   7.063
  197    HE2  LYS  25           HE2      LYS  25 -11.492 -10.951   4.934
  198    HE3  LYS  25           HE3      LYS  25 -11.295 -10.274   6.548
  199    HZ1  LYS  25           HZ1      LYS  25 -11.787 -13.123   5.874
  200    HZ2  LYS  25           HZ2      LYS  25 -11.739 -12.506   7.445
  201    HZ3  LYS  25           HZ3      LYS  25 -10.354 -12.460   6.478
  202    H    ASP  26           H        ASP  26 -15.763 -14.172   3.470
  203    HA   ASP  26           HA       ASP  26 -13.372 -15.830   3.101
  204    HB2  ASP  26           HB2      ASP  26 -14.369 -17.411   4.625
  205    HB3  ASP  26           HB3      ASP  26 -14.472 -15.810   5.347
  206    H    VAL  27           H        VAL  27 -15.764 -14.946   1.224
  207    HA   VAL  27           HA       VAL  27 -16.421 -17.622   0.218
  208    HB   VAL  27           HB       VAL  27 -17.687 -14.979  -0.531
  209   HG11  VAL  27          HG11      VAL  27 -17.889 -16.651  -2.275
  210   HG12  VAL  27          HG12      VAL  27 -19.454 -16.383  -1.505
  211   HG13  VAL  27          HG13      VAL  27 -18.509 -17.821  -1.112
  212   HG21  VAL  27          HG21      VAL  27 -18.148 -15.461   1.795
  213   HG22  VAL  27          HG22      VAL  27 -18.650 -17.100   1.384
  214   HG23  VAL  27          HG23      VAL  27 -19.603 -15.722   0.832
  215    H    GLU  28           H        GLU  28 -14.969 -18.280  -1.208
  216    HA   GLU  28           HA       GLU  28 -13.445 -16.425  -2.803
  217    HB2  GLU  28           HB2      GLU  28 -13.498 -19.448  -2.830
  218    HB3  GLU  28           HB3      GLU  28 -12.321 -18.437  -3.651
  219    HG2  GLU  28           HG2      GLU  28 -12.729 -18.500  -0.673
  220    HG3  GLU  28           HG3      GLU  28 -11.493 -19.415  -1.535
  221    H    GLY  29           H        GLY  29 -13.546 -16.164  -5.021
  222    HA2  GLY  29           HA2      GLY  29 -14.429 -16.331  -7.162
  223    HA3  GLY  29           HA3      GLY  29 -15.441 -17.658  -6.608
  224    H    GLN  30           H        GLN  30 -15.480 -14.767  -4.766
  225    HA   GLN  30           HA       GLN  30 -17.844 -13.770  -6.171
  226    HB2  GLN  30           HB2      GLN  30 -18.504 -15.259  -4.216
  227    HB3  GLN  30           HB3      GLN  30 -17.768 -14.067  -3.167
  228    HG2  GLN  30           HG2      GLN  30 -19.875 -13.245  -5.108
  229    HG3  GLN  30           HG3      GLN  30 -20.332 -14.033  -3.607
  230   HE21  GLN  30          HE21      GLN  30 -18.144 -12.666  -2.105
  231   HE22  GLN  30          HE22      GLN  30 -18.690 -11.048  -1.933
  232    H    ASP  31           H        ASP  31 -17.827 -11.624  -6.373
  233    HA   ASP  31           HA       ASP  31 -15.590 -10.121  -5.424
  234    HB2  ASP  31           HB2      ASP  31 -18.151  -9.291  -6.777
  235    HB3  ASP  31           HB3      ASP  31 -16.851  -8.166  -6.394
  236    H    VAL  32           H        VAL  32 -15.602 -10.101  -3.189
  237    HA   VAL  32           HA       VAL  32 -17.779  -9.581  -1.530
  238    HB   VAL  32           HB       VAL  32 -15.462 -10.318  -0.818
  239   HG11  VAL  32          HG11      VAL  32 -14.172  -8.663  -1.980
  240   HG12  VAL  32          HG12      VAL  32 -13.872  -8.524  -0.247
  241   HG13  VAL  32          HG13      VAL  32 -14.936  -7.365  -1.059
  242   HG21  VAL  32          HG21      VAL  32 -17.152  -9.765   0.831
  243   HG22  VAL  32          HG22      VAL  32 -16.749  -8.051   0.707
  244   HG23  VAL  32          HG23      VAL  32 -15.573  -9.190   1.367
  245    H    VAL  33           H        VAL  33 -15.753  -7.480  -3.395
  246    HA   VAL  33           HA       VAL  33 -16.330  -4.970  -2.395
  247    HB   VAL  33           HB       VAL  33 -16.268  -5.496  -5.341
  248   HG11  VAL  33          HG11      VAL  33 -16.558  -3.219  -4.780
  249   HG12  VAL  33          HG12      VAL  33 -14.891  -3.415  -5.321
  250   HG13  VAL  33          HG13      VAL  33 -15.253  -3.276  -3.601
  251   HG21  VAL  33          HG21      VAL  33 -14.534  -6.912  -4.673
  252   HG22  VAL  33          HG22      VAL  33 -13.984  -5.796  -3.428
  253   HG23  VAL  33          HG23      VAL  33 -13.736  -5.406  -5.130
  254    H    GLU  34           H        GLU  34 -17.948  -6.642  -5.079
  255    HA   GLU  34           HA       GLU  34 -20.076  -4.763  -5.145
  256    HB2  GLU  34           HB2      GLU  34 -19.719  -7.424  -6.509
  257    HB3  GLU  34           HB3      GLU  34 -21.105  -6.373  -6.773
  258    HG2  GLU  34           HG2      GLU  34 -19.497  -4.578  -7.451
  259    HG3  GLU  34           HG3      GLU  34 -18.219  -5.791  -7.391
  260    H    ALA  35           H        ALA  35 -19.563  -7.838  -3.566
  261    HA   ALA  35           HA       ALA  35 -22.160  -8.432  -2.782
  262    HB1  ALA  35           HB1      ALA  35 -21.187  -9.450  -0.772
  263    HB2  ALA  35           HB2      ALA  35 -19.654  -8.647  -1.114
  264    HB3  ALA  35           HB3      ALA  35 -20.273  -9.873  -2.221
  265    H    ILE  36           H        ILE  36 -19.849  -6.155  -1.400
  266    HA   ILE  36           HA       ILE  36 -21.585  -5.312   0.697
  267    HB   ILE  36           HB       ILE  36 -19.175  -3.908  -0.448
  268   HG12  ILE  36          HG12      ILE  36 -19.264  -5.661   1.998
  269   HG13  ILE  36          HG13      ILE  36 -18.874  -6.301   0.403
  270   HG21  ILE  36          HG21      ILE  36 -19.076  -2.811   1.744
  271   HG22  ILE  36          HG22      ILE  36 -20.567  -3.627   2.212
  272   HG23  ILE  36          HG23      ILE  36 -20.581  -2.452   0.898
  273   HD11  ILE  36          HD11      ILE  36 -17.007  -4.721   0.265
  274   HD12  ILE  36          HD12      ILE  36 -16.875  -5.834   1.624
  275   HD13  ILE  36          HD13      ILE  36 -17.384  -4.170   1.897
  276    H    LEU  37           H        LEU  37 -20.328  -3.593  -2.162
  277    HA   LEU  37           HA       LEU  37 -21.946  -1.337  -1.639
  278    HB2  LEU  37           HB2      LEU  37 -21.196  -0.566  -3.912
  279    HB3  LEU  37           HB3      LEU  37 -19.947  -0.902  -2.737
  280    HG   LEU  37           HG       LEU  37 -19.660  -3.164  -3.899
  281   HD11  LEU  37          HD11      LEU  37 -21.311  -1.700  -5.966
  282   HD12  LEU  37          HD12      LEU  37 -21.708  -3.228  -5.179
  283   HD13  LEU  37          HD13      LEU  37 -20.344  -3.135  -6.294
  284   HD21  LEU  37          HD21      LEU  37 -19.021  -0.604  -5.347
  285   HD22  LEU  37          HD22      LEU  37 -18.255  -2.165  -5.638
  286   HD23  LEU  37          HD23      LEU  37 -18.062  -1.364  -4.078
  287    H    ALA  38           H        ALA  38 -22.673  -4.213  -3.345
  288    HA   ALA  38           HA       ALA  38 -24.886  -2.989  -4.779
  289    HB1  ALA  38           HB1      ALA  38 -23.573  -4.744  -5.869
  290    HB2  ALA  38           HB2      ALA  38 -25.275  -5.186  -5.722
  291    HB3  ALA  38           HB3      ALA  38 -24.083  -5.886  -4.625
  292    H    HIS  39           H        HIS  39 -24.354  -4.769  -1.817
  293    HA   HIS  39           HA       HIS  39 -27.164  -5.494  -1.636
  294    HB2  HIS  39           HB2      HIS  39 -24.750  -6.135  -0.000
  295    HB3  HIS  39           HB3      HIS  39 -26.344  -6.299   0.727
  296    HD1  HIS  39           HD1      HIS  39 -27.665  -8.363   0.146
  297    HD2  HIS  39           HD2      HIS  39 -24.289  -7.886  -2.217
  298    HE1  HIS  39           HE1      HIS  39 -27.438 -10.501  -1.149
  299    HE2  HIS  39           HE2      HIS  39 -25.549 -10.077  -2.752
  300    H    LEU  40           H        LEU  40 -25.024  -3.045  -0.291
  301    HA   LEU  40           HA       LEU  40 -27.216  -2.259   1.466
  302    HB2  LEU  40           HB2      LEU  40 -25.431  -0.503   2.249
  303    HB3  LEU  40           HB3      LEU  40 -25.451  -2.137   2.855
  304    HG   LEU  40           HG       LEU  40 -23.658  -2.648   1.114
  305   HD11  LEU  40          HD11      LEU  40 -22.306  -0.781   0.358
  306   HD12  LEU  40          HD12      LEU  40 -23.438   0.359   1.086
  307   HD13  LEU  40          HD13      LEU  40 -23.949  -0.649  -0.273
  308   HD21  LEU  40          HD21      LEU  40 -21.895  -1.750   2.566
  309   HD22  LEU  40          HD22      LEU  40 -23.206  -2.487   3.486
  310   HD23  LEU  40          HD23      LEU  40 -23.088  -0.729   3.369
  311    H    ASN  41           H        ASN  41 -28.650  -1.434   0.012
  312    HA   ASN  41           HA       ASN  41 -27.875   0.772  -1.708
  313    HB2  ASN  41           HB2      ASN  41 -29.654  -1.039  -2.235
  314    HB3  ASN  41           HB3      ASN  41 -30.712  -0.109  -1.181
  315   HD21  ASN  41          HD21      ASN  41 -31.430   1.930  -1.854
  316   HD22  ASN  41          HD22      ASN  41 -31.289   2.451  -3.496
  317    H    THR  42           H        THR  42 -27.374   1.200   0.975
  318    HA   THR  42           HA       THR  42 -29.391   3.115   1.883
  319    HB   THR  42           HB       THR  42 -28.628   1.596   3.599
  320    HG1  THR  42           HG1      THR  42 -27.442   3.238   5.001
  321   HG21  THR  42          HG21      THR  42 -26.309   1.369   4.261
  322   HG22  THR  42          HG22      THR  42 -25.820   2.546   3.039
  323   HG23  THR  42          HG23      THR  42 -26.485   0.991   2.549
  324    H    VAL  43           H        VAL  43 -26.578   2.925   0.084
  325    HA   VAL  43           HA       VAL  43 -26.183   5.809   0.193
  326    HB   VAL  43           HB       VAL  43 -23.656   5.405   0.185
  327   HG11  VAL  43          HG11      VAL  43 -24.744   6.446   2.061
  328   HG12  VAL  43          HG12      VAL  43 -23.534   5.305   2.647
  329   HG13  VAL  43          HG13      VAL  43 -25.245   4.876   2.688
  330   HG21  VAL  43          HG21      VAL  43 -22.879   3.381   1.331
  331   HG22  VAL  43          HG22      VAL  43 -23.702   2.993  -0.180
  332   HG23  VAL  43          HG23      VAL  43 -24.531   2.766   1.360
  333    HA   PRO  44           HA       PRO  44 -25.874   4.778  -4.219
  334    HB2  PRO  44           HB2      PRO  44 -26.137   7.345  -5.063
  335    HB3  PRO  44           HB3      PRO  44 -27.522   6.336  -4.631
  336    HG2  PRO  44           HG2      PRO  44 -26.138   8.445  -3.023
  337    HG3  PRO  44           HG3      PRO  44 -27.873   8.119  -3.188
  338    HD2  PRO  44           HD2      PRO  44 -26.414   7.315  -1.043
  339    HD3  PRO  44           HD3      PRO  44 -27.827   6.420  -1.639
  340    H    ARG  45           H        ARG  45 -23.694   4.191  -4.228
  341    HA   ARG  45           HA       ARG  45 -21.763   6.396  -4.370
  342    HB2  ARG  45           HB2      ARG  45 -21.497   3.911  -2.684
  343    HB3  ARG  45           HB3      ARG  45 -20.180   5.035  -3.005
  344    HG2  ARG  45           HG2      ARG  45 -21.569   6.829  -1.992
  345    HG3  ARG  45           HG3      ARG  45 -22.734   5.586  -1.526
  346    HD2  ARG  45           HD2      ARG  45 -20.804   4.409  -0.393
  347    HD3  ARG  45           HD3      ARG  45 -19.884   5.892  -0.637
  348    HE   ARG  45           HE       ARG  45 -21.979   5.432   1.274
  349   HH11  ARG  45          HH11      ARG  45 -20.246   7.878  -0.531
  350   HH12  ARG  45          HH12      ARG  45 -20.562   9.135   0.620
  351   HH21  ARG  45          HH21      ARG  45 -22.383   7.079   2.804
  352   HH22  ARG  45          HH22      ARG  45 -21.787   8.682   2.507
  353    H    THR  46           H        THR  46 -19.488   5.374  -4.857
  354    HA   THR  46           HA       THR  46 -19.918   3.719  -7.258
  355    HB   THR  46           HB       THR  46 -19.076   5.993  -7.706
  356    HG1  THR  46           HG1      THR  46 -17.043   5.212  -8.798
  357   HG21  THR  46          HG21      THR  46 -17.817   6.467  -5.709
  358   HG22  THR  46          HG22      THR  46 -16.728   6.549  -7.093
  359   HG23  THR  46          HG23      THR  46 -16.711   5.136  -6.044
  360    H    ARG  47           H        ARG  47 -17.929   2.383  -7.867
  361    HA   ARG  47           HA       ARG  47 -17.496   0.430  -5.925
  362    HB2  ARG  47           HB2      ARG  47 -16.312   1.053  -8.567
  363    HB3  ARG  47           HB3      ARG  47 -15.354   0.023  -7.516
  364    HG2  ARG  47           HG2      ARG  47 -16.683  -1.334  -8.979
  365    HG3  ARG  47           HG3      ARG  47 -17.260  -1.519  -7.326
  366    HD2  ARG  47           HD2      ARG  47 -19.091   0.024  -7.783
  367    HD3  ARG  47           HD3      ARG  47 -18.497   0.245  -9.428
  368    HE   ARG  47           HE       ARG  47 -18.912  -2.491  -8.992
  369   HH11  ARG  47          HH11      ARG  47 -20.731   0.470  -9.364
  370   HH12  ARG  47          HH12      ARG  47 -22.150  -0.324  -9.969
  371   HH21  ARG  47          HH21      ARG  47 -20.766  -3.560  -9.798
  372   HH22  ARG  47          HH22      ARG  47 -22.164  -2.620 -10.230
  373    H    LYS  48           H        LYS  48 -15.219   2.873  -7.091
  374    HA   LYS  48           HA       LYS  48 -13.035   2.364  -5.498
  375    HB2  LYS  48           HB2      LYS  48 -13.038   3.971  -7.331
  376    HB3  LYS  48           HB3      LYS  48 -14.125   5.020  -6.437
  377    HG2  LYS  48           HG2      LYS  48 -12.206   4.992  -4.660
  378    HG3  LYS  48           HG3      LYS  48 -11.219   4.525  -6.047
  379    HD2  LYS  48           HD2      LYS  48 -11.126   6.907  -5.860
  380    HD3  LYS  48           HD3      LYS  48 -12.131   6.518  -7.260
  381    HE2  LYS  48           HE2      LYS  48 -14.147   6.856  -5.908
  382    HE3  LYS  48           HE3      LYS  48 -13.147   7.229  -4.505
  383    HZ1  LYS  48           HZ1      LYS  48 -12.265   9.144  -5.711
  384    HZ2  LYS  48           HZ2      LYS  48 -13.945   9.239  -5.546
  385    HZ3  LYS  48           HZ3      LYS  48 -13.266   8.792  -7.029
  386    H    GLN  49           H        GLN  49 -16.025   3.908  -4.631
  387    HA   GLN  49           HA       GLN  49 -15.065   5.377  -2.413
  388    HB2  GLN  49           HB2      GLN  49 -17.222   5.631  -3.890
  389    HB3  GLN  49           HB3      GLN  49 -17.930   4.559  -2.692
  390    HG2  GLN  49           HG2      GLN  49 -17.816   6.112  -1.044
  391    HG3  GLN  49           HG3      GLN  49 -16.443   6.939  -1.770
  392   HE21  GLN  49          HE21      GLN  49 -17.405   8.951  -1.585
  393   HE22  GLN  49          HE22      GLN  49 -18.718   9.436  -2.604
  394    H    ILE  50           H        ILE  50 -17.072   2.419  -2.616
  395    HA   ILE  50           HA       ILE  50 -17.067   1.884   0.142
  396    HB   ILE  50           HB       ILE  50 -17.550   0.173  -2.270
  397   HG12  ILE  50          HG12      ILE  50 -19.725  -0.175  -0.853
  398   HG13  ILE  50          HG13      ILE  50 -19.167   1.252   0.012
  399   HG21  ILE  50          HG21      ILE  50 -16.350  -1.321  -0.792
  400   HG22  ILE  50          HG22      ILE  50 -18.058  -1.760  -0.841
  401   HG23  ILE  50          HG23      ILE  50 -17.411  -0.886   0.547
  402   HD11  ILE  50          HD11      ILE  50 -19.156   2.500  -2.098
  403   HD12  ILE  50          HD12      ILE  50 -20.750   1.853  -1.704
  404   HD13  ILE  50          HD13      ILE  50 -19.759   1.066  -2.932
  405    H    ILE  51           H        ILE  51 -14.959   0.680  -2.446
  406    HA   ILE  51           HA       ILE  51 -13.366  -1.067  -1.011
  407    HB   ILE  51           HB       ILE  51 -12.474   0.783  -3.223
  408   HG12  ILE  51          HG12      ILE  51 -13.465  -2.067  -3.399
  409   HG13  ILE  51          HG13      ILE  51 -14.430  -0.648  -3.796
  410   HG21  ILE  51          HG21      ILE  51 -10.739  -0.908  -3.632
  411   HG22  ILE  51          HG22      ILE  51 -11.266  -1.777  -2.193
  412   HG23  ILE  51          HG23      ILE  51 -10.584  -0.157  -2.045
  413   HD11  ILE  51          HD11      ILE  51 -13.526  -1.714  -5.788
  414   HD12  ILE  51          HD12      ILE  51 -11.889  -1.480  -5.176
  415   HD13  ILE  51          HD13      ILE  51 -12.886  -0.084  -5.585
  416    H    HIS  52           H        HIS  52 -12.960   2.411  -1.488
  417    HA   HIS  52           HA       HIS  52 -10.430   2.638  -0.341
  418    HB2  HIS  52           HB2      HIS  52 -12.545   4.475  -1.190
  419    HB3  HIS  52           HB3      HIS  52 -11.545   5.098   0.122
  420    HD1  HIS  52           HD1      HIS  52  -9.831   6.564  -0.856
  421    HD2  HIS  52           HD2      HIS  52 -10.479   3.185  -3.202
  422    HE1  HIS  52           HE1      HIS  52  -8.139   6.687  -2.705
  423    HE2  HIS  52           HE2      HIS  52  -8.468   4.584  -4.045
  424    H    HIS  53           H        HIS  53 -13.627   2.909   1.196
  425    HA   HIS  53           HA       HIS  53 -12.525   3.897   3.652
  426    HB2  HIS  53           HB2      HIS  53 -15.231   2.613   3.316
  427    HB3  HIS  53           HB3      HIS  53 -14.728   3.754   4.556
  428    HD1  HIS  53           HD1      HIS  53 -13.415   5.854   2.607
  429    HD2  HIS  53           HD2      HIS  53 -17.180   4.146   2.188
  430    HE1  HIS  53           HE1      HIS  53 -14.677   7.375   1.046
  431    HE2  HIS  53           HE2      HIS  53 -17.008   6.460   1.029
  432    H    LEU  54           H        LEU  54 -12.970   0.810   2.289
  433    HA   LEU  54           HA       LEU  54 -13.065  -0.661   4.755
  434    HB2  LEU  54           HB2      LEU  54 -12.732  -1.425   1.867
  435    HB3  LEU  54           HB3      LEU  54 -12.601  -2.611   3.148
  436    HG   LEU  54           HG       LEU  54 -15.047  -0.888   2.788
  437   HD11  LEU  54          HD11      LEU  54 -14.619  -2.184   0.744
  438   HD12  LEU  54          HD12      LEU  54 -16.059  -2.733   1.598
  439   HD13  LEU  54          HD13      LEU  54 -14.564  -3.659   1.710
  440   HD21  LEU  54          HD21      LEU  54 -16.131  -2.638   4.105
  441   HD22  LEU  54          HD22      LEU  54 -14.769  -1.950   4.990
  442   HD23  LEU  54          HD23      LEU  54 -14.610  -3.524   4.209
  443    H    VAL  55           H        VAL  55 -10.633  -0.193   2.201
  444    HA   VAL  55           HA       VAL  55  -8.582  -1.562   3.609
  445    HB   VAL  55           HB       VAL  55  -7.056  -0.771   1.950
  446   HG11  VAL  55          HG11      VAL  55  -9.768  -1.271   0.738
  447   HG12  VAL  55          HG12      VAL  55  -8.587  -2.489   1.217
  448   HG13  VAL  55          HG13      VAL  55  -8.233  -1.396  -0.120
  449   HG21  VAL  55          HG21      VAL  55  -7.629   1.588   1.918
  450   HG22  VAL  55          HG22      VAL  55  -9.169   1.223   1.140
  451   HG23  VAL  55          HG23      VAL  55  -7.657   0.930   0.282
  452    H    GLN  56           H        GLN  56  -9.783   1.669   3.648
  453    HA   GLN  56           HA       GLN  56  -7.585   2.765   5.141
  454    HB2  GLN  56           HB2      GLN  56 -10.274   3.762   4.271
  455    HB3  GLN  56           HB3      GLN  56  -9.371   4.649   5.480
  456    HG2  GLN  56           HG2      GLN  56  -7.500   4.882   3.912
  457    HG3  GLN  56           HG3      GLN  56  -8.408   3.978   2.704
  458   HE21  GLN  56          HE21      GLN  56 -10.192   4.915   1.747
  459   HE22  GLN  56          HE22      GLN  56 -10.448   6.626   1.749
  460    H    MET  57           H        MET  57 -10.354   0.908   5.881
  461    HA   MET  57           HA       MET  57 -10.541   1.865   8.610
  462    HB2  MET  57           HB2      MET  57 -12.469   0.998   7.067
  463    HB3  MET  57           HB3      MET  57 -11.942  -0.585   7.621
  464    HG2  MET  57           HG2      MET  57 -12.293   0.133   9.945
  465    HG3  MET  57           HG3      MET  57 -12.881   1.687   9.357
  466    HE1  MET  57           HE1      MET  57 -14.462   0.419   6.652
  467    HE2  MET  57           HE2      MET  57 -14.935   1.826   7.604
  468    HE3  MET  57           HE3      MET  57 -16.086   0.516   7.336
  469    H    GLY  58           H        GLY  58  -8.534  -0.183   6.990
  470    HA2  GLY  58           HA2      GLY  58  -6.694  -1.254   7.940
  471    HA3  GLY  58           HA3      GLY  58  -7.471  -1.145   9.511
  472    H    LEU  59           H        LEU  59  -9.769  -2.301   7.546
  473    HA   LEU  59           HA       LEU  59  -9.382  -4.998   8.512
  474    HB2  LEU  59           HB2      LEU  59 -11.644  -5.376   7.534
  475    HB3  LEU  59           HB3      LEU  59 -11.570  -4.153   8.782
  476    HG   LEU  59           HG       LEU  59 -11.327  -2.554   6.678
  477   HD11  LEU  59          HD11      LEU  59 -12.888  -4.900   5.629
  478   HD12  LEU  59          HD12      LEU  59 -11.326  -4.333   5.034
  479   HD13  LEU  59          HD13      LEU  59 -12.759  -3.319   4.864
  480   HD21  LEU  59          HD21      LEU  59 -13.711  -2.158   6.821
  481   HD22  LEU  59          HD22      LEU  59 -13.036  -2.448   8.424
  482   HD23  LEU  59          HD23      LEU  59 -13.939  -3.721   7.604
  483    H    ALA  60           H        ALA  60  -8.800  -3.227   5.682
  484    HA   ALA  60           HA       ALA  60  -8.034  -5.743   4.340
  485    HB1  ALA  60           HB1      ALA  60  -8.421  -4.598   2.165
  486    HB2  ALA  60           HB2      ALA  60  -9.154  -3.260   3.047
  487    HB3  ALA  60           HB3      ALA  60  -9.894  -4.857   3.102
  488    H    ASP  61           H        ASP  61  -6.250  -5.381   2.721
  489    HA   ASP  61           HA       ASP  61  -4.178  -3.765   3.912
  490    HB2  ASP  61           HB2      ASP  61  -3.579  -5.955   3.007
  491    HB3  ASP  61           HB3      ASP  61  -4.165  -5.478   1.414
  492    H    SER  62           H        SER  62  -5.426  -4.007   0.584
  493    HA   SER  62           HA       SER  62  -5.232  -1.124   0.307
  494    HB2  SER  62           HB2      SER  62  -3.657  -3.017  -1.448
  495    HB3  SER  62           HB3      SER  62  -3.775  -1.274  -1.646
  496    HG   SER  62           HG       SER  62  -2.468  -2.761   0.369
  497    H    VAL  63           H        VAL  63  -5.884  -0.455  -1.935
  498    HA   VAL  63           HA       VAL  63  -8.400  -1.468  -2.627
  499    HB   VAL  63           HB       VAL  63  -6.467   0.254  -4.188
  500   HG11  VAL  63          HG11      VAL  63  -9.380  -0.256  -4.780
  501   HG12  VAL  63          HG12      VAL  63  -8.021  -0.836  -5.741
  502   HG13  VAL  63          HG13      VAL  63  -8.338   0.894  -5.611
  503   HG21  VAL  63          HG21      VAL  63  -7.241   1.234  -2.114
  504   HG22  VAL  63          HG22      VAL  63  -8.915   0.912  -2.562
  505   HG23  VAL  63          HG23      VAL  63  -7.962   2.071  -3.489
  506    H    LYS  64           H        LYS  64  -5.225  -2.394  -3.548
  507    HA   LYS  64           HA       LYS  64  -5.530  -3.629  -5.994
  508    HB2  LYS  64           HB2      LYS  64  -3.465  -4.589  -5.567
  509    HB3  LYS  64           HB3      LYS  64  -3.493  -3.264  -4.427
  510    HG2  LYS  64           HG2      LYS  64  -4.252  -4.871  -2.678
  511    HG3  LYS  64           HG3      LYS  64  -3.956  -6.164  -3.840
  512    HD2  LYS  64           HD2      LYS  64  -1.598  -5.255  -4.039
  513    HD3  LYS  64           HD3      LYS  64  -1.968  -4.258  -2.630
  514    HE2  LYS  64           HE2      LYS  64  -2.110  -7.270  -2.742
  515    HE3  LYS  64           HE3      LYS  64  -0.806  -6.336  -2.017
  516    HZ1  LYS  64           HZ1      LYS  64  -2.322  -5.478  -0.380
  517    HZ2  LYS  64           HZ2      LYS  64  -2.430  -7.168  -0.393
  518    HZ3  LYS  64           HZ3      LYS  64  -3.644  -6.242  -1.123
  519    H    ASP  65           H        ASP  65  -6.286  -4.810  -2.810
  520    HA   ASP  65           HA       ASP  65  -6.775  -7.510  -3.482
  521    HB2  ASP  65           HB2      ASP  65  -7.729  -5.820  -1.167
  522    HB3  ASP  65           HB3      ASP  65  -8.020  -7.556  -1.285
  523    H    PHE  66           H        PHE  66  -8.689  -4.667  -3.804
  524    HA   PHE  66           HA       PHE  66 -11.125  -6.222  -4.353
  525    HB2  PHE  66           HB2      PHE  66 -10.684  -3.233  -4.145
  526    HB3  PHE  66           HB3      PHE  66 -12.236  -4.003  -4.433
  527    HD1  PHE  66           HD1      PHE  66 -13.642  -4.080  -2.634
  528    HD2  PHE  66           HD2      PHE  66  -9.438  -4.285  -1.976
  529    HE1  PHE  66           HE1      PHE  66 -14.017  -4.157  -0.209
  530    HE2  PHE  66           HE2      PHE  66  -9.813  -4.361   0.448
  531    HZ   PHE  66           HZ       PHE  66 -12.102  -4.289   1.335
  532    H    GLN  67           H        GLN  67  -9.026  -3.755  -5.711
  533    HA   GLN  67           HA       GLN  67  -9.544  -4.624  -8.426
  534    HB2  GLN  67           HB2      GLN  67 -10.213  -1.848  -7.418
  535    HB3  GLN  67           HB3      GLN  67 -10.003  -2.234  -9.125
  536    HG2  GLN  67           HG2      GLN  67 -11.845  -3.905  -8.884
  537    HG3  GLN  67           HG3      GLN  67 -12.107  -3.285  -7.252
  538   HE21  GLN  67          HE21      GLN  67 -14.161  -2.583  -7.720
  539   HE22  GLN  67          HE22      GLN  67 -14.472  -1.208  -8.717
  540    H    ARG  68           H        ARG  68  -7.403  -5.096  -8.736
  541    HA   ARG  68           HA       ARG  68  -5.291  -3.394  -7.917
  542    HB2  ARG  68           HB2      ARG  68  -4.888  -5.758  -8.254
  543    HB3  ARG  68           HB3      ARG  68  -5.341  -5.629  -9.947
  544    HG2  ARG  68           HG2      ARG  68  -3.409  -4.228 -10.384
  545    HG3  ARG  68           HG3      ARG  68  -2.968  -4.277  -8.676
  546    HD2  ARG  68           HD2      ARG  68  -2.550  -6.631  -8.788
  547    HD3  ARG  68           HD3      ARG  68  -3.201  -6.722 -10.422
  548    HE   ARG  68           HE       ARG  68  -1.232  -5.065 -10.873
  549   HH11  ARG  68          HH11      ARG  68  -1.190  -7.868  -8.771
  550   HH12  ARG  68          HH12      ARG  68   0.490  -8.197  -9.041
  551   HH21  ARG  68          HH21      ARG  68   0.967  -5.494 -11.231
  552   HH22  ARG  68          HH22      ARG  68   1.740  -6.838 -10.437
  553    H    LYS  69           H        LYS  69  -6.069  -1.383  -8.690
  554    HA   LYS  69           HA       LYS  69  -5.285  -0.885 -11.488
  555    HB2  LYS  69           HB2      LYS  69  -6.901   0.870  -9.616
  556    HB3  LYS  69           HB3      LYS  69  -6.498   1.251 -11.284
  557    HG2  LYS  69           HG2      LYS  69  -7.819  -0.657 -12.041
  558    HG3  LYS  69           HG3      LYS  69  -8.219  -1.046 -10.368
  559    HD2  LYS  69           HD2      LYS  69 -10.065   0.155 -11.334
  560    HD3  LYS  69           HD3      LYS  69  -9.271   1.202 -10.160
  561    HE2  LYS  69           HE2      LYS  69  -9.834   2.438 -12.173
  562    HE3  LYS  69           HE3      LYS  69  -8.089   2.336 -11.975
  563    HZ1  LYS  69           HZ1      LYS  69  -9.710   0.617 -13.775
  564    HZ2  LYS  69           HZ2      LYS  69  -8.026   0.580 -13.612
  565    HZ3  LYS  69           HZ3      LYS  69  -8.783   1.944 -14.262
  566    H    GLY  70           H        GLY  70  -5.164   0.467  -8.218
  567    HA2  GLY  70           HA2      GLY  70  -2.447   1.460  -8.776
  568    HA3  GLY  70           HA3      GLY  70  -3.497   2.055  -7.493
  569    H    THR  71           H        THR  71  -0.893   0.115  -8.126
  570    HA   THR  71           HA       THR  71  -1.487  -2.044  -6.337
  571    HB   THR  71           HB       THR  71   1.058  -2.465  -6.601
  572    HG1  THR  71           HG1      THR  71   0.750  -0.869  -8.919
  573   HG21  THR  71          HG21      THR  71   0.676  -3.489  -8.821
  574   HG22  THR  71          HG22      THR  71  -0.833  -2.588  -8.966
  575   HG23  THR  71          HG23      THR  71  -0.650  -3.807  -7.705
  576    H    HIS  72           H        HIS  72  -1.175  -2.153  -4.204
  577    HA   HIS  72           HA       HIS  72   0.117  -0.216  -2.672
  578    HB2  HIS  72           HB2      HIS  72  -1.037  -1.757  -1.326
  579    HB3  HIS  72           HB3      HIS  72  -0.398  -3.148  -2.206
  580    HD1  HIS  72           HD1      HIS  72   1.278  -0.295  -0.331
  581    HD2  HIS  72           HD2      HIS  72   1.414  -4.429  -0.637
  582    HE1  HIS  72           HE1      HIS  72   3.358  -1.001   0.859
  583    HE2  HIS  72           HE2      HIS  72   3.134  -3.509   1.051
  584    H    ILE  73           H        ILE  73   2.140   0.417  -2.744
  585    HA   ILE  73           HA       ILE  73   4.166  -1.555  -3.487
  586    HB   ILE  73           HB       ILE  73   3.572   1.056  -4.733
  587   HG12  ILE  73          HG12      ILE  73   3.289  -1.457  -5.473
  588   HG13  ILE  73          HG13      ILE  73   3.617  -0.176  -6.649
  589   HG21  ILE  73          HG21      ILE  73   5.938   1.113  -5.629
  590   HG22  ILE  73          HG22      ILE  73   6.353  -0.015  -4.335
  591   HG23  ILE  73          HG23      ILE  73   5.747   1.591  -3.943
  592   HD11  ILE  73          HD11      ILE  73   4.982  -2.172  -7.041
  593   HD12  ILE  73          HD12      ILE  73   5.664  -2.021  -5.420
  594   HD13  ILE  73          HD13      ILE  73   5.982  -0.777  -6.631
  595    H    VAL  74           H        VAL  74   5.547  -1.801  -1.994
  596    HA   VAL  74           HA       VAL  74   6.084   0.076   0.058
  597    HB   VAL  74           HB       VAL  74   7.881  -1.465   0.705
  598   HG11  VAL  74          HG11      VAL  74   5.629  -2.022   1.384
  599   HG12  VAL  74          HG12      VAL  74   6.532  -3.494   1.022
  600   HG13  VAL  74          HG13      VAL  74   5.356  -2.871  -0.140
  601   HG21  VAL  74          HG21      VAL  74   7.250  -2.902  -1.869
  602   HG22  VAL  74          HG22      VAL  74   8.349  -3.471  -0.609
  603   HG23  VAL  74          HG23      VAL  74   8.730  -2.005  -1.512
  604    H    LEU  75           H        LEU  75   8.004   1.369   0.262
  605    HA   LEU  75           HA       LEU  75   8.487   2.914  -1.973
  606    HB2  LEU  75           HB2      LEU  75  10.383   3.877  -0.669
  607    HB3  LEU  75           HB3      LEU  75   8.852   3.817   0.185
  608    HG   LEU  75           HG       LEU  75  10.292   1.416   0.751
  609   HD11  LEU  75          HD11      LEU  75  12.249   2.344   1.868
  610   HD12  LEU  75          HD12      LEU  75  11.842   3.952   1.270
  611   HD13  LEU  75          HD13      LEU  75  12.294   2.678   0.135
  612   HD21  LEU  75          HD21      LEU  75  10.053   2.193   3.041
  613   HD22  LEU  75          HD22      LEU  75   8.559   2.430   2.135
  614   HD23  LEU  75          HD23      LEU  75   9.617   3.801   2.463
  615    H    TRP  76           H        TRP  76   9.102   1.682  -3.768
  616    HA   TRP  76           HA       TRP  76  11.523   0.108  -3.631
  617    HB2  TRP  76           HB2      TRP  76   9.465   0.554  -5.771
  618    HB3  TRP  76           HB3      TRP  76  11.013  -0.190  -6.155
  619    HD1  TRP  76           HD1      TRP  76   7.639  -1.157  -5.304
  620    HE1  TRP  76           HE1      TRP  76   7.538  -3.560  -4.390
  621    HE3  TRP  76           HE3      TRP  76  12.594  -1.860  -4.315
  622    HZ2  TRP  76           HZ2      TRP  76   9.312  -5.492  -3.385
  623    HZ3  TRP  76           HZ3      TRP  76  13.307  -4.014  -3.378
  624    HH2  TRP  76           HH2      TRP  76  11.701  -5.791  -2.919
  625    H    THR  77           H        THR  77  13.333   1.155  -3.613
  626    HA   THR  77           HA       THR  77  13.791   3.286  -5.587
  627    HB   THR  77           HB       THR  77  15.684   3.963  -4.111
  628    HG1  THR  77           HG1      THR  77  15.396   3.012  -1.860
  629   HG21  THR  77          HG21      THR  77  14.316   4.952  -2.321
  630   HG22  THR  77          HG22      THR  77  12.990   3.873  -2.748
  631   HG23  THR  77          HG23      THR  77  13.532   5.100  -3.893
  632    H    GLY  78           H        GLY  78  16.277   3.331  -6.150
  633    HA2  GLY  78           HA2      GLY  78  17.067   0.903  -7.326
  634    HA3  GLY  78           HA3      GLY  78  18.124   2.275  -7.020
  635    H    ASP  79           H        ASP  79  17.646   2.272  -4.165
  636    HA   ASP  79           HA       ASP  79  19.649   0.421  -3.350
  637    HB2  ASP  79           HB2      ASP  79  17.734   2.009  -1.617
  638    HB3  ASP  79           HB3      ASP  79  19.222   1.236  -1.084
  639    H    GLN  80           H        GLN  80  16.148   0.662  -2.637
  640    HA   GLN  80           HA       GLN  80  16.108  -1.743  -1.143
  641    HB2  GLN  80           HB2      GLN  80  14.391  -0.004  -0.856
  642    HB3  GLN  80           HB3      GLN  80  13.783  -0.339  -2.476
  643    HG2  GLN  80           HG2      GLN  80  13.090  -2.521  -1.855
  644    HG3  GLN  80           HG3      GLN  80  13.927  -2.414  -0.314
  645   HE21  GLN  80          HE21      GLN  80  11.118  -1.531  -2.113
  646   HE22  GLN  80          HE22      GLN  80  10.212  -0.898  -0.789
  647    H    GLU  81           H        GLU  81  15.617  -1.039  -4.539
  648    HA   GLU  81           HA       GLU  81  14.580  -3.513  -5.362
  649    HB2  GLU  81           HB2      GLU  81  14.732  -1.484  -6.790
  650    HB3  GLU  81           HB3      GLU  81  16.475  -1.693  -6.864
  651    HG2  GLU  81           HG2      GLU  81  16.227  -3.764  -8.057
  652    HG3  GLU  81           HG3      GLU  81  14.473  -3.701  -7.870
  653    H    LEU  82           H        LEU  82  17.881  -2.379  -4.874
  654    HA   LEU  82           HA       LEU  82  19.171  -4.780  -5.632
  655    HB2  LEU  82           HB2      LEU  82  20.337  -2.631  -5.507
  656    HB3  LEU  82           HB3      LEU  82  20.087  -2.589  -3.772
  657    HG   LEU  82           HG       LEU  82  21.408  -4.770  -3.690
  658   HD11  LEU  82          HD11      LEU  82  22.191  -3.847  -6.447
  659   HD12  LEU  82          HD12      LEU  82  21.309  -5.322  -6.049
  660   HD13  LEU  82          HD13      LEU  82  22.982  -5.125  -5.525
  661   HD21  LEU  82          HD21      LEU  82  22.257  -2.649  -2.898
  662   HD22  LEU  82          HD22      LEU  82  22.776  -2.229  -4.532
  663   HD23  LEU  82          HD23      LEU  82  23.529  -3.583  -3.685
  664    H    GLU  83           H        GLU  83  18.088  -3.479  -2.505
  665    HA   GLU  83           HA       GLU  83  19.055  -5.406  -0.780
  666    HB2  GLU  83           HB2      GLU  83  16.362  -4.034  -0.686
  667    HB3  GLU  83           HB3      GLU  83  17.044  -4.965   0.636
  668    HG2  GLU  83           HG2      GLU  83  18.942  -3.367   0.703
  669    HG3  GLU  83           HG3      GLU  83  18.106  -2.397  -0.512
  670    H    LEU  84           H        LEU  84  16.021  -5.439  -2.615
  671    HA   LEU  84           HA       LEU  84  15.088  -7.932  -1.736
  672    HB2  LEU  84           HB2      LEU  84  13.610  -6.462  -2.906
  673    HB3  LEU  84           HB3      LEU  84  14.651  -6.442  -4.317
  674    HG   LEU  84           HG       LEU  84  14.154  -8.832  -4.702
  675   HD11  LEU  84          HD11      LEU  84  12.166  -8.510  -2.460
  676   HD12  LEU  84          HD12      LEU  84  13.667  -9.431  -2.371
  677   HD13  LEU  84          HD13      LEU  84  12.388  -9.933  -3.477
  678   HD21  LEU  84          HD21      LEU  84  12.844  -7.115  -5.835
  679   HD22  LEU  84          HD22      LEU  84  11.710  -7.080  -4.483
  680   HD23  LEU  84          HD23      LEU  84  11.860  -8.533  -5.470
  681    H    GLN  85           H        GLN  85  16.956  -7.071  -4.623
  682    HA   GLN  85           HA       GLN  85  17.080  -9.604  -5.757
  683    HB2  GLN  85           HB2      GLN  85  17.697  -7.527  -6.931
  684    HB3  GLN  85           HB3      GLN  85  19.147  -7.408  -5.937
  685    HG2  GLN  85           HG2      GLN  85  19.931  -9.536  -6.846
  686    HG3  GLN  85           HG3      GLN  85  18.500  -9.626  -7.859
  687   HE21  GLN  85          HE21      GLN  85  21.570  -8.153  -7.372
  688   HE22  GLN  85          HE22      GLN  85  21.648  -7.320  -8.885
  689    H    ARG  86           H        ARG  86  19.449  -8.013  -3.622
  690    HA   ARG  86           HA       ARG  86  21.374 -10.019  -3.655
  691    HB2  ARG  86           HB2      ARG  86  20.681  -8.189  -1.354
  692    HB3  ARG  86           HB3      ARG  86  22.185  -9.085  -1.535
  693    HG2  ARG  86           HG2      ARG  86  22.561  -7.838  -3.674
  694    HG3  ARG  86           HG3      ARG  86  21.169  -6.840  -3.254
  695    HD2  ARG  86           HD2      ARG  86  23.212  -5.728  -2.575
  696    HD3  ARG  86           HD3      ARG  86  22.276  -6.194  -1.155
  697    HE   ARG  86           HE       ARG  86  24.235  -8.150  -1.896
  698   HH11  ARG  86          HH11      ARG  86  23.733  -5.148  -0.158
  699   HH12  ARG  86          HH12      ARG  86  25.084  -5.391   0.902
  700   HH21  ARG  86          HH21      ARG  86  26.024  -8.461  -0.503
  701   HH22  ARG  86          HH22      ARG  86  26.396  -7.260   0.692
  702    H    LEU  87           H        LEU  87  18.765  -9.582  -1.248
  703    HA   LEU  87           HA       LEU  87  19.338 -11.950   0.174
  704    HB2  LEU  87           HB2      LEU  87  16.963 -10.152  -0.011
  705    HB3  LEU  87           HB3      LEU  87  16.792 -11.705   0.784
  706    HG   LEU  87           HG       LEU  87  18.718 -11.029   2.278
  707   HD11  LEU  87          HD11      LEU  87  19.130  -8.618   2.502
  708   HD12  LEU  87          HD12      LEU  87  18.169  -8.335   1.050
  709   HD13  LEU  87          HD13      LEU  87  19.669  -9.256   0.947
  710   HD21  LEU  87          HD21      LEU  87  17.298  -9.647   3.701
  711   HD22  LEU  87          HD22      LEU  87  16.423 -11.018   3.018
  712   HD23  LEU  87          HD23      LEU  87  16.192  -9.402   2.349
  713    H    PHE  88           H        PHE  88  17.178 -11.262  -2.517
  714    HA   PHE  88           HA       PHE  88  15.886 -13.694  -2.765
  715    HB2  PHE  88           HB2      PHE  88  15.084 -12.028  -4.164
  716    HB3  PHE  88           HB3      PHE  88  16.693 -11.542  -4.679
  717    HD1  PHE  88           HD1      PHE  88  14.130 -14.199  -5.057
  718    HD2  PHE  88           HD2      PHE  88  17.624 -12.352  -6.639
  719    HE1  PHE  88           HE1      PHE  88  13.875 -15.494  -7.138
  720    HE2  PHE  88           HE2      PHE  88  17.378 -13.643  -8.712
  721    HZ   PHE  88           HZ       PHE  88  15.504 -15.210  -8.963
  722    H    GLU  89           H        GLU  89  19.005 -12.693  -4.166
  723    HA   GLU  89           HA       GLU  89  19.569 -15.160  -5.439
  724    HB2  GLU  89           HB2      GLU  89  21.483 -13.073  -4.379
  725    HB3  GLU  89           HB3      GLU  89  21.885 -14.347  -5.514
  726    HG2  GLU  89           HG2      GLU  89  20.401 -13.366  -7.172
  727    HG3  GLU  89           HG3      GLU  89  19.919 -12.134  -6.005
  728    H    GLU  90           H        GLU  90  20.195 -13.907  -2.209
  729    HA   GLU  90           HA       GLU  90  22.215 -15.812  -1.588
  730    HB2  GLU  90           HB2      GLU  90  20.694 -13.731  -0.093
  731    HB3  GLU  90           HB3      GLU  90  21.691 -14.885   0.793
  732    HG2  GLU  90           HG2      GLU  90  22.550 -12.878  -1.267
  733    HG3  GLU  90           HG3      GLU  90  23.007 -12.957   0.435
  734    H    PHE  91           H        PHE  91  18.745 -15.666  -1.011
  735    HA   PHE  91           HA       PHE  91  18.946 -18.231   0.431
  736    HB2  PHE  91           HB2      PHE  91  16.739 -16.167   0.523
  737    HB3  PHE  91           HB3      PHE  91  16.774 -17.668   1.440
  738    HD1  PHE  91           HD1      PHE  91  18.723 -17.991   3.076
  739    HD2  PHE  91           HD2      PHE  91  17.651 -14.228   1.407
  740    HE1  PHE  91           HE1      PHE  91  19.908 -16.848   4.904
  741    HE2  PHE  91           HE2      PHE  91  18.836 -13.077   3.230
  742    HZ   PHE  91           HZ       PHE  91  19.966 -14.390   4.979
  743    H    ARG  92           H        ARG  92  18.751 -17.586  -2.524
  744    HA   ARG  92           HA       ARG  92  16.144 -18.218  -3.438
  745    HB2  ARG  92           HB2      ARG  92  18.025 -16.997  -4.650
  746    HB3  ARG  92           HB3      ARG  92  18.689 -18.587  -4.992
  747    HG2  ARG  92           HG2      ARG  92  16.531 -19.168  -6.087
  748    HG3  ARG  92           HG3      ARG  92  16.048 -17.480  -5.883
  749    HD2  ARG  92           HD2      ARG  92  16.994 -17.877  -8.090
  750    HD3  ARG  92           HD3      ARG  92  17.974 -16.751  -7.167
  751    HE   ARG  92           HE       ARG  92  18.802 -19.511  -7.003
  752   HH11  ARG  92          HH11      ARG  92  19.122 -16.539  -8.826
  753   HH12  ARG  92          HH12      ARG  92  20.743 -16.885  -9.336
  754   HH21  ARG  92          HH21      ARG  92  20.938 -19.957  -7.662
  755   HH22  ARG  92          HH22      ARG  92  21.769 -18.836  -8.693
  756    H    ASP  93           H        ASP  93  18.974 -20.111  -2.751
  757    HA   ASP  93           HA       ASP  93  18.088 -22.496  -4.064
  758    HB2  ASP  93           HB2      ASP  93  20.064 -23.532  -3.069
  759    HB3  ASP  93           HB3      ASP  93  20.476 -21.978  -3.787
  760    H    SER  94           H        SER  94  16.509 -21.235  -1.716
  761    HA   SER  94           HA       SER  94  16.331 -23.677  -0.097
  762    HB2  SER  94           HB2      SER  94  15.091 -22.328   1.541
  763    HB3  SER  94           HB3      SER  94  16.655 -21.600   1.190
  764    HG   SER  94           HG       SER  94  15.586 -20.142  -0.208
  765    H    ASP  95           H        ASP  95  13.876 -23.917   0.706
  766    HA   ASP  95           HA       ASP  95  12.436 -24.584  -1.676
  767    HB2  ASP  95           HB2      ASP  95  11.608 -24.707   1.233
  768    HB3  ASP  95           HB3      ASP  95  10.665 -25.360  -0.101
  769    H    ASP  96           H        ASP  96  12.434 -21.981   0.576
  770    HA   ASP  96           HA       ASP  96  10.476 -20.564  -1.055
  771    HB2  ASP  96           HB2      ASP  96   9.172 -21.528   0.786
  772    HB3  ASP  96           HB3      ASP  96  10.284 -20.828   1.955
  773    H    VAL  97           H        VAL  97  11.853 -19.038  -1.788
  774    HA   VAL  97           HA       VAL  97  13.954 -17.987  -0.157
  775    HB   VAL  97           HB       VAL  97  14.289 -18.229  -2.554
  776   HG11  VAL  97          HG11      VAL  97  12.044 -17.791  -3.356
  777   HG12  VAL  97          HG12      VAL  97  13.212 -16.745  -4.165
  778   HG13  VAL  97          HG13      VAL  97  12.188 -16.098  -2.881
  779   HG21  VAL  97          HG21      VAL  97  14.336 -15.330  -1.726
  780   HG22  VAL  97          HG22      VAL  97  15.265 -16.052  -3.046
  781   HG23  VAL  97          HG23      VAL  97  15.583 -16.528  -1.376
  782    H    LEU  98           H        LEU  98  10.722 -16.935  -0.998
  783    HA   LEU  98           HA       LEU  98  11.115 -14.184  -0.509
  784    HB2  LEU  98           HB2      LEU  98   8.610 -15.839  -0.556
  785    HB3  LEU  98           HB3      LEU  98   8.610 -14.100  -0.342
  786    HG   LEU  98           HG       LEU  98   9.986 -14.141  -2.589
  787   HD11  LEU  98          HD11      LEU  98   9.212 -15.909  -4.089
  788   HD12  LEU  98          HD12      LEU  98   8.403 -16.699  -2.736
  789   HD13  LEU  98          HD13      LEU  98  10.161 -16.559  -2.752
  790   HD21  LEU  98          HD21      LEU  98   7.017 -14.611  -2.500
  791   HD22  LEU  98          HD22      LEU  98   7.920 -13.806  -3.783
  792   HD23  LEU  98          HD23      LEU  98   7.814 -13.071  -2.183
  793    H    GLY  99           H        GLY  99  10.025 -16.818   1.597
  794    HA2  GLY  99           HA2      GLY  99   9.197 -15.236   3.767
  795    HA3  GLY  99           HA3      GLY  99   9.784 -16.895   3.880
  796    H    HIS 100           H        HIS 100  12.372 -16.316   2.772
  797    HA   HIS 100           HA       HIS 100  13.685 -15.453   5.169
  798    HB2  HIS 100           HB2      HIS 100  14.813 -16.114   2.439
  799    HB3  HIS 100           HB3      HIS 100  15.768 -15.857   3.895
  800    HD1  HIS 100           HD1      HIS 100  15.029 -18.547   1.967
  801    HD2  HIS 100           HD2      HIS 100  14.240 -17.795   5.975
  802    HE1  HIS 100           HE1      HIS 100  14.769 -20.799   3.037
  803    HE2  HIS 100           HE2      HIS 100  14.485 -20.324   5.489
  804    H    ILE 101           H        ILE 101  12.735 -14.030   2.172
  805    HA   ILE 101           HA       ILE 101  14.455 -11.772   2.223
  806    HB   ILE 101           HB       ILE 101  11.773 -12.157   0.870
  807   HG12  ILE 101          HG12      ILE 101  14.606 -12.337  -0.202
  808   HG13  ILE 101          HG13      ILE 101  13.535 -13.700   0.099
  809   HG21  ILE 101          HG21      ILE 101  12.403 -10.223  -0.518
  810   HG22  ILE 101          HG22      ILE 101  13.845  -9.988   0.469
  811   HG23  ILE 101          HG23      ILE 101  12.245  -9.786   1.183
  812   HD11  ILE 101          HD11      ILE 101  13.561 -13.222  -2.245
  813   HD12  ILE 101          HD12      ILE 101  13.165 -11.530  -1.948
  814   HD13  ILE 101          HD13      ILE 101  11.980 -12.785  -1.597
  815    H    MET 102           H        MET 102  10.952 -12.000   2.855
  816    HA   MET 102           HA       MET 102  10.754  -9.356   3.804
  817    HB2  MET 102           HB2      MET 102   8.497 -10.244   4.759
  818    HB3  MET 102           HB3      MET 102   8.733 -10.144   3.019
  819    HG2  MET 102           HG2      MET 102   9.018 -12.456   2.815
  820    HG3  MET 102           HG3      MET 102   9.261 -12.660   4.532
  821    HE1  MET 102           HE1      MET 102   5.198 -11.758   2.578
  822    HE2  MET 102           HE2      MET 102   6.687 -12.041   1.678
  823    HE3  MET 102           HE3      MET 102   6.509 -10.581   2.654
  824    H    LYS 103           H        LYS 103  11.716 -12.248   5.423
  825    HA   LYS 103           HA       LYS 103  11.129 -11.179   8.050
  826    HB2  LYS 103           HB2      LYS 103  12.101 -13.762   6.993
  827    HB3  LYS 103           HB3      LYS 103  12.666 -13.320   8.597
  828    HG2  LYS 103           HG2      LYS 103  10.673 -14.684   8.739
  829    HG3  LYS 103           HG3      LYS 103  10.358 -13.059   9.347
  830    HD2  LYS 103           HD2      LYS 103   9.325 -12.476   7.191
  831    HD3  LYS 103           HD3      LYS 103   9.603 -14.125   6.625
  832    HE2  LYS 103           HE2      LYS 103   7.314 -13.881   7.383
  833    HE3  LYS 103           HE3      LYS 103   8.193 -14.964   8.460
  834    HZ1  LYS 103           HZ1      LYS 103   6.826 -13.402   9.692
  835    HZ2  LYS 103           HZ2      LYS 103   7.629 -12.097   8.976
  836    HZ3  LYS 103           HZ3      LYS 103   8.465 -13.135  10.014
  837    H    ASN 104           H        ASN 104  13.927 -11.448   5.937
  838    HA   ASN 104           HA       ASN 104  15.694 -10.684   8.135
  839    HB2  ASN 104           HB2      ASN 104  16.364 -12.497   6.550
  840    HB3  ASN 104           HB3      ASN 104  16.450 -11.291   5.270
  841   HD21  ASN 104          HD21      ASN 104  18.179  -9.854   5.229
  842   HD22  ASN 104          HD22      ASN 104  19.558 -10.028   6.252
  843    H    ILE 105           H        ILE 105  14.043  -9.207   5.506
  844    HA   ILE 105           HA       ILE 105  15.895  -6.962   5.453
  845    HB   ILE 105           HB       ILE 105  14.903  -7.798   3.345
  846   HG12  ILE 105          HG12      ILE 105  14.342  -5.553   2.426
  847   HG13  ILE 105          HG13      ILE 105  14.321  -4.933   4.073
  848   HG21  ILE 105          HG21      ILE 105  12.602  -7.181   2.757
  849   HG22  ILE 105          HG22      ILE 105  12.349  -6.601   4.403
  850   HG23  ILE 105          HG23      ILE 105  12.650  -8.313   4.109
  851   HD11  ILE 105          HD11      ILE 105  16.414  -4.444   2.900
  852   HD12  ILE 105          HD12      ILE 105  16.705  -6.175   2.718
  853   HD13  ILE 105          HD13      ILE 105  16.669  -5.450   4.325
  854    H    THR 106           H        THR 106  15.245  -4.824   5.822
  855    HA   THR 106           HA       THR 106  13.831  -4.593   8.267
  856    HB   THR 106           HB       THR 106  15.867  -3.309   7.580
  857    HG1  THR 106           HG1      THR 106  15.291  -1.719   8.939
  858   HG21  THR 106          HG21      THR 106  15.550  -1.241   6.294
  859   HG22  THR 106          HG22      THR 106  13.882  -1.707   5.970
  860   HG23  THR 106          HG23      THR 106  15.208  -2.678   5.329
  861    H    ALA 107           H        ALA 107  13.039  -3.934   4.916
  862    HA   ALA 107           HA       ALA 107  10.597  -2.533   5.615
  863    HB1  ALA 107           HB1      ALA 107  11.827  -1.791   3.650
  864    HB2  ALA 107           HB2      ALA 107  10.244  -2.412   3.178
  865    HB3  ALA 107           HB3      ALA 107  11.684  -3.398   2.935
  866    H    LYS 108           H        LYS 108   8.678  -3.523   5.906
  867    HA   LYS 108           HA       LYS 108   8.544  -6.384   5.499
  868    HB2  LYS 108           HB2      LYS 108   6.353  -4.516   6.418
  869    HB3  LYS 108           HB3      LYS 108   6.365  -6.265   6.555
  870    HG2  LYS 108           HG2      LYS 108   8.338  -4.467   7.946
  871    HG3  LYS 108           HG3      LYS 108   6.835  -5.027   8.671
  872    HD2  LYS 108           HD2      LYS 108   8.298  -6.595   9.490
  873    HD3  LYS 108           HD3      LYS 108   7.778  -7.397   8.010
  874    HE2  LYS 108           HE2      LYS 108   9.786  -6.850   6.894
  875    HE3  LYS 108           HE3      LYS 108  10.237  -5.667   8.118
  876    HZ1  LYS 108           HZ1      LYS 108  10.542  -7.473   9.691
  877    HZ2  LYS 108           HZ2      LYS 108  11.513  -7.699   8.327
  878    HZ3  LYS 108           HZ3      LYS 108  10.100  -8.609   8.512
  879    H    ARG 109           H        ARG 109   8.451  -6.934   3.454
  880    HA   ARG 109           HA       ARG 109   6.465  -5.610   1.736
  881    HB2  ARG 109           HB2      ARG 109   8.732  -7.319   0.745
  882    HB3  ARG 109           HB3      ARG 109   7.784  -6.128  -0.137
  883    HG2  ARG 109           HG2      ARG 109   8.842  -4.330   1.072
  884    HG3  ARG 109           HG3      ARG 109   9.726  -5.486   2.074
  885    HD2  ARG 109           HD2      ARG 109  10.694  -6.387  -0.100
  886    HD3  ARG 109           HD3      ARG 109  10.044  -4.937  -0.865
  887    HE   ARG 109           HE       ARG 109  11.433  -3.717   0.906
  888   HH11  ARG 109          HH11      ARG 109  12.363  -6.778  -0.520
  889   HH12  ARG 109          HH12      ARG 109  14.060  -6.507  -0.310
  890   HH21  ARG 109          HH21      ARG 109  13.679  -3.356   1.183
  891   HH22  ARG 109          HH22      ARG 109  14.809  -4.552   0.646
  892    H    SER 110           H        SER 110   4.887  -6.815   0.895
  893    HA   SER 110           HA       SER 110   4.569  -9.460   2.055
  894    HB2  SER 110           HB2      SER 110   2.711  -7.818   2.129
  895    HB3  SER 110           HB3      SER 110   2.641  -7.823   0.368
  896    HG   SER 110           HG       SER 110   2.098  -9.986   2.127
  897    H    ARG 111           H        ARG 111   3.469 -11.149   0.619
  898    HA   ARG 111           HA       ARG 111   5.441 -12.063  -1.124
  899    HB2  ARG 111           HB2      ARG 111   2.597 -12.941  -0.676
  900    HB3  ARG 111           HB3      ARG 111   3.686 -13.790  -1.767
  901    HG2  ARG 111           HG2      ARG 111   4.260 -13.305   1.147
  902    HG3  ARG 111           HG3      ARG 111   3.533 -14.781   0.507
  903    HD2  ARG 111           HD2      ARG 111   5.494 -15.199  -0.843
  904    HD3  ARG 111           HD3      ARG 111   6.208 -13.675  -0.332
  905    HE   ARG 111           HE       ARG 111   6.279 -14.647   1.943
  906   HH11  ARG 111          HH11      ARG 111   6.132 -16.780  -0.848
  907   HH12  ARG 111          HH12      ARG 111   6.922 -18.099  -0.029
  908   HH21  ARG 111          HH21      ARG 111   7.274 -16.405   3.006
  909   HH22  ARG 111          HH22      ARG 111   7.588 -17.870   2.132
  910    H    ALA 112           H        ALA 112   2.172 -10.879  -1.956
  911    HA   ALA 112           HA       ALA 112   2.410 -11.208  -4.723
  912    HB1  ALA 112           HB1      ALA 112   0.276 -10.820  -3.627
  913    HB2  ALA 112           HB2      ALA 112   0.544  -9.625  -4.897
  914    HB3  ALA 112           HB3      ALA 112   0.771  -9.181  -3.205
  915    H    ARG 113           H        ARG 113   3.684  -8.787  -2.627
  916    HA   ARG 113           HA       ARG 113   4.155  -6.881  -4.757
  917    HB2  ARG 113           HB2      ARG 113   3.490  -5.994  -2.636
  918    HB3  ARG 113           HB3      ARG 113   4.744  -6.886  -1.799
  919    HG2  ARG 113           HG2      ARG 113   5.086  -4.403  -2.078
  920    HG3  ARG 113           HG3      ARG 113   6.425  -5.447  -2.542
  921    HD2  ARG 113           HD2      ARG 113   5.887  -3.511  -4.076
  922    HD3  ARG 113           HD3      ARG 113   6.053  -5.096  -4.829
  923    HE   ARG 113           HE       ARG 113   3.385  -4.025  -4.195
  924   HH11  ARG 113          HH11      ARG 113   5.743  -5.171  -6.527
  925   HH12  ARG 113          HH12      ARG 113   4.644  -5.122  -7.866
  926   HH21  ARG 113          HH21      ARG 113   1.936  -3.953  -5.976
  927   HH22  ARG 113          HH22      ARG 113   2.486  -4.412  -7.556
  928    H    ILE 114           H        ILE 114   5.999  -9.164  -2.798
  929    HA   ILE 114           HA       ILE 114   8.538  -8.417  -3.850
  930    HB   ILE 114           HB       ILE 114   7.641 -10.950  -2.474
  931   HG12  ILE 114          HG12      ILE 114   9.257  -8.592  -1.470
  932   HG13  ILE 114          HG13      ILE 114   7.552  -8.860  -1.130
  933   HG21  ILE 114          HG21      ILE 114  10.419 -10.045  -3.217
  934   HG22  ILE 114          HG22      ILE 114   9.569 -11.464  -3.828
  935   HG23  ILE 114          HG23      ILE 114  10.054 -11.387  -2.134
  936   HD11  ILE 114          HD11      ILE 114   9.816 -10.671  -0.289
  937   HD12  ILE 114          HD12      ILE 114   8.107 -10.926   0.065
  938   HD13  ILE 114          HD13      ILE 114   8.953  -9.539   0.751
  939    H    VAL 115           H        VAL 115   6.261 -11.067  -4.649
  940    HA   VAL 115           HA       VAL 115   7.897 -12.268  -6.602
  941    HB   VAL 115           HB       VAL 115   5.876 -13.349  -7.489
  942   HG11  VAL 115          HG11      VAL 115   6.958 -14.304  -5.537
  943   HG12  VAL 115          HG12      VAL 115   5.214 -14.550  -5.473
  944   HG13  VAL 115          HG13      VAL 115   5.965 -13.302  -4.480
  945   HG21  VAL 115          HG21      VAL 115   4.286 -11.533  -7.317
  946   HG22  VAL 115          HG22      VAL 115   4.378 -11.587  -5.555
  947   HG23  VAL 115          HG23      VAL 115   3.688 -12.945  -6.446
  948    H    ASP 116           H        ASP 116   5.499  -9.708  -6.815
  949    HA   ASP 116           HA       ASP 116   5.389  -9.529  -9.620
  950    HB2  ASP 116           HB2      ASP 116   3.721  -8.548  -8.074
  951    HB3  ASP 116           HB3      ASP 116   4.921  -7.373  -7.558
  952    H    LYS 117           H        LYS 117   7.518  -8.110  -7.218
  953    HA   LYS 117           HA       LYS 117   8.692  -6.219  -8.989
  954    HB2  LYS 117           HB2      LYS 117   8.682  -5.878  -6.561
  955    HB3  LYS 117           HB3      LYS 117   9.712  -7.287  -6.354
  956    HG2  LYS 117           HG2      LYS 117  10.985  -5.227  -6.180
  957    HG3  LYS 117           HG3      LYS 117  11.503  -6.176  -7.572
  958    HD2  LYS 117           HD2      LYS 117  10.115  -4.738  -9.026
  959    HD3  LYS 117           HD3      LYS 117   9.682  -3.766  -7.618
  960    HE2  LYS 117           HE2      LYS 117  12.018  -3.183  -7.281
  961    HE3  LYS 117           HE3      LYS 117  12.485  -4.203  -8.640
  962    HZ1  LYS 117           HZ1      LYS 117  11.111  -2.752 -10.074
  963    HZ2  LYS 117           HZ2      LYS 117  12.424  -1.955  -9.364
  964    HZ3  LYS 117           HZ3      LYS 117  10.862  -1.720  -8.754
  965    H    LEU 118           H        LEU 118   9.606  -9.496  -7.924
  966    HA   LEU 118           HA       LEU 118  12.098  -9.659  -9.178
  967    HB2  LEU 118           HB2      LEU 118  10.028 -11.841  -9.067
  968    HB3  LEU 118           HB3      LEU 118  11.731 -12.057  -9.392
  969    HG   LEU 118           HG       LEU 118  10.389 -11.418  -6.785
  970   HD11  LEU 118          HD11      LEU 118  10.630 -13.743  -7.483
  971   HD12  LEU 118          HD12      LEU 118  11.656 -13.392  -6.090
  972   HD13  LEU 118          HD13      LEU 118  12.363 -13.505  -7.708
  973   HD21  LEU 118          HD21      LEU 118  12.325  -9.876  -7.098
  974   HD22  LEU 118          HD22      LEU 118  13.356 -11.292  -7.309
  975   HD23  LEU 118          HD23      LEU 118  12.529 -11.023  -5.775
  976    H    LEU 119           H        LEU 119   8.879 -10.328 -10.434
  977    HA   LEU 119           HA       LEU 119   9.646 -11.142 -13.010
  978    HB2  LEU 119           HB2      LEU 119   7.118 -10.175 -11.745
  979    HB3  LEU 119           HB3      LEU 119   7.192 -10.289 -13.493
  980    HG   LEU 119           HG       LEU 119   6.173 -12.289 -12.471
  981   HD11  LEU 119          HD11      LEU 119   7.467 -13.936 -13.698
  982   HD12  LEU 119          HD12      LEU 119   8.829 -12.821 -13.788
  983   HD13  LEU 119          HD13      LEU 119   7.321 -12.441 -14.621
  984   HD21  LEU 119          HD21      LEU 119   7.639 -13.899 -11.275
  985   HD22  LEU 119          HD22      LEU 119   7.349 -12.414 -10.370
  986   HD23  LEU 119          HD23      LEU 119   8.887 -12.655 -11.199
  987    H    ALA 120           H        ALA 120   9.102  -8.019 -11.599
  988    HA   ALA 120           HA       ALA 120   9.026  -6.651 -14.143
  989    HB1  ALA 120           HB1      ALA 120   9.145  -5.501 -11.361
  990    HB2  ALA 120           HB2      ALA 120   7.662  -5.941 -12.207
  991    HB3  ALA 120           HB3      ALA 120   8.690  -4.654 -12.841
  992    H    LEU 121           H        LEU 121  11.367  -7.513 -11.756
  993    HA   LEU 121           HA       LEU 121  13.329  -5.608 -12.730
  994    HB2  LEU 121           HB2      LEU 121  13.175  -5.885 -10.363
  995    HB3  LEU 121           HB3      LEU 121  13.283  -7.627 -10.497
  996    HG   LEU 121           HG       LEU 121  15.597  -7.429 -11.224
  997   HD11  LEU 121          HD11      LEU 121  15.495  -5.236 -12.294
  998   HD12  LEU 121          HD12      LEU 121  16.768  -5.281 -11.075
  999   HD13  LEU 121          HD13      LEU 121  15.239  -4.474 -10.725
 1000   HD21  LEU 121          HD21      LEU 121  15.026  -5.929  -8.678
 1001   HD22  LEU 121          HD22      LEU 121  16.520  -6.778  -9.076
 1002   HD23  LEU 121          HD23      LEU 121  15.020  -7.681  -8.853
 1003    H    GLY 122           H        GLY 122  12.279  -8.755 -13.372
 1004    HA2  GLY 122           HA2      GLY 122  13.018 -10.216 -15.000
 1005    HA3  GLY 122           HA3      GLY 122  14.380  -9.142 -15.296
 1006    H    LEU 123           H        LEU 123  13.538 -10.502 -12.175
 1007    HA   LEU 123           HA       LEU 123  16.137 -11.759 -12.013
 1008    HB2  LEU 123           HB2      LEU 123  13.866 -11.462 -10.066
 1009    HB3  LEU 123           HB3      LEU 123  15.313 -12.390  -9.699
 1010    HG   LEU 123           HG       LEU 123  15.156  -9.429 -10.262
 1011   HD11  LEU 123          HD11      LEU 123  15.788 -11.024  -7.794
 1012   HD12  LEU 123          HD12      LEU 123  14.447  -9.904  -8.050
 1013   HD13  LEU 123          HD13      LEU 123  16.099  -9.298  -7.957
 1014   HD21  LEU 123          HD21      LEU 123  17.183 -10.314 -11.259
 1015   HD22  LEU 123          HD22      LEU 123  17.579 -11.151  -9.758
 1016   HD23  LEU 123          HD23      LEU 123  17.569  -9.388  -9.809
 1017    H    VAL 124           H        VAL 124  12.919 -12.576 -12.722
 1018    HA   VAL 124           HA       VAL 124  13.640 -15.365 -13.168
 1019    HB   VAL 124           HB       VAL 124  11.487 -16.114 -12.115
 1020   HG11  VAL 124          HG11      VAL 124  13.545 -14.892 -10.283
 1021   HG12  VAL 124          HG12      VAL 124  13.618 -16.496 -11.013
 1022   HG13  VAL 124          HG13      VAL 124  12.370 -16.123  -9.825
 1023   HG21  VAL 124          HG21      VAL 124  10.271 -14.078 -11.985
 1024   HG22  VAL 124          HG22      VAL 124  11.551 -13.300 -11.056
 1025   HG23  VAL 124          HG23      VAL 124  10.591 -14.585 -10.326
 1026    H    ALA 125           H        ALA 125  11.410 -16.432 -13.985
 1027    HA   ALA 125           HA       ALA 125  10.374 -14.616 -16.063
 1028    HB1  ALA 125           HB1      ALA 125  10.796 -17.602 -16.211
 1029    HB2  ALA 125           HB2      ALA 125  11.772 -16.369 -17.011
 1030    HB3  ALA 125           HB3      ALA 125  10.088 -16.603 -17.481
 1031    H    GLU 126           H        GLU 126   9.615 -16.190 -13.282
 1032    HA   GLU 126           HA       GLU 126   6.823 -15.890 -13.445
 1033    HB2  GLU 126           HB2      GLU 126   6.215 -18.301 -13.424
 1034    HB3  GLU 126           HB3      GLU 126   6.912 -17.783 -14.955
 1035    HG2  GLU 126           HG2      GLU 126   9.128 -18.627 -14.045
 1036    HG3  GLU 126           HG3      GLU 126   8.184 -19.417 -12.787
 1037    H    ARG 127           H        ARG 127   5.755 -17.102 -11.538
 1038    HA   ARG 127           HA       ARG 127   7.399 -16.654  -9.223
 1039    HB2  ARG 127           HB2      ARG 127   4.545 -17.575  -9.502
 1040    HB3  ARG 127           HB3      ARG 127   5.348 -17.412  -7.949
 1041    HG2  ARG 127           HG2      ARG 127   4.205 -15.416  -8.154
 1042    HG3  ARG 127           HG3      ARG 127   5.826 -14.994  -8.703
 1043    HD2  ARG 127           HD2      ARG 127   5.138 -15.200 -11.006
 1044    HD3  ARG 127           HD3      ARG 127   3.538 -15.741 -10.502
 1045    HE   ARG 127           HE       ARG 127   3.682 -13.351  -9.325
 1046   HH11  ARG 127          HH11      ARG 127   4.378 -14.351 -12.607
 1047   HH12  ARG 127          HH12      ARG 127   4.005 -12.801 -13.294
 1048   HH21  ARG 127          HH21      ARG 127   3.166 -11.316 -10.233
 1049   HH22  ARG 127          HH22      ARG 127   3.334 -11.078 -11.945
 1050    H    ARG 128           H        ARG 128   6.646 -19.345 -11.169
 1051    HA   ARG 128           HA       ARG 128   6.717 -21.458  -9.329
 1052    HB2  ARG 128           HB2      ARG 128   6.051 -21.721 -11.684
 1053    HB3  ARG 128           HB3      ARG 128   7.707 -21.408 -12.184
 1054    HG2  ARG 128           HG2      ARG 128   8.230 -23.440 -10.610
 1055    HG3  ARG 128           HG3      ARG 128   6.536 -23.828 -10.919
 1056    HD2  ARG 128           HD2      ARG 128   8.787 -23.572 -12.897
 1057    HD3  ARG 128           HD3      ARG 128   7.788 -24.982 -12.561
 1058    HE   ARG 128           HE       ARG 128   6.692 -22.538 -13.806
 1059   HH11  ARG 128          HH11      ARG 128   7.207 -26.011 -13.816
 1060   HH12  ARG 128          HH12      ARG 128   6.118 -26.284 -15.139
 1061   HH21  ARG 128          HH21      ARG 128   5.281 -22.913 -15.548
 1062   HH22  ARG 128          HH22      ARG 128   5.023 -24.529 -16.124
 1063    H    GLU 129           H        GLU 129   9.245 -19.607 -10.839
 1064    HA   GLU 129           HA       GLU 129  11.321 -21.493 -10.270
 1065    HB2  GLU 129           HB2      GLU 129  11.383 -18.667 -11.316
 1066    HB3  GLU 129           HB3      GLU 129  12.782 -19.721 -11.211
 1067    HG2  GLU 129           HG2      GLU 129  10.323 -20.119 -12.885
 1068    HG3  GLU 129           HG3      GLU 129  11.958 -19.773 -13.450
 1069    H    LEU 130           H        LEU 130   9.744 -19.280  -8.361
 1070    HA   LEU 130           HA       LEU 130  12.062 -18.268  -6.956
 1071    HB2  LEU 130           HB2      LEU 130   9.367 -18.028  -5.754
 1072    HB3  LEU 130           HB3      LEU 130  10.645 -16.845  -5.854
 1073    HG   LEU 130           HG       LEU 130   8.651 -17.576  -7.980
 1074   HD11  LEU 130          HD11      LEU 130   8.053 -15.207  -7.817
 1075   HD12  LEU 130          HD12      LEU 130   9.212 -15.023  -6.500
 1076   HD13  LEU 130          HD13      LEU 130   7.811 -16.078  -6.302
 1077   HD21  LEU 130          HD21      LEU 130  10.988 -15.697  -8.249
 1078   HD22  LEU 130          HD22      LEU 130   9.695 -15.947  -9.431
 1079   HD23  LEU 130          HD23      LEU 130  10.811 -17.261  -9.054
 1080    H    TYR 131           H        TYR 131  10.330 -21.063  -6.967
 1081    HA   TYR 131           HA       TYR 131  10.951 -21.677  -4.164
 1082    HB2  TYR 131           HB2      TYR 131   8.582 -22.692  -5.757
 1083    HB3  TYR 131           HB3      TYR 131   8.918 -23.019  -4.060
 1084    HD1  TYR 131           HD1      TYR 131   8.477 -21.339  -2.360
 1085    HD2  TYR 131           HD2      TYR 131   7.724 -20.506  -6.465
 1086    HE1  TYR 131           HE1      TYR 131   7.164 -19.364  -1.718
 1087    HE2  TYR 131           HE2      TYR 131   6.400 -18.533  -5.836
 1088    HH   TYR 131           HH       TYR 131   5.124 -17.738  -3.843
 1089    H    LYS 132           H        LYS 132  12.133 -23.477  -3.877
 1090    HA   LYS 132           HA       LYS 132  13.658 -24.600  -5.837
 1091    HB2  LYS 132           HB2      LYS 132  14.088 -24.875  -3.439
 1092    HB3  LYS 132           HB3      LYS 132  12.722 -25.974  -3.314
 1093    HG2  LYS 132           HG2      LYS 132  13.824 -27.577  -4.741
 1094    HG3  LYS 132           HG3      LYS 132  15.164 -26.464  -5.008
 1095    HD2  LYS 132           HD2      LYS 132  14.375 -27.627  -2.338
 1096    HD3  LYS 132           HD3      LYS 132  15.701 -28.204  -3.346
 1097    HE2  LYS 132           HE2      LYS 132  16.683 -25.909  -3.215
 1098    HE3  LYS 132           HE3      LYS 132  15.435 -25.507  -2.039
 1099    HZ1  LYS 132           HZ1      LYS 132  16.274 -27.296  -0.626
 1100    HZ2  LYS 132           HZ2      LYS 132  17.460 -26.130  -0.929
 1101    HZ3  LYS 132           HZ3      LYS 132  17.503 -27.614  -1.740
 1102    H    LYS 133           H        LYS 133  13.503 -26.198  -7.324
 1103    HA   LYS 133           HA       LYS 133  10.996 -27.701  -7.468
 1104    HB2  LYS 133           HB2      LYS 133  10.681 -27.080  -9.817
 1105    HB3  LYS 133           HB3      LYS 133  10.638 -25.663  -8.778
 1106    HG2  LYS 133           HG2      LYS 133  13.237 -26.405 -10.008
 1107    HG3  LYS 133           HG3      LYS 133  11.996 -25.698 -11.043
 1108    HD2  LYS 133           HD2      LYS 133  11.922 -23.712  -9.746
 1109    HD3  LYS 133           HD3      LYS 133  12.869 -24.440  -8.448
 1110    HE2  LYS 133           HE2      LYS 133  14.848 -24.348  -9.677
 1111    HE3  LYS 133           HE3      LYS 133  13.997 -24.172 -11.211
 1112    HZ1  LYS 133           HZ1      LYS 133  13.503 -21.955 -10.765
 1113    HZ2  LYS 133           HZ2      LYS 133  15.114 -22.119 -10.268
 1114    HZ3  LYS 133           HZ3      LYS 133  13.879 -22.084  -9.116
 1115    H    ARG 134           H        ARG 134  11.119 -29.645  -8.480
 1116    HA   ARG 134           HA       ARG 134  13.631 -30.322  -9.859
 1117    HB2  ARG 134           HB2      ARG 134  11.835 -32.116  -8.217
 1118    HB3  ARG 134           HB3      ARG 134  13.033 -32.740  -9.339
 1119    HG2  ARG 134           HG2      ARG 134  13.980 -32.810  -7.162
 1120    HG3  ARG 134           HG3      ARG 134  14.776 -31.504  -8.039
 1121    HD2  ARG 134           HD2      ARG 134  14.246 -30.800  -5.781
 1122    HD3  ARG 134           HD3      ARG 134  13.299 -29.885  -6.960
 1123    HE   ARG 134           HE       ARG 134  11.864 -32.161  -6.040
 1124   HH11  ARG 134          HH11      ARG 134  12.836 -28.946  -5.101
 1125   HH12  ARG 134          HH12      ARG 134  11.498 -28.705  -4.028
 1126   HH21  ARG 134          HH21      ARG 134  10.087 -31.853  -4.635
 1127   HH22  ARG 134          HH22      ARG 134   9.935 -30.365  -3.753
 1128    H    GLN 135           H        GLN 135  12.928 -29.685 -11.849
 1129    HA   GLN 135           HA       GLN 135  10.556 -31.074 -12.909
 1130    HB2  GLN 135           HB2      GLN 135   9.815 -29.028 -13.997
 1131    HB3  GLN 135           HB3      GLN 135   9.961 -28.765 -12.266
 1132    HG2  GLN 135           HG2      GLN 135  12.165 -27.707 -12.656
 1133    HG3  GLN 135           HG3      GLN 135  11.901 -27.883 -14.390
 1134   HE21  GLN 135          HE21      GLN 135  12.305 -25.455 -12.910
 1135   HE22  GLN 135          HE22      GLN 135  10.896 -24.476 -13.138
 1136    H    LYS 136           H        LYS 136  10.429 -31.059 -15.289
 1137    HA   LYS 136           HA       LYS 136  13.100 -31.123 -16.518
 1138    HB2  LYS 136           HB2      LYS 136  11.998 -32.457 -18.316
 1139    HB3  LYS 136           HB3      LYS 136  11.910 -33.221 -16.737
 1140    HG2  LYS 136           HG2      LYS 136   9.606 -32.509 -16.493
 1141    HG3  LYS 136           HG3      LYS 136   9.684 -31.663 -18.039
 1142    HD2  LYS 136           HD2      LYS 136  10.183 -33.842 -19.131
 1143    HD3  LYS 136           HD3      LYS 136   9.931 -34.634 -17.575
 1144    HE2  LYS 136           HE2      LYS 136   7.924 -34.794 -18.915
 1145    HE3  LYS 136           HE3      LYS 136   7.635 -33.752 -17.522
 1146    HZ1  LYS 136           HZ1      LYS 136   8.238 -32.809 -20.272
 1147    HZ2  LYS 136           HZ2      LYS 136   7.905 -31.827 -18.936
 1148    HZ3  LYS 136           HZ3      LYS 136   6.703 -32.832 -19.564
 1149    H    LYS 137           H        LYS 137  12.473 -28.674 -16.162
 1150    HA   LYS 137           HA       LYS 137  11.571 -27.597 -18.693
 1151    HB2  LYS 137           HB2      LYS 137   9.466 -27.777 -17.580
 1152    HB3  LYS 137           HB3      LYS 137  10.129 -27.181 -16.071
 1153    HG2  LYS 137           HG2      LYS 137  10.144 -25.371 -18.438
 1154    HG3  LYS 137           HG3      LYS 137   8.618 -25.674 -17.599
 1155    HD2  LYS 137           HD2      LYS 137   9.678 -25.009 -15.483
 1156    HD3  LYS 137           HD3      LYS 137  11.172 -24.665 -16.353
 1157    HE2  LYS 137           HE2      LYS 137   9.852 -23.022 -17.731
 1158    HE3  LYS 137           HE3      LYS 137   8.524 -23.260 -16.593
 1159    HZ1  LYS 137           HZ1      LYS 137   9.756 -21.360 -15.911
 1160    HZ2  LYS 137           HZ2      LYS 137  11.228 -22.204 -15.992
 1161    HZ3  LYS 137           HZ3      LYS 137  10.095 -22.599 -14.799
 1162    H    LEU 138           H        LEU 138  12.221 -25.456 -19.020
 1163    HA   LEU 138           HA       LEU 138  14.737 -24.752 -18.266
 1164    HB2  LEU 138           HB2      LEU 138  12.488 -22.873 -18.970
 1165    HB3  LEU 138           HB3      LEU 138  14.191 -22.461 -19.000
 1166    HG   LEU 138           HG       LEU 138  12.997 -24.639 -20.707
 1167   HD11  LEU 138          HD11      LEU 138  11.926 -22.548 -21.275
 1168   HD12  LEU 138          HD12      LEU 138  13.066 -23.007 -22.541
 1169   HD13  LEU 138          HD13      LEU 138  13.494 -21.747 -21.385
 1170   HD21  LEU 138          HD21      LEU 138  15.608 -23.129 -20.864
 1171   HD22  LEU 138          HD22      LEU 138  15.057 -24.362 -21.998
 1172   HD23  LEU 138          HD23      LEU 138  15.408 -24.798 -20.326
 1173    H    ALA 139           H        ALA 139  15.679 -24.094 -16.486
 1174    HA   ALA 139           HA       ALA 139  14.274 -23.543 -14.090
 1175    HB1  ALA 139           HB1      ALA 139  16.547 -24.578 -14.266
 1176    HB2  ALA 139           HB2      ALA 139  16.425 -23.273 -13.089
 1177    HB3  ALA 139           HB3      ALA 139  17.182 -22.980 -14.655
 1178    H    SER 140           H        SER 140  15.610 -21.467 -12.887
 1179    HA   SER 140           HA       SER 140  14.101 -19.255 -13.443
 1180    HB2  SER 140           HB2      SER 140  16.895 -19.205 -12.282
 1181    HB3  SER 140           HB3      SER 140  15.608 -18.029 -12.008
 1182    HG   SER 140           HG       SER 140  15.233 -19.262 -10.335
 1183    H    SER 141           H        SER 141  13.961 -18.477 -15.471
 1184    HA   SER 141           HA       SER 141  16.430 -17.748 -16.867
 1185    HB2  SER 141           HB2      SER 141  13.618 -17.994 -17.970
 1186    HB3  SER 141           HB3      SER 141  15.089 -17.716 -18.905
 1187    HG   SER 141           HG       SER 141  14.842 -19.984 -17.232
  Start of MODEL    5
    1    H1   ASP   1           HT1      ASP   1 -32.182   9.147  -8.428
    2    H2   ASP   1           HT2      ASP   1 -33.631   8.421  -8.911
    3    H3   ASP   1           HT3      ASP   1 -32.726   7.745  -7.659
    4    HA   ASP   1           HA       ASP   1 -34.042  10.382  -7.617
    5    HB2  ASP   1           HB2      ASP   1 -34.829   7.750  -6.388
    6    HB3  ASP   1           HB3      ASP   1 -35.449   9.286  -5.787
    7    HA   PRO   2           HA       PRO   2 -31.711  10.083  -3.536
    8    HB2  PRO   2           HB2      PRO   2 -30.540   7.856  -2.645
    9    HB3  PRO   2           HB3      PRO   2 -32.285   8.092  -2.479
   10    HG2  PRO   2           HG2      PRO   2 -30.778   6.476  -4.498
   11    HG3  PRO   2           HG3      PRO   2 -32.257   6.061  -3.614
   12    HD2  PRO   2           HD2      PRO   2 -32.210   7.025  -6.192
   13    HD3  PRO   2           HD3      PRO   2 -33.592   7.175  -5.093
   14    H    SER   3           H        SER   3 -30.606   9.132  -6.469
   15    HA   SER   3           HA       SER   3 -27.804   8.824  -5.938
   16    HB2  SER   3           HB2      SER   3 -27.795   8.899  -8.537
   17    HB3  SER   3           HB3      SER   3 -28.570   7.537  -7.726
   18    HG   SER   3           HG       SER   3 -29.674   9.148  -9.464
   19    H    ARG   4           H        ARG   4 -28.892  11.270  -5.038
   20    HA   ARG   4           HA       ARG   4 -27.798  13.356  -6.747
   21    HB2  ARG   4           HB2      ARG   4 -29.021  13.497  -3.980
   22    HB3  ARG   4           HB3      ARG   4 -28.586  14.876  -4.976
   23    HG2  ARG   4           HG2      ARG   4 -30.271  14.343  -6.581
   24    HG3  ARG   4           HG3      ARG   4 -30.622  12.812  -5.778
   25    HD2  ARG   4           HD2      ARG   4 -31.079  15.580  -4.675
   26    HD3  ARG   4           HD3      ARG   4 -32.314  14.446  -5.219
   27    HE   ARG   4           HE       ARG   4 -30.542  13.835  -2.943
   28   HH11  ARG   4          HH11      ARG   4 -33.748  14.135  -4.316
   29   HH12  ARG   4          HH12      ARG   4 -34.538  13.456  -2.932
   30   HH21  ARG   4          HH21      ARG   4 -31.573  12.934  -1.129
   31   HH22  ARG   4          HH22      ARG   4 -33.302  12.783  -1.106
   32    H    ARG   5           H        ARG   5 -26.688  15.048  -4.784
   33    HA   ARG   5           HA       ARG   5 -24.115  14.351  -4.345
   34    HB2  ARG   5           HB2      ARG   5 -24.742  16.518  -3.665
   35    HB3  ARG   5           HB3      ARG   5 -26.014  15.914  -2.612
   36    HG2  ARG   5           HG2      ARG   5 -24.177  16.759  -1.299
   37    HG3  ARG   5           HG3      ARG   5 -24.315  15.013  -1.091
   38    HD2  ARG   5           HD2      ARG   5 -22.572  15.033  -3.098
   39    HD3  ARG   5           HD3      ARG   5 -22.197  16.614  -2.413
   40    HE   ARG   5           HE       ARG   5 -22.275  14.334  -0.590
   41   HH11  ARG   5          HH11      ARG   5 -20.365  16.636  -2.407
   42   HH12  ARG   5          HH12      ARG   5 -18.904  16.308  -1.538
   43   HH21  ARG   5          HH21      ARG   5 -20.343  13.876   0.544
   44   HH22  ARG   5          HH22      ARG   5 -18.889  14.732   0.145
   45    H    ALA   6           H        ALA   6 -23.065  12.776  -3.327
   46    HA   ALA   6           HA       ALA   6 -24.407  10.679  -2.049
   47    HB1  ALA   6           HB1      ALA   6 -22.288  10.314  -3.158
   48    HB2  ALA   6           HB2      ALA   6 -22.189   9.822  -1.463
   49    HB3  ALA   6           HB3      ALA   6 -21.471  11.349  -1.984
   50    HA   PRO   7           HA       PRO   7 -24.869  12.118   2.127
   51    HB2  PRO   7           HB2      PRO   7 -24.958   9.589   3.212
   52    HB3  PRO   7           HB3      PRO   7 -26.353  10.439   2.546
   53    HG2  PRO   7           HG2      PRO   7 -24.633   8.327   1.333
   54    HG3  PRO   7           HG3      PRO   7 -26.383   8.570   1.186
   55    HD2  PRO   7           HD2      PRO   7 -24.674   9.250  -0.773
   56    HD3  PRO   7           HD3      PRO   7 -26.142  10.193  -0.440
   57    H    THR   8           H        THR   8 -23.705  12.039   4.116
   58    HA   THR   8           HA       THR   8 -20.945  11.196   3.864
   59    HB   THR   8           HB       THR   8 -20.928  12.132   6.316
   60    HG1  THR   8           HG1      THR   8 -22.650  13.920   6.229
   61   HG21  THR   8          HG21      THR   8 -19.812  13.184   4.411
   62   HG22  THR   8          HG22      THR   8 -20.578  14.396   5.439
   63   HG23  THR   8          HG23      THR   8 -21.334  13.922   3.918
   64    H    TRP   9           H        TRP   9 -20.005   9.566   5.025
   65    HA   TRP   9           HA       TRP   9 -21.660   7.364   5.595
   66    HB2  TRP   9           HB2      TRP   9 -18.734   7.881   6.047
   67    HB3  TRP   9           HB3      TRP   9 -19.497   6.366   6.514
   68    HD1  TRP   9           HD1      TRP   9 -18.520   8.384   3.414
   69    HE1  TRP   9           HE1      TRP   9 -18.553   6.815   1.377
   70    HE3  TRP   9           HE3      TRP   9 -20.549   4.252   5.612
   71    HZ2  TRP   9           HZ2      TRP   9 -19.358   4.188   0.777
   72    HZ3  TRP   9           HZ3      TRP   9 -20.927   2.251   4.232
   73    HH2  TRP   9           HH2      TRP   9 -20.343   2.223   1.863
   74    H    SER  10           H        SER  10 -22.848   7.019   7.272
   75    HA   SER  10           HA       SER  10 -22.447   8.350   9.789
   76    HB2  SER  10           HB2      SER  10 -24.355   6.086   9.154
   77    HB3  SER  10           HB3      SER  10 -24.484   7.259  10.466
   78    HG   SER  10           HG       SER  10 -25.532   7.453   8.083
   79    HA   PRO  11           HA       PRO  11 -19.932   5.442  12.025
   80    HB2  PRO  11           HB2      PRO  11 -22.192   5.293  13.977
   81    HB3  PRO  11           HB3      PRO  11 -20.469   5.567  14.269
   82    HG2  PRO  11           HG2      PRO  11 -22.168   7.597  14.366
   83    HG3  PRO  11           HG3      PRO  11 -20.578   7.792  13.603
   84    HD2  PRO  11           HD2      PRO  11 -23.264   7.499  12.335
   85    HD3  PRO  11           HD3      PRO  11 -21.874   8.475  11.822
   86    H    GLU  12           H        GLU  12 -23.397   4.572  12.101
   87    HA   GLU  12           HA       GLU  12 -22.975   1.777  12.316
   88    HB2  GLU  12           HB2      GLU  12 -25.091   2.916  12.918
   89    HB3  GLU  12           HB3      GLU  12 -25.372   3.262  11.219
   90    HG2  GLU  12           HG2      GLU  12 -26.709   1.405  11.723
   91    HG3  GLU  12           HG3      GLU  12 -25.324   0.769  10.835
   92    H    GLU  13           H        GLU  13 -23.019   3.982   9.641
   93    HA   GLU  13           HA       GLU  13 -23.652   2.064   7.625
   94    HB2  GLU  13           HB2      GLU  13 -24.030   4.582   7.549
   95    HB3  GLU  13           HB3      GLU  13 -22.311   4.735   7.222
   96    HG2  GLU  13           HG2      GLU  13 -22.500   3.691   5.134
   97    HG3  GLU  13           HG3      GLU  13 -24.106   3.055   5.504
   98    H    GLU  14           H        GLU  14 -20.643   3.550   8.825
   99    HA   GLU  14           HA       GLU  14 -18.969   2.096   7.027
  100    HB2  GLU  14           HB2      GLU  14 -18.349   3.507   9.622
  101    HB3  GLU  14           HB3      GLU  14 -17.125   2.717   8.639
  102    HG2  GLU  14           HG2      GLU  14 -17.852   4.201   6.742
  103    HG3  GLU  14           HG3      GLU  14 -18.819   5.088   7.919
  104    H    ALA  15           H        ALA  15 -20.262   1.466  10.223
  105    HA   ALA  15           HA       ALA  15 -18.737  -0.869  10.736
  106    HB1  ALA  15           HB1      ALA  15 -21.461  -0.095  11.772
  107    HB2  ALA  15           HB2      ALA  15 -19.911   0.306  12.514
  108    HB3  ALA  15           HB3      ALA  15 -20.436  -1.374  12.422
  109    H    HIS  16           H        HIS  16 -21.970  -0.380   9.397
  110    HA   HIS  16           HA       HIS  16 -22.575  -2.987   8.674
  111    HB2  HIS  16           HB2      HIS  16 -24.140  -1.026   8.643
  112    HB3  HIS  16           HB3      HIS  16 -23.349  -0.474   7.175
  113    HD1  HIS  16           HD1      HIS  16 -25.950  -0.711   6.344
  114    HD2  HIS  16           HD2      HIS  16 -23.845  -4.236   6.976
  115    HE1  HIS  16           HE1      HIS  16 -27.244  -2.503   5.144
  116    HE2  HIS  16           HE2      HIS  16 -26.058  -4.645   5.707
  117    H    LEU  17           H        LEU  17 -20.426  -0.676   7.257
  118    HA   LEU  17           HA       LEU  17 -20.247  -1.816   4.673
  119    HB2  LEU  17           HB2      LEU  17 -19.516   0.507   5.482
  120    HB3  LEU  17           HB3      LEU  17 -18.074  -0.286   6.084
  121    HG   LEU  17           HG       LEU  17 -17.468  -0.967   3.827
  122   HD11  LEU  17          HD11      LEU  17 -19.626  -1.300   2.855
  123   HD12  LEU  17          HD12      LEU  17 -18.788  -0.064   1.922
  124   HD13  LEU  17          HD13      LEU  17 -20.041   0.398   3.073
  125   HD21  LEU  17          HD21      LEU  17 -16.988   1.227   2.910
  126   HD22  LEU  17          HD22      LEU  17 -16.729   1.212   4.654
  127   HD23  LEU  17          HD23      LEU  17 -18.182   1.955   3.985
  128    H    ARG  18           H        ARG  18 -18.299  -2.129   7.631
  129    HA   ARG  18           HA       ARG  18 -16.699  -4.223   6.503
  130    HB2  ARG  18           HB2      ARG  18 -15.714  -4.423   8.720
  131    HB3  ARG  18           HB3      ARG  18 -15.781  -2.737   8.231
  132    HG2  ARG  18           HG2      ARG  18 -17.817  -2.473   9.618
  133    HG3  ARG  18           HG3      ARG  18 -17.594  -4.129  10.185
  134    HD2  ARG  18           HD2      ARG  18 -15.370  -3.512  11.039
  135    HD3  ARG  18           HD3      ARG  18 -15.646  -1.853  10.519
  136    HE   ARG  18           HE       ARG  18 -17.656  -2.898  12.309
  137   HH11  ARG  18          HH11      ARG  18 -14.623  -1.179  12.023
  138   HH12  ARG  18          HH12      ARG  18 -14.722  -0.477  13.603
  139   HH21  ARG  18          HH21      ARG  18 -17.790  -1.967  14.398
  140   HH22  ARG  18          HH22      ARG  18 -16.523  -0.918  14.954
  141    H    GLU  19           H        GLU  19 -19.596  -3.925   8.382
  142    HA   GLU  19           HA       GLU  19 -19.978  -6.410   9.433
  143    HB2  GLU  19           HB2      GLU  19 -21.525  -4.539   9.731
  144    HB3  GLU  19           HB3      GLU  19 -22.025  -4.683   8.054
  145    HG2  GLU  19           HG2      GLU  19 -23.678  -5.641   9.533
  146    HG3  GLU  19           HG3      GLU  19 -22.959  -6.880   8.509
  147    H    LEU  20           H        LEU  20 -20.854  -5.299   6.209
  148    HA   LEU  20           HA       LEU  20 -21.738  -7.825   5.258
  149    HB2  LEU  20           HB2      LEU  20 -21.712  -5.131   4.391
  150    HB3  LEU  20           HB3      LEU  20 -20.933  -6.079   3.140
  151    HG   LEU  20           HG       LEU  20 -23.605  -6.892   4.240
  152   HD11  LEU  20          HD11      LEU  20 -23.093  -4.991   1.963
  153   HD12  LEU  20          HD12      LEU  20 -23.792  -4.562   3.526
  154   HD13  LEU  20          HD13      LEU  20 -24.657  -5.649   2.439
  155   HD21  LEU  20          HD21      LEU  20 -23.813  -7.974   2.074
  156   HD22  LEU  20          HD22      LEU  20 -22.342  -8.506   2.893
  157   HD23  LEU  20          HD23      LEU  20 -22.246  -7.326   1.585
  158    H    TYR  21           H        TYR  21 -18.674  -6.153   5.276
  159    HA   TYR  21           HA       TYR  21 -17.437  -7.721   3.248
  160    HB2  TYR  21           HB2      TYR  21 -16.537  -5.528   3.763
  161    HB3  TYR  21           HB3      TYR  21 -16.247  -6.001   5.434
  162    HD1  TYR  21           HD1      TYR  21 -15.185  -6.623   1.939
  163    HD2  TYR  21           HD2      TYR  21 -14.250  -7.098   6.057
  164    HE1  TYR  21           HE1      TYR  21 -12.922  -7.385   1.337
  165    HE2  TYR  21           HE2      TYR  21 -11.992  -7.865   5.468
  166    HH   TYR  21           HH       TYR  21 -10.725  -7.600   2.287
  167    H    LEU  22           H        LEU  22 -17.287  -7.734   6.782
  168    HA   LEU  22           HA       LEU  22 -15.477  -9.838   7.075
  169    HB2  LEU  22           HB2      LEU  22 -17.749  -9.147   8.941
  170    HB3  LEU  22           HB3      LEU  22 -16.274  -9.994   9.353
  171    HG   LEU  22           HG       LEU  22 -16.446  -7.112   8.486
  172   HD11  LEU  22          HD11      LEU  22 -15.797  -6.613  10.790
  173   HD12  LEU  22          HD12      LEU  22 -15.944  -8.326  11.192
  174   HD13  LEU  22          HD13      LEU  22 -17.366  -7.410  10.691
  175   HD21  LEU  22          HD21      LEU  22 -14.352  -8.145   7.800
  176   HD22  LEU  22          HD22      LEU  22 -14.078  -8.703   9.451
  177   HD23  LEU  22          HD23      LEU  22 -14.101  -6.974   9.096
  178    H    ALA  23           H        ALA  23 -18.896  -9.827   6.447
  179    HA   ALA  23           HA       ALA  23 -19.341 -12.574   7.052
  180    HB1  ALA  23           HB1      ALA  23 -21.003 -10.733   5.343
  181    HB2  ALA  23           HB2      ALA  23 -21.115 -10.868   7.097
  182    HB3  ALA  23           HB3      ALA  23 -21.524 -12.248   6.080
  183    H    ASN  24           H        ASN  24 -18.790 -10.808   3.990
  184    HA   ASN  24           HA       ASN  24 -18.877 -13.402   2.615
  185    HB2  ASN  24           HB2      ASN  24 -19.306 -10.614   1.524
  186    HB3  ASN  24           HB3      ASN  24 -19.339 -12.089   0.562
  187   HD21  ASN  24          HD21      ASN  24 -21.018 -10.124   2.855
  188   HD22  ASN  24          HD22      ASN  24 -22.522 -10.980   2.798
  189    H    LYS  25           H        LYS  25 -16.523 -11.866   3.962
  190    HA   LYS  25           HA       LYS  25 -14.766 -11.250   1.784
  191    HB2  LYS  25           HB2      LYS  25 -13.021 -11.019   3.489
  192    HB3  LYS  25           HB3      LYS  25 -14.476 -10.148   3.945
  193    HG2  LYS  25           HG2      LYS  25 -15.094 -11.953   5.462
  194    HG3  LYS  25           HG3      LYS  25 -13.648 -12.845   4.991
  195    HD2  LYS  25           HD2      LYS  25 -13.632 -10.113   6.269
  196    HD3  LYS  25           HD3      LYS  25 -13.426 -11.627   7.149
  197    HE2  LYS  25           HE2      LYS  25 -11.632 -10.575   4.962
  198    HE3  LYS  25           HE3      LYS  25 -11.274 -10.578   6.686
  199    HZ1  LYS  25           HZ1      LYS  25 -11.629 -12.971   4.964
  200    HZ2  LYS  25           HZ2      LYS  25 -11.391 -13.016   6.636
  201    HZ3  LYS  25           HZ3      LYS  25 -10.178 -12.412   5.625
  202    H    ASP  26           H        ASP  26 -15.650 -14.134   3.374
  203    HA   ASP  26           HA       ASP  26 -13.184 -15.480   2.537
  204    HB2  ASP  26           HB2      ASP  26 -15.370 -16.324   4.446
  205    HB3  ASP  26           HB3      ASP  26 -14.032 -17.365   3.971
  206    H    VAL  27           H        VAL  27 -15.835 -14.697   1.059
  207    HA   VAL  27           HA       VAL  27 -16.543 -17.318  -0.008
  208    HB   VAL  27           HB       VAL  27 -17.704 -14.620  -0.728
  209   HG11  VAL  27          HG11      VAL  27 -18.680 -17.423  -1.270
  210   HG12  VAL  27          HG12      VAL  27 -18.046 -16.286  -2.462
  211   HG13  VAL  27          HG13      VAL  27 -19.568 -15.945  -1.637
  212   HG21  VAL  27          HG21      VAL  27 -19.587 -15.224   0.706
  213   HG22  VAL  27          HG22      VAL  27 -18.084 -15.130   1.629
  214   HG23  VAL  27          HG23      VAL  27 -18.753 -16.701   1.186
  215    H    GLU  28           H        GLU  28 -15.201 -18.066  -1.472
  216    HA   GLU  28           HA       GLU  28 -13.806 -16.213  -3.232
  217    HB2  GLU  28           HB2      GLU  28 -13.463 -19.178  -2.761
  218    HB3  GLU  28           HB3      GLU  28 -12.500 -18.234  -3.892
  219    HG2  GLU  28           HG2      GLU  28 -11.667 -16.861  -2.059
  220    HG3  GLU  28           HG3      GLU  28 -12.655 -17.769  -0.918
  221    H    GLY  29           H        GLY  29 -13.777 -16.509  -5.506
  222    HA2  GLY  29           HA2      GLY  29 -14.796 -16.954  -7.557
  223    HA3  GLY  29           HA3      GLY  29 -15.908 -18.047  -6.736
  224    H    GLN  30           H        GLN  30 -15.381 -14.932  -5.447
  225    HA   GLN  30           HA       GLN  30 -17.864 -13.875  -6.538
  226    HB2  GLN  30           HB2      GLN  30 -18.660 -15.026  -4.629
  227    HB3  GLN  30           HB3      GLN  30 -17.294 -14.524  -3.654
  228    HG2  GLN  30           HG2      GLN  30 -18.975 -12.333  -4.658
  229    HG3  GLN  30           HG3      GLN  30 -19.754 -13.426  -3.513
  230   HE21  GLN  30          HE21      GLN  30 -19.833 -11.748  -1.969
  231   HE22  GLN  30          HE22      GLN  30 -18.429 -11.270  -1.095
  232    H    ASP  31           H        ASP  31 -18.025 -11.616  -6.393
  233    HA   ASP  31           HA       ASP  31 -15.545 -10.178  -5.875
  234    HB2  ASP  31           HB2      ASP  31 -18.249  -9.281  -6.876
  235    HB3  ASP  31           HB3      ASP  31 -16.877  -8.201  -6.665
  236    H    VAL  32           H        VAL  32 -15.217  -9.919  -3.700
  237    HA   VAL  32           HA       VAL  32 -17.242  -9.877  -1.797
  238    HB   VAL  32           HB       VAL  32 -14.800 -10.297  -1.331
  239   HG11  VAL  32          HG11      VAL  32 -13.789  -8.412  -2.411
  240   HG12  VAL  32          HG12      VAL  32 -13.454  -8.308  -0.682
  241   HG13  VAL  32          HG13      VAL  32 -14.704  -7.288  -1.403
  242   HG21  VAL  32          HG21      VAL  32 -16.396 -10.118   0.468
  243   HG22  VAL  32          HG22      VAL  32 -16.291  -8.356   0.427
  244   HG23  VAL  32          HG23      VAL  32 -14.897  -9.310   0.935
  245    H    VAL  33           H        VAL  33 -15.597  -7.176  -3.412
  246    HA   VAL  33           HA       VAL  33 -16.837  -5.195  -1.825
  247    HB   VAL  33           HB       VAL  33 -14.739  -4.807  -3.041
  248   HG11  VAL  33          HG11      VAL  33 -16.443  -4.721  -5.513
  249   HG12  VAL  33          HG12      VAL  33 -15.203  -5.916  -5.130
  250   HG13  VAL  33          HG13      VAL  33 -14.751  -4.231  -5.405
  251   HG21  VAL  33          HG21      VAL  33 -16.970  -2.899  -3.698
  252   HG22  VAL  33          HG22      VAL  33 -15.251  -2.511  -3.767
  253   HG23  VAL  33          HG23      VAL  33 -16.001  -2.923  -2.224
  254    H    GLU  34           H        GLU  34 -17.681  -6.734  -4.878
  255    HA   GLU  34           HA       GLU  34 -19.861  -5.128  -5.595
  256    HB2  GLU  34           HB2      GLU  34 -19.041  -6.797  -7.129
  257    HB3  GLU  34           HB3      GLU  34 -19.369  -8.081  -5.976
  258    HG2  GLU  34           HG2      GLU  34 -21.781  -7.576  -6.167
  259    HG3  GLU  34           HG3      GLU  34 -21.396  -6.405  -7.426
  260    H    ALA  35           H        ALA  35 -19.665  -8.013  -3.553
  261    HA   ALA  35           HA       ALA  35 -22.329  -8.209  -2.797
  262    HB1  ALA  35           HB1      ALA  35 -21.541  -9.448  -0.863
  263    HB2  ALA  35           HB2      ALA  35 -19.908  -8.828  -1.109
  264    HB3  ALA  35           HB3      ALA  35 -20.627  -9.911  -2.300
  265    H    ILE  36           H        ILE  36 -19.757  -6.150  -1.555
  266    HA   ILE  36           HA       ILE  36 -21.266  -5.188   0.662
  267    HB   ILE  36           HB       ILE  36 -19.066  -3.590  -0.606
  268   HG12  ILE  36          HG12      ILE  36 -18.152  -5.826  -0.523
  269   HG13  ILE  36          HG13      ILE  36 -17.440  -4.875   0.773
  270   HG21  ILE  36          HG21      ILE  36 -20.251  -2.591   1.243
  271   HG22  ILE  36          HG22      ILE  36 -18.612  -3.010   1.743
  272   HG23  ILE  36          HG23      ILE  36 -19.969  -4.022   2.234
  273   HD11  ILE  36          HD11      ILE  36 -19.715  -6.805   1.127
  274   HD12  ILE  36          HD12      ILE  36 -18.825  -5.962   2.396
  275   HD13  ILE  36          HD13      ILE  36 -18.020  -7.185   1.410
  276    H    LEU  37           H        LEU  37 -20.233  -3.586  -2.341
  277    HA   LEU  37           HA       LEU  37 -21.542  -1.173  -2.059
  278    HB2  LEU  37           HB2      LEU  37 -21.530  -2.487  -4.740
  279    HB3  LEU  37           HB3      LEU  37 -21.279  -0.810  -4.349
  280    HG   LEU  37           HG       LEU  37 -19.262  -2.926  -3.645
  281   HD11  LEU  37          HD11      LEU  37 -18.084  -2.335  -5.697
  282   HD12  LEU  37          HD12      LEU  37 -19.424  -1.289  -6.170
  283   HD13  LEU  37          HD13      LEU  37 -19.666  -3.033  -6.047
  284   HD21  LEU  37          HD21      LEU  37 -19.102   0.054  -4.027
  285   HD22  LEU  37          HD22      LEU  37 -17.736  -1.010  -3.683
  286   HD23  LEU  37          HD23      LEU  37 -19.027  -0.820  -2.498
  287    H    ALA  38           H        ALA  38 -22.867  -4.188  -3.273
  288    HA   ALA  38           HA       ALA  38 -25.246  -2.877  -4.282
  289    HB1  ALA  38           HB1      ALA  38 -24.111  -4.544  -5.632
  290    HB2  ALA  38           HB2      ALA  38 -25.768  -5.029  -5.272
  291    HB3  ALA  38           HB3      ALA  38 -24.421  -5.763  -4.398
  292    H    HIS  39           H        HIS  39 -24.391  -4.758  -1.461
  293    HA   HIS  39           HA       HIS  39 -27.162  -5.536  -1.043
  294    HB2  HIS  39           HB2      HIS  39 -24.619  -6.161   0.407
  295    HB3  HIS  39           HB3      HIS  39 -26.167  -6.420   1.200
  296    HD1  HIS  39           HD1      HIS  39 -27.585  -8.397   0.407
  297    HD2  HIS  39           HD2      HIS  39 -24.069  -7.893  -1.737
  298    HE1  HIS  39           HE1      HIS  39 -27.333 -10.483  -0.973
  299    HE2  HIS  39           HE2      HIS  39 -25.336 -10.034  -2.444
  300    H    LEU  40           H        LEU  40 -24.917  -3.118   0.160
  301    HA   LEU  40           HA       LEU  40 -27.016  -2.227   1.991
  302    HB2  LEU  40           HB2      LEU  40 -25.136  -0.488   2.612
  303    HB3  LEU  40           HB3      LEU  40 -25.185  -2.091   3.307
  304    HG   LEU  40           HG       LEU  40 -23.502  -2.778   1.540
  305   HD11  LEU  40          HD11      LEU  40 -22.137  -0.983   0.573
  306   HD12  LEU  40          HD12      LEU  40 -23.287   0.207   1.184
  307   HD13  LEU  40          HD13      LEU  40 -23.792  -0.964  -0.038
  308   HD21  LEU  40          HD21      LEU  40 -22.897  -2.400   3.856
  309   HD22  LEU  40          HD22      LEU  40 -22.727  -0.671   3.549
  310   HD23  LEU  40          HD23      LEU  40 -21.626  -1.818   2.782
  311    H    ASN  41           H        ASN  41 -28.450  -1.454   0.472
  312    HA   ASN  41           HA       ASN  41 -27.598   0.538  -1.441
  313    HB2  ASN  41           HB2      ASN  41 -30.346  -0.537  -0.761
  314    HB3  ASN  41           HB3      ASN  41 -30.006   0.577  -2.081
  315   HD21  ASN  41          HD21      ASN  41 -29.717  -2.679  -0.934
  316   HD22  ASN  41          HD22      ASN  41 -29.188  -3.372  -2.427
  317    H    THR  42           H        THR  42 -27.122   1.227   1.228
  318    HA   THR  42           HA       THR  42 -29.039   3.321   1.870
  319    HB   THR  42           HB       THR  42 -28.225   2.066   3.764
  320    HG1  THR  42           HG1      THR  42 -26.681   4.381   4.115
  321   HG21  THR  42          HG21      THR  42 -25.843   2.014   4.391
  322   HG22  THR  42          HG22      THR  42 -25.437   2.849   2.891
  323   HG23  THR  42          HG23      THR  42 -26.129   1.228   2.839
  324    H    VAL  43           H        VAL  43 -26.040   2.826   0.285
  325    HA   VAL  43           HA       VAL  43 -25.691   5.735   0.030
  326    HB   VAL  43           HB       VAL  43 -23.243   5.113  -0.496
  327   HG11  VAL  43          HG11      VAL  43 -23.859   6.393   1.451
  328   HG12  VAL  43          HG12      VAL  43 -22.630   5.207   1.890
  329   HG13  VAL  43          HG13      VAL  43 -24.321   4.923   2.308
  330   HG21  VAL  43          HG21      VAL  43 -24.077   2.657   1.045
  331   HG22  VAL  43          HG22      VAL  43 -22.413   3.118   0.685
  332   HG23  VAL  43          HG23      VAL  43 -23.519   2.704  -0.627
  333    HA   PRO  44           HA       PRO  44 -26.026   4.733  -4.385
  334    HB2  PRO  44           HB2      PRO  44 -26.077   7.644  -4.652
  335    HB3  PRO  44           HB3      PRO  44 -27.291   6.461  -5.150
  336    HG2  PRO  44           HG2      PRO  44 -27.682   8.186  -3.097
  337    HG3  PRO  44           HG3      PRO  44 -28.405   6.569  -3.149
  338    HD2  PRO  44           HD2      PRO  44 -26.005   7.524  -1.631
  339    HD3  PRO  44           HD3      PRO  44 -27.293   6.411  -1.121
  340    H    ARG  45           H        ARG  45 -23.841   4.037  -4.379
  341    HA   ARG  45           HA       ARG  45 -21.862   6.133  -4.837
  342    HB2  ARG  45           HB2      ARG  45 -21.937   4.258  -2.541
  343    HB3  ARG  45           HB3      ARG  45 -20.367   4.579  -3.267
  344    HG2  ARG  45           HG2      ARG  45 -20.668   6.953  -2.919
  345    HG3  ARG  45           HG3      ARG  45 -22.271   6.671  -2.242
  346    HD2  ARG  45           HD2      ARG  45 -21.440   5.866  -0.272
  347    HD3  ARG  45           HD3      ARG  45 -19.968   5.247  -1.020
  348    HE   ARG  45           HE       ARG  45 -19.034   7.400  -0.918
  349   HH11  ARG  45          HH11      ARG  45 -22.181   7.228   0.614
  350   HH12  ARG  45          HH12      ARG  45 -22.034   8.782   1.375
  351   HH21  ARG  45          HH21      ARG  45 -18.843   9.447   0.090
  352   HH22  ARG  45          HH22      ARG  45 -20.144  10.041   1.079
  353    H    THR  46           H        THR  46 -19.647   5.033  -5.182
  354    HA   THR  46           HA       THR  46 -20.070   3.001  -7.249
  355    HB   THR  46           HB       THR  46 -17.919   3.801  -8.163
  356    HG1  THR  46           HG1      THR  46 -16.876   5.517  -7.210
  357   HG21  THR  46          HG21      THR  46 -18.711   5.995  -8.922
  358   HG22  THR  46          HG22      THR  46 -19.916   6.001  -7.634
  359   HG23  THR  46          HG23      THR  46 -20.019   4.811  -8.934
  360    H    ARG  47           H        ARG  47 -17.553   2.039  -7.556
  361    HA   ARG  47           HA       ARG  47 -17.495   0.126  -5.440
  362    HB2  ARG  47           HB2      ARG  47 -15.154   0.209  -7.238
  363    HB3  ARG  47           HB3      ARG  47 -16.179  -1.143  -6.797
  364    HG2  ARG  47           HG2      ARG  47 -16.746   0.938  -8.903
  365    HG3  ARG  47           HG3      ARG  47 -16.311  -0.743  -9.161
  366    HD2  ARG  47           HD2      ARG  47 -18.390  -1.494  -8.226
  367    HD3  ARG  47           HD3      ARG  47 -18.813   0.152  -7.741
  368    HE   ARG  47           HE       ARG  47 -18.445   0.321 -10.434
  369   HH11  ARG  47          HH11      ARG  47 -20.470  -1.649  -8.367
  370   HH12  ARG  47          HH12      ARG  47 -21.724  -1.825  -9.548
  371   HH21  ARG  47          HH21      ARG  47 -20.113   0.100 -11.987
  372   HH22  ARG  47          HH22      ARG  47 -21.510  -0.854 -11.608
  373    H    LYS  48           H        LYS  48 -15.291   2.634  -6.574
  374    HA   LYS  48           HA       LYS  48 -13.124   2.180  -4.915
  375    HB2  LYS  48           HB2      LYS  48 -12.997   3.613  -6.840
  376    HB3  LYS  48           HB3      LYS  48 -14.168   4.733  -6.141
  377    HG2  LYS  48           HG2      LYS  48 -12.335   4.873  -4.234
  378    HG3  LYS  48           HG3      LYS  48 -11.282   4.374  -5.558
  379    HD2  LYS  48           HD2      LYS  48 -11.269   6.758  -5.510
  380    HD3  LYS  48           HD3      LYS  48 -12.246   6.276  -6.899
  381    HE2  LYS  48           HE2      LYS  48 -14.280   6.608  -5.573
  382    HE3  LYS  48           HE3      LYS  48 -13.299   7.089  -4.194
  383    HZ1  LYS  48           HZ1      LYS  48 -14.195   8.998  -5.375
  384    HZ2  LYS  48           HZ2      LYS  48 -13.418   8.511  -6.795
  385    HZ3  LYS  48           HZ3      LYS  48 -12.507   8.981  -5.453
  386    H    GLN  49           H        GLN  49 -16.046   4.016  -4.267
  387    HA   GLN  49           HA       GLN  49 -15.317   5.402  -1.973
  388    HB2  GLN  49           HB2      GLN  49 -17.868   4.392  -3.108
  389    HB3  GLN  49           HB3      GLN  49 -17.889   4.859  -1.417
  390    HG2  GLN  49           HG2      GLN  49 -18.638   6.695  -2.727
  391    HG3  GLN  49           HG3      GLN  49 -17.061   7.092  -2.069
  392   HE21  GLN  49          HE21      GLN  49 -18.606   8.065  -4.403
  393   HE22  GLN  49          HE22      GLN  49 -17.528   7.917  -5.744
  394    H    ILE  50           H        ILE  50 -17.057   2.310  -2.108
  395    HA   ILE  50           HA       ILE  50 -16.983   1.820   0.654
  396    HB   ILE  50           HB       ILE  50 -17.518   0.117  -1.743
  397   HG12  ILE  50          HG12      ILE  50 -19.678  -0.190  -0.235
  398   HG13  ILE  50          HG13      ILE  50 -19.088   1.283   0.519
  399   HG21  ILE  50          HG21      ILE  50 -16.348  -1.423  -0.346
  400   HG22  ILE  50          HG22      ILE  50 -18.071  -1.783  -0.226
  401   HG23  ILE  50          HG23      ILE  50 -17.259  -0.909   1.073
  402   HD11  ILE  50          HD11      ILE  50 -19.960   0.874  -2.327
  403   HD12  ILE  50          HD12      ILE  50 -19.072   2.311  -1.790
  404   HD13  ILE  50          HD13      ILE  50 -20.655   1.943  -1.105
  405    H    ILE  51           H        ILE  51 -14.871   0.769  -1.977
  406    HA   ILE  51           HA       ILE  51 -13.227  -1.025  -0.657
  407    HB   ILE  51           HB       ILE  51 -12.375   1.013  -2.718
  408   HG12  ILE  51          HG12      ILE  51 -13.235  -1.856  -3.102
  409   HG13  ILE  51          HG13      ILE  51 -14.292  -0.471  -3.358
  410   HG21  ILE  51          HG21      ILE  51 -10.482   0.013  -1.533
  411   HG22  ILE  51          HG22      ILE  51 -10.552  -0.545  -3.204
  412   HG23  ILE  51          HG23      ILE  51 -11.098  -1.597  -1.901
  413   HD11  ILE  51          HD11      ILE  51 -12.866   0.325  -5.128
  414   HD12  ILE  51          HD12      ILE  51 -13.342  -1.343  -5.437
  415   HD13  ILE  51          HD13      ILE  51 -11.725  -0.982  -4.833
  416    H    HIS  52           H        HIS  52 -12.964   2.497  -0.876
  417    HA   HIS  52           HA       HIS  52 -10.499   2.837   0.335
  418    HB2  HIS  52           HB2      HIS  52 -12.833   4.558  -0.176
  419    HB3  HIS  52           HB3      HIS  52 -11.758   5.104   1.106
  420    HD1  HIS  52           HD1      HIS  52  -9.854   6.493   0.341
  421    HD2  HIS  52           HD2      HIS  52 -11.279   4.010  -2.674
  422    HE1  HIS  52           HE1      HIS  52  -8.558   7.113  -1.714
  423    HE2  HIS  52           HE2      HIS  52  -9.568   5.742  -3.556
  424    H    HIS  53           H        HIS  53 -13.710   2.904   1.917
  425    HA   HIS  53           HA       HIS  53 -12.667   3.513   4.475
  426    HB2  HIS  53           HB2      HIS  53 -15.241   2.142   3.712
  427    HB3  HIS  53           HB3      HIS  53 -14.846   2.642   5.354
  428    HD1  HIS  53           HD1      HIS  53 -14.656   5.241   5.772
  429    HD2  HIS  53           HD2      HIS  53 -16.215   4.096   2.087
  430    HE1  HIS  53           HE1      HIS  53 -15.627   7.328   4.776
  431    HE2  HIS  53           HE2      HIS  53 -16.668   6.596   2.601
  432    H    LEU  54           H        LEU  54 -13.102   0.463   2.833
  433    HA   LEU  54           HA       LEU  54 -12.886  -1.164   5.158
  434    HB2  LEU  54           HB2      LEU  54 -12.556  -1.774   2.228
  435    HB3  LEU  54           HB3      LEU  54 -12.449  -2.999   3.478
  436    HG   LEU  54           HG       LEU  54 -14.889  -1.288   2.960
  437   HD11  LEU  54          HD11      LEU  54 -15.860  -3.326   2.015
  438   HD12  LEU  54          HD12      LEU  54 -14.309  -4.146   2.200
  439   HD13  LEU  54          HD13      LEU  54 -14.458  -2.780   1.093
  440   HD21  LEU  54          HD21      LEU  54 -14.687  -2.091   5.284
  441   HD22  LEU  54          HD22      LEU  54 -14.531  -3.743   4.690
  442   HD23  LEU  54          HD23      LEU  54 -16.032  -2.853   4.435
  443    H    VAL  55           H        VAL  55 -10.583  -0.286   2.595
  444    HA   VAL  55           HA       VAL  55  -8.410  -1.657   3.832
  445    HB   VAL  55           HB       VAL  55  -6.978  -0.589   2.188
  446   HG11  VAL  55          HG11      VAL  55  -8.281  -2.496   1.459
  447   HG12  VAL  55          HG12      VAL  55  -8.110  -1.340   0.138
  448   HG13  VAL  55          HG13      VAL  55  -9.629  -1.441   1.030
  449   HG21  VAL  55          HG21      VAL  55  -7.884   1.026   0.567
  450   HG22  VAL  55          HG22      VAL  55  -7.882   1.663   2.212
  451   HG23  VAL  55          HG23      VAL  55  -9.385   1.091   1.488
  452    H    GLN  56           H        GLN  56  -9.861   1.423   4.230
  453    HA   GLN  56           HA       GLN  56  -7.637   2.664   5.543
  454    HB2  GLN  56           HB2      GLN  56 -10.468   3.363   4.989
  455    HB3  GLN  56           HB3      GLN  56  -9.685   4.190   6.321
  456    HG2  GLN  56           HG2      GLN  56  -7.939   4.982   4.819
  457    HG3  GLN  56           HG3      GLN  56  -8.679   4.098   3.486
  458   HE21  GLN  56          HE21      GLN  56 -10.584   4.847   2.596
  459   HE22  GLN  56          HE22      GLN  56 -11.150   6.461   2.843
  460    H    MET  57           H        MET  57 -10.338   0.688   6.515
  461    HA   MET  57           HA       MET  57  -9.960   1.303   9.314
  462    HB2  MET  57           HB2      MET  57 -11.828  -0.508   7.827
  463    HB3  MET  57           HB3      MET  57 -11.638  -0.657   9.569
  464    HG2  MET  57           HG2      MET  57 -12.236   1.727   9.798
  465    HG3  MET  57           HG3      MET  57 -12.531   1.787   8.063
  466    HE1  MET  57           HE1      MET  57 -14.008  -0.678   7.203
  467    HE2  MET  57           HE2      MET  57 -14.680   0.923   6.897
  468    HE3  MET  57           HE3      MET  57 -15.699  -0.346   7.577
  469    H    GLY  58           H        GLY  58  -8.234  -0.476   7.212
  470    HA2  GLY  58           HA2      GLY  58  -6.397  -1.808   7.640
  471    HA3  GLY  58           HA3      GLY  58  -6.785  -1.721   9.350
  472    H    LEU  59           H        LEU  59  -9.492  -2.680   7.709
  473    HA   LEU  59           HA       LEU  59  -9.094  -5.439   8.527
  474    HB2  LEU  59           HB2      LEU  59 -11.501  -5.701   7.948
  475    HB3  LEU  59           HB3      LEU  59 -11.184  -4.496   9.178
  476    HG   LEU  59           HG       LEU  59 -11.265  -2.824   7.171
  477   HD11  LEU  59          HD11      LEU  59 -12.747  -3.481   5.398
  478   HD12  LEU  59          HD12      LEU  59 -12.933  -5.088   6.098
  479   HD13  LEU  59          HD13      LEU  59 -11.371  -4.581   5.453
  480   HD21  LEU  59          HD21      LEU  59 -13.703  -2.609   7.496
  481   HD22  LEU  59          HD22      LEU  59 -12.807  -2.765   9.006
  482   HD23  LEU  59          HD23      LEU  59 -13.693  -4.146   8.360
  483    H    ALA  60           H        ALA  60  -8.825  -3.523   5.794
  484    HA   ALA  60           HA       ALA  60  -8.391  -5.933   4.159
  485    HB1  ALA  60           HB1      ALA  60 -10.418  -4.832   3.368
  486    HB2  ALA  60           HB2      ALA  60  -9.125  -4.693   2.176
  487    HB3  ALA  60           HB3      ALA  60  -9.539  -3.313   3.193
  488    H    ASP  61           H        ASP  61  -6.747  -5.607   2.460
  489    HA   ASP  61           HA       ASP  61  -4.489  -4.268   3.630
  490    HB2  ASP  61           HB2      ASP  61  -4.805  -5.919   1.127
  491    HB3  ASP  61           HB3      ASP  61  -3.281  -5.167   1.582
  492    H    SER  62           H        SER  62  -5.837  -4.086   0.320
  493    HA   SER  62           HA       SER  62  -5.197  -1.254   0.217
  494    HB2  SER  62           HB2      SER  62  -3.918  -3.225  -1.682
  495    HB3  SER  62           HB3      SER  62  -3.730  -1.473  -1.725
  496    HG   SER  62           HG       SER  62  -2.985  -1.893   0.607
  497    H    VAL  63           H        VAL  63  -5.831  -0.285  -1.860
  498    HA   VAL  63           HA       VAL  63  -8.465  -1.042  -2.545
  499    HB   VAL  63           HB       VAL  63  -6.546   0.960  -3.735
  500   HG11  VAL  63          HG11      VAL  63  -8.030   0.246  -5.525
  501   HG12  VAL  63          HG12      VAL  63  -8.430   1.883  -5.003
  502   HG13  VAL  63          HG13      VAL  63  -9.434   0.525  -4.494
  503   HG21  VAL  63          HG21      VAL  63  -8.092   2.567  -2.679
  504   HG22  VAL  63          HG22      VAL  63  -7.343   1.472  -1.517
  505   HG23  VAL  63          HG23      VAL  63  -9.013   1.214  -2.022
  506    H    LYS  64           H        LYS  64  -5.352  -1.668  -3.957
  507    HA   LYS  64           HA       LYS  64  -6.013  -2.382  -6.553
  508    HB2  LYS  64           HB2      LYS  64  -3.851  -3.339  -4.704
  509    HB3  LYS  64           HB3      LYS  64  -3.970  -3.899  -6.359
  510    HG2  LYS  64           HG2      LYS  64  -3.724  -1.625  -7.169
  511    HG3  LYS  64           HG3      LYS  64  -3.658  -1.032  -5.509
  512    HD2  LYS  64           HD2      LYS  64  -1.413  -1.151  -6.236
  513    HD3  LYS  64           HD3      LYS  64  -1.650  -2.549  -5.193
  514    HE2  LYS  64           HE2      LYS  64  -1.822  -2.643  -8.201
  515    HE3  LYS  64           HE3      LYS  64  -0.356  -2.990  -7.293
  516    HZ1  LYS  64           HZ1      LYS  64  -1.765  -4.730  -6.110
  517    HZ2  LYS  64           HZ2      LYS  64  -1.296  -5.057  -7.699
  518    HZ3  LYS  64           HZ3      LYS  64  -2.870  -4.534  -7.378
  519    H    ASP  65           H        ASP  65  -6.455  -4.164  -3.602
  520    HA   ASP  65           HA       ASP  65  -6.675  -6.742  -4.823
  521    HB2  ASP  65           HB2      ASP  65  -5.993  -6.322  -2.436
  522    HB3  ASP  65           HB3      ASP  65  -7.663  -5.885  -2.092
  523    H    PHE  66           H        PHE  66  -8.748  -4.076  -4.454
  524    HA   PHE  66           HA       PHE  66 -11.166  -5.706  -4.876
  525    HB2  PHE  66           HB2      PHE  66 -10.930  -2.757  -4.242
  526    HB3  PHE  66           HB3      PHE  66 -12.419  -3.678  -4.328
  527    HD1  PHE  66           HD1      PHE  66 -13.396  -3.872  -2.298
  528    HD2  PHE  66           HD2      PHE  66  -9.161  -4.123  -2.538
  529    HE1  PHE  66           HE1      PHE  66 -13.283  -4.200   0.134
  530    HE2  PHE  66           HE2      PHE  66  -9.039  -4.453  -0.107
  531    HZ   PHE  66           HZ       PHE  66 -11.101  -4.476   1.233
  532    H    GLN  67           H        GLN  67  -9.421  -2.873  -6.059
  533    HA   GLN  67           HA       GLN  67 -10.430  -3.181  -8.756
  534    HB2  GLN  67           HB2      GLN  67 -11.126  -0.812  -7.011
  535    HB3  GLN  67           HB3      GLN  67 -11.140  -0.723  -8.767
  536    HG2  GLN  67           HG2      GLN  67 -12.791  -2.638  -7.133
  537    HG3  GLN  67           HG3      GLN  67 -13.366  -1.099  -7.775
  538   HE21  GLN  67          HE21      GLN  67 -14.283  -3.818  -8.302
  539   HE22  GLN  67          HE22      GLN  67 -14.170  -4.036 -10.012
  540    H    ARG  68           H        ARG  68  -9.560  -0.948  -9.940
  541    HA   ARG  68           HA       ARG  68  -6.829  -0.571  -8.937
  542    HB2  ARG  68           HB2      ARG  68  -7.241  -2.182 -11.039
  543    HB3  ARG  68           HB3      ARG  68  -7.176  -0.644 -11.886
  544    HG2  ARG  68           HG2      ARG  68  -5.039  -1.629 -10.006
  545    HG3  ARG  68           HG3      ARG  68  -4.999  -1.840 -11.754
  546    HD2  ARG  68           HD2      ARG  68  -5.280   0.878 -10.505
  547    HD3  ARG  68           HD3      ARG  68  -3.701   0.130 -10.735
  548    HE   ARG  68           HE       ARG  68  -4.802  -0.066 -13.185
  549   HH11  ARG  68          HH11      ARG  68  -4.444   2.644 -10.985
  550   HH12  ARG  68          HH12      ARG  68  -4.297   3.814 -12.256
  551   HH21  ARG  68          HH21      ARG  68  -4.585   1.469 -14.848
  552   HH22  ARG  68          HH22      ARG  68  -4.362   3.147 -14.452
  553    H    LYS  69           H        LYS  69  -7.004   1.430  -8.242
  554    HA   LYS  69           HA       LYS  69  -7.285   3.500 -10.274
  555    HB2  LYS  69           HB2      LYS  69  -9.512   3.268  -9.097
  556    HB3  LYS  69           HB3      LYS  69  -8.697   3.702  -7.604
  557    HG2  LYS  69           HG2      LYS  69  -9.829   5.626  -8.533
  558    HG3  LYS  69           HG3      LYS  69  -8.082   5.868  -8.568
  559    HD2  LYS  69           HD2      LYS  69  -9.097   6.626 -10.650
  560    HD3  LYS  69           HD3      LYS  69  -8.049   5.238 -10.943
  561    HE2  LYS  69           HE2      LYS  69 -10.051   3.780 -10.913
  562    HE3  LYS  69           HE3      LYS  69 -11.061   5.211 -10.726
  563    HZ1  LYS  69           HZ1      LYS  69 -10.885   4.401 -13.036
  564    HZ2  LYS  69           HZ2      LYS  69  -9.231   4.751 -13.017
  565    HZ3  LYS  69           HZ3      LYS  69 -10.357   5.996 -12.852
  566    H    GLY  70           H        GLY  70  -6.969   3.247  -6.736
  567    HA2  GLY  70           HA2      GLY  70  -4.583   4.867  -6.731
  568    HA3  GLY  70           HA3      GLY  70  -5.295   4.046  -5.344
  569    H    THR  71           H        THR  71  -2.492   4.148  -6.570
  570    HA   THR  71           HA       THR  71  -2.102   1.397  -7.408
  571    HB   THR  71           HB       THR  71   0.377   2.272  -7.432
  572    HG1  THR  71           HG1      THR  71  -0.424   4.751  -8.068
  573   HG21  THR  71          HG21      THR  71   0.007   3.170  -9.697
  574   HG22  THR  71          HG22      THR  71  -1.730   3.222  -9.383
  575   HG23  THR  71          HG23      THR  71  -0.884   1.673  -9.424
  576    H    HIS  72           H        HIS  72   0.058   0.455  -6.566
  577    HA   HIS  72           HA       HIS  72  -0.062   0.133  -3.701
  578    HB2  HIS  72           HB2      HIS  72   1.759  -1.469  -4.037
  579    HB3  HIS  72           HB3      HIS  72   0.496  -1.756  -5.226
  580    HD1  HIS  72           HD1      HIS  72   3.213  -2.854  -5.871
  581    HD2  HIS  72           HD2      HIS  72   2.072   0.997  -6.929
  582    HE1  HIS  72           HE1      HIS  72   4.724  -2.180  -7.763
  583    HE2  HIS  72           HE2      HIS  72   3.801   0.012  -8.567
  584    H    ILE  73           H        ILE  73   0.672   2.775  -4.975
  585    HA   ILE  73           HA       ILE  73   3.517   2.915  -4.743
  586    HB   ILE  73           HB       ILE  73   1.462   4.823  -5.740
  587   HG12  ILE  73          HG12      ILE  73   2.368   3.184  -7.267
  588   HG13  ILE  73          HG13      ILE  73   3.014   4.766  -7.696
  589   HG21  ILE  73          HG21      ILE  73   4.325   5.595  -5.349
  590   HG22  ILE  73          HG22      ILE  73   3.042   6.088  -4.248
  591   HG23  ILE  73          HG23      ILE  73   3.007   6.606  -5.935
  592   HD11  ILE  73          HD11      ILE  73   4.828   3.264  -7.831
  593   HD12  ILE  73          HD12      ILE  73   4.419   2.504  -6.298
  594   HD13  ILE  73          HD13      ILE  73   5.060   4.148  -6.317
  595    H    VAL  74           H        VAL  74   4.383   2.950  -2.992
  596    HA   VAL  74           HA       VAL  74   3.779   4.075  -0.560
  597    HB   VAL  74           HB       VAL  74   5.708   2.869  -0.356
  598   HG11  VAL  74          HG11      VAL  74   6.288   3.712  -3.190
  599   HG12  VAL  74          HG12      VAL  74   5.915   2.097  -2.577
  600   HG13  VAL  74          HG13      VAL  74   7.473   2.842  -2.221
  601   HG21  VAL  74          HG21      VAL  74   6.974   5.458  -1.265
  602   HG22  VAL  74          HG22      VAL  74   7.753   4.197  -0.304
  603   HG23  VAL  74          HG23      VAL  74   6.404   5.113   0.370
  604    H    LEU  75           H        LEU  75   4.086   6.138   0.324
  605    HA   LEU  75           HA       LEU  75   3.586   8.326  -1.279
  606    HB2  LEU  75           HB2      LEU  75   4.247   9.731   0.661
  607    HB3  LEU  75           HB3      LEU  75   3.106   8.462   1.056
  608    HG   LEU  75           HG       LEU  75   5.896   7.676   1.489
  609   HD11  LEU  75          HD11      LEU  75   6.141  10.023   2.049
  610   HD12  LEU  75          HD12      LEU  75   6.170   9.041   3.514
  611   HD13  LEU  75          HD13      LEU  75   4.718   9.947   3.087
  612   HD21  LEU  75          HD21      LEU  75   4.976   6.898   3.608
  613   HD22  LEU  75          HD22      LEU  75   3.955   6.385   2.267
  614   HD23  LEU  75          HD23      LEU  75   3.465   7.741   3.278
  615    H    TRP  76           H        TRP  76   4.824   8.805  -2.954
  616    HA   TRP  76           HA       TRP  76   7.712   8.965  -2.676
  617    HB2  TRP  76           HB2      TRP  76   5.813   8.992  -4.986
  618    HB3  TRP  76           HB3      TRP  76   7.397   9.740  -5.194
  619    HD1  TRP  76           HD1      TRP  76   5.820   6.328  -4.368
  620    HE1  TRP  76           HE1      TRP  76   7.467   4.475  -5.055
  621    HE3  TRP  76           HE3      TRP  76   9.810   9.235  -5.672
  622    HZ2  TRP  76           HZ2      TRP  76  10.095   4.271  -6.003
  623    HZ3  TRP  76           HZ3      TRP  76  11.862   8.119  -6.458
  624    HH2  TRP  76           HH2      TRP  76  11.998   5.691  -6.621
  625    H    THR  77           H        THR  77   8.543  10.704  -1.871
  626    HA   THR  77           HA       THR  77   7.459  13.325  -2.637
  627    HB   THR  77           HB       THR  77   8.350  14.129  -0.408
  628    HG1  THR  77           HG1      THR  77   8.138  11.706   0.800
  629   HG21  THR  77          HG21      THR  77   6.138  12.070  -0.357
  630   HG22  THR  77          HG22      THR  77   5.958  13.781  -0.748
  631   HG23  THR  77          HG23      THR  77   6.422  13.293   0.882
  632    H    GLY  78           H        GLY  78   9.269  15.063  -2.152
  633    HA2  GLY  78           HA2      GLY  78  11.367  14.652  -3.919
  634    HA3  GLY  78           HA3      GLY  78  11.359  15.880  -2.663
  635    H    ASP  79           H        ASP  79  11.454  14.426  -0.376
  636    HA   ASP  79           HA       ASP  79  14.148  13.706  -0.112
  637    HB2  ASP  79           HB2      ASP  79  11.812  12.870   1.626
  638    HB3  ASP  79           HB3      ASP  79  13.507  12.809   2.089
  639    H    GLN  80           H        GLN  80  11.267  11.616  -0.172
  640    HA   GLN  80           HA       GLN  80  12.615   9.177   0.062
  641    HB2  GLN  80           HB2      GLN  80  10.144   9.640   0.383
  642    HB3  GLN  80           HB3      GLN  80   9.990   9.610  -1.367
  643    HG2  GLN  80           HG2      GLN  80  11.306   7.265  -0.186
  644    HG3  GLN  80           HG3      GLN  80   9.611   7.477   0.238
  645   HE21  GLN  80          HE21      GLN  80   8.047   7.312  -1.357
  646   HE22  GLN  80          HE22      GLN  80   8.386   6.655  -2.921
  647    H    GLU  81           H        GLU  81  11.656  11.015  -2.793
  648    HA   GLU  81           HA       GLU  81  12.387   9.103  -4.733
  649    HB2  GLU  81           HB2      GLU  81  10.924  11.108  -5.095
  650    HB3  GLU  81           HB3      GLU  81  12.360  12.116  -5.007
  651    HG2  GLU  81           HG2      GLU  81  13.252  11.125  -6.996
  652    HG3  GLU  81           HG3      GLU  81  11.955   9.934  -7.035
  653    H    LEU  82           H        LEU  82  14.105  11.891  -3.393
  654    HA   LEU  82           HA       LEU  82  16.461  11.589  -4.897
  655    HB2  LEU  82           HB2      LEU  82  15.868  13.670  -3.862
  656    HB3  LEU  82           HB3      LEU  82  15.876  12.950  -2.269
  657    HG   LEU  82           HG       LEU  82  17.808  14.495  -2.894
  658   HD11  LEU  82          HD11      LEU  82  19.440  13.191  -1.666
  659   HD12  LEU  82          HD12      LEU  82  18.487  11.729  -1.919
  660   HD13  LEU  82          HD13      LEU  82  17.840  13.043  -0.933
  661   HD21  LEU  82          HD21      LEU  82  18.617  12.074  -4.489
  662   HD22  LEU  82          HD22      LEU  82  19.676  13.427  -4.094
  663   HD23  LEU  82          HD23      LEU  82  18.261  13.683  -5.113
  664    H    GLU  83           H        GLU  83  15.543  10.364  -1.686
  665    HA   GLU  83           HA       GLU  83  18.051   9.295  -1.005
  666    HB2  GLU  83           HB2      GLU  83  15.291   8.412  -0.169
  667    HB3  GLU  83           HB3      GLU  83  16.781   7.819   0.554
  668    HG2  GLU  83           HG2      GLU  83  17.316  10.221   1.113
  669    HG3  GLU  83           HG3      GLU  83  15.662  10.604   0.639
  670    H    LEU  84           H        LEU  84  15.301   7.808  -2.707
  671    HA   LEU  84           HA       LEU  84  16.606   5.276  -2.950
  672    HB2  LEU  84           HB2      LEU  84  14.182   5.432  -2.979
  673    HB3  LEU  84           HB3      LEU  84  14.232   6.425  -4.421
  674    HG   LEU  84           HG       LEU  84  14.912   4.579  -5.781
  675   HD11  LEU  84          HD11      LEU  84  15.192   3.004  -3.222
  676   HD12  LEU  84          HD12      LEU  84  16.509   3.552  -4.260
  677   HD13  LEU  84          HD13      LEU  84  15.359   2.354  -4.853
  678   HD21  LEU  84          HD21      LEU  84  13.026   3.187  -5.643
  679   HD22  LEU  84          HD22      LEU  84  12.498   4.723  -4.960
  680   HD23  LEU  84          HD23      LEU  84  12.904   3.380  -3.895
  681    H    GLN  85           H        GLN  85  16.313   8.131  -4.961
  682    HA   GLN  85           HA       GLN  85  17.352   7.226  -7.372
  683    HB2  GLN  85           HB2      GLN  85  16.421   9.549  -6.648
  684    HB3  GLN  85           HB3      GLN  85  18.080   9.903  -6.206
  685    HG2  GLN  85           HG2      GLN  85  17.117   9.155  -8.951
  686    HG3  GLN  85           HG3      GLN  85  17.501  10.783  -8.406
  687   HE21  GLN  85          HE21      GLN  85  19.708  11.267  -7.926
  688   HE22  GLN  85          HE22      GLN  85  20.982  10.355  -8.669
  689    H    ARG  86           H        ARG  86  19.143   8.848  -4.758
  690    HA   ARG  86           HA       ARG  86  21.670   8.539  -5.926
  691    HB2  ARG  86           HB2      ARG  86  20.951   8.887  -3.018
  692    HB3  ARG  86           HB3      ARG  86  22.564   9.079  -3.686
  693    HG2  ARG  86           HG2      ARG  86  21.461  10.833  -5.224
  694    HG3  ARG  86           HG3      ARG  86  20.160  10.808  -4.033
  695    HD2  ARG  86           HD2      ARG  86  21.706  12.566  -3.472
  696    HD3  ARG  86           HD3      ARG  86  21.824  11.284  -2.266
  697    HE   ARG  86           HE       ARG  86  23.724  11.136  -4.454
  698   HH11  ARG  86          HH11      ARG  86  23.114  12.155  -1.158
  699   HH12  ARG  86          HH12      ARG  86  24.795  12.310  -0.761
  700   HH21  ARG  86          HH21      ARG  86  25.949  11.330  -3.918
  701   HH22  ARG  86          HH22      ARG  86  26.399  11.829  -2.315
  702    H    LEU  87           H        LEU  87  19.976   6.549  -3.543
  703    HA   LEU  87           HA       LEU  87  22.091   4.809  -2.950
  704    HB2  LEU  87           HB2      LEU  87  19.205   4.854  -2.559
  705    HB3  LEU  87           HB3      LEU  87  19.858   3.237  -2.728
  706    HG   LEU  87           HG       LEU  87  21.480   3.782  -0.901
  707   HD11  LEU  87          HD11      LEU  87  19.721   6.198  -0.524
  708   HD12  LEU  87          HD12      LEU  87  21.397   6.222  -1.075
  709   HD13  LEU  87          HD13      LEU  87  21.010   5.665   0.554
  710   HD21  LEU  87          HD21      LEU  87  18.546   3.931  -0.282
  711   HD22  LEU  87          HD22      LEU  87  19.817   3.534   0.873
  712   HD23  LEU  87          HD23      LEU  87  19.510   2.473  -0.498
  713    H    PHE  88           H        PHE  88  19.525   4.536  -5.381
  714    HA   PHE  88           HA       PHE  88  20.196   2.030  -6.402
  715    HB2  PHE  88           HB2      PHE  88  18.161   2.800  -7.171
  716    HB3  PHE  88           HB3      PHE  88  18.753   4.428  -7.444
  717    HD1  PHE  88           HD1      PHE  88  19.811   1.091  -8.775
  718    HD2  PHE  88           HD2      PHE  88  18.407   5.017  -9.608
  719    HE1  PHE  88           HE1      PHE  88  20.008   0.646 -11.181
  720    HE2  PHE  88           HE2      PHE  88  18.585   4.573 -12.017
  721    HZ   PHE  88           HZ       PHE  88  19.397   2.396 -12.806
  722    H    GLU  89           H        GLU  89  21.601   5.196  -7.082
  723    HA   GLU  89           HA       GLU  89  23.219   4.202  -9.225
  724    HB2  GLU  89           HB2      GLU  89  23.359   6.753  -7.636
  725    HB3  GLU  89           HB3      GLU  89  24.408   6.389  -8.997
  726    HG2  GLU  89           HG2      GLU  89  22.373   6.158 -10.401
  727    HG3  GLU  89           HG3      GLU  89  21.435   6.735  -9.023
  728    H    GLU  90           H        GLU  90  23.742   4.733  -5.744
  729    HA   GLU  90           HA       GLU  90  26.601   4.424  -6.181
  730    HB2  GLU  90           HB2      GLU  90  26.862   5.155  -3.885
  731    HB3  GLU  90           HB3      GLU  90  25.839   6.254  -4.799
  732    HG2  GLU  90           HG2      GLU  90  23.871   5.359  -3.762
  733    HG3  GLU  90           HG3      GLU  90  24.830   4.139  -2.922
  734    H    PHE  91           H        PHE  91  23.955   2.575  -4.884
  735    HA   PHE  91           HA       PHE  91  25.816   0.551  -3.873
  736    HB2  PHE  91           HB2      PHE  91  22.814   0.835  -3.744
  737    HB3  PHE  91           HB3      PHE  91  23.642  -0.637  -3.246
  738    HD1  PHE  91           HD1      PHE  91  24.955  -0.696  -1.224
  739    HD2  PHE  91           HD2      PHE  91  23.024   2.887  -2.447
  740    HE1  PHE  91           HE1      PHE  91  25.330   0.258   1.010
  741    HE2  PHE  91           HE2      PHE  91  23.395   3.852  -0.211
  742    HZ   PHE  91           HZ       PHE  91  24.546   2.538   1.518
  743    H    ARG  92           H        ARG  92  25.156   1.377  -6.750
  744    HA   ARG  92           HA       ARG  92  23.833  -0.914  -7.871
  745    HB2  ARG  92           HB2      ARG  92  23.696   1.519  -8.668
  746    HB3  ARG  92           HB3      ARG  92  25.263   1.233  -9.411
  747    HG2  ARG  92           HG2      ARG  92  24.330  -0.518 -10.782
  748    HG3  ARG  92           HG3      ARG  92  22.770  -0.346  -9.988
  749    HD2  ARG  92           HD2      ARG  92  22.398   1.774 -10.913
  750    HD3  ARG  92           HD3      ARG  92  24.085   1.963 -11.371
  751    HE   ARG  92           HE       ARG  92  23.056  -0.254 -12.734
  752   HH11  ARG  92          HH11      ARG  92  22.618   3.221 -12.638
  753   HH12  ARG  92          HH12      ARG  92  22.214   3.346 -14.320
  754   HH21  ARG  92          HH21      ARG  92  22.581  -0.087 -14.956
  755   HH22  ARG  92          HH22      ARG  92  22.187   1.461 -15.639
  756    H    ASP  93           H        ASP  93  27.016  -0.229  -6.987
  757    HA   ASP  93           HA       ASP  93  28.232  -1.805  -9.101
  758    HB2  ASP  93           HB2      ASP  93  30.353  -1.268  -8.095
  759    HB3  ASP  93           HB3      ASP  93  29.383   0.197  -8.164
  760    H    SER  94           H        SER  94  26.460  -2.652  -6.563
  761    HA   SER  94           HA       SER  94  28.098  -5.008  -5.957
  762    HB2  SER  94           HB2      SER  94  26.517  -5.398  -4.070
  763    HB3  SER  94           HB3      SER  94  27.378  -3.866  -3.949
  764    HG   SER  94           HG       SER  94  25.331  -3.079  -5.125
  765    H    ASP  95           H        ASP  95  26.573  -7.017  -5.525
  766    HA   ASP  95           HA       ASP  95  25.779  -7.713  -8.136
  767    HB2  ASP  95           HB2      ASP  95  25.510  -9.183  -5.522
  768    HB3  ASP  95           HB3      ASP  95  25.078  -9.882  -7.082
  769    H    ASP  96           H        ASP  96  23.954  -6.594  -5.393
  770    HA   ASP  96           HA       ASP  96  21.579  -6.533  -7.088
  771    HB2  ASP  96           HB2      ASP  96  21.248  -8.602  -5.924
  772    HB3  ASP  96           HB3      ASP  96  21.702  -7.881  -4.389
  773    H    VAL  97           H        VAL  97  21.231  -4.427  -7.178
  774    HA   VAL  97           HA       VAL  97  22.142  -2.536  -5.303
  775    HB   VAL  97           HB       VAL  97  19.808  -1.945  -7.092
  776   HG11  VAL  97          HG11      VAL  97  20.562  -0.133  -5.709
  777   HG12  VAL  97          HG12      VAL  97  20.985   0.199  -7.395
  778   HG13  VAL  97          HG13      VAL  97  22.222  -0.356  -6.263
  779   HG21  VAL  97          HG21      VAL  97  21.127  -3.122  -8.603
  780   HG22  VAL  97          HG22      VAL  97  22.620  -2.429  -7.967
  781   HG23  VAL  97          HG23      VAL  97  21.493  -1.418  -8.875
  782    H    LEU  98           H        LEU  98  18.888  -3.743  -5.991
  783    HA   LEU  98           HA       LEU  98  17.586  -1.997  -4.227
  784    HB2  LEU  98           HB2      LEU  98  16.597  -4.632  -5.297
  785    HB3  LEU  98           HB3      LEU  98  15.606  -3.376  -4.582
  786    HG   LEU  98           HG       LEU  98  16.756  -1.963  -6.573
  787   HD11  LEU  98          HD11      LEU  98  16.689  -3.377  -8.606
  788   HD12  LEU  98          HD12      LEU  98  16.578  -4.798  -7.568
  789   HD13  LEU  98          HD13      LEU  98  18.011  -3.770  -7.507
  790   HD21  LEU  98          HD21      LEU  98  14.323  -3.720  -6.857
  791   HD22  LEU  98          HD22      LEU  98  14.681  -2.279  -7.808
  792   HD23  LEU  98          HD23      LEU  98  14.363  -2.140  -6.077
  793    H    GLY  99           H        GLY  99  19.094  -5.083  -3.715
  794    HA2  GLY  99           HA2      GLY  99  17.822  -5.752  -1.267
  795    HA3  GLY  99           HA3      GLY  99  19.390  -6.340  -1.812
  796    H    HIS 100           H        HIS 100  20.829  -4.018  -1.985
  797    HA   HIS 100           HA       HIS 100  21.378  -3.491   0.778
  798    HB2  HIS 100           HB2      HIS 100  22.546  -2.351  -1.769
  799    HB3  HIS 100           HB3      HIS 100  23.096  -1.900  -0.159
  800    HD1  HIS 100           HD1      HIS 100  24.705  -3.452   0.999
  801    HD2  HIS 100           HD2      HIS 100  23.119  -5.077  -2.481
  802    HE1  HIS 100           HE1      HIS 100  26.031  -5.539   0.564
  803    HE2  HIS 100           HE2      HIS 100  24.914  -6.607  -1.424
  804    H    ILE 101           H        ILE 101  19.723  -1.940  -1.844
  805    HA   ILE 101           HA       ILE 101  19.325   0.597  -0.790
  806    HB   ILE 101           HB       ILE 101  17.605  -1.131  -2.555
  807   HG12  ILE 101          HG12      ILE 101  19.208   1.388  -3.034
  808   HG13  ILE 101          HG13      ILE 101  19.648  -0.238  -3.539
  809   HG21  ILE 101          HG21      ILE 101  16.058   0.258  -1.309
  810   HG22  ILE 101          HG22      ILE 101  16.180   0.839  -2.970
  811   HG23  ILE 101          HG23      ILE 101  17.012   1.696  -1.673
  812   HD11  ILE 101          HD11      ILE 101  17.248   1.294  -4.513
  813   HD12  ILE 101          HD12      ILE 101  17.762  -0.299  -5.060
  814   HD13  ILE 101          HD13      ILE 101  18.769   1.109  -5.381
  815    H    MET 102           H        MET 102  17.220  -2.267  -0.453
  816    HA   MET 102           HA       MET 102  15.362  -1.081   1.270
  817    HB2  MET 102           HB2      MET 102  16.132  -3.987   1.019
  818    HB3  MET 102           HB3      MET 102  14.706  -3.389   1.862
  819    HG2  MET 102           HG2      MET 102  13.816  -2.507  -0.192
  820    HG3  MET 102           HG3      MET 102  15.274  -2.980  -1.061
  821    HE1  MET 102           HE1      MET 102  12.437  -5.379  -2.364
  822    HE2  MET 102           HE2      MET 102  13.603  -4.133  -2.809
  823    HE3  MET 102           HE3      MET 102  12.214  -3.721  -1.801
  824    H    LYS 103           H        LYS 103  18.385  -2.725   1.945
  825    HA   LYS 103           HA       LYS 103  17.905  -2.902   4.765
  826    HB2  LYS 103           HB2      LYS 103  20.168  -3.556   2.940
  827    HB3  LYS 103           HB3      LYS 103  20.512  -3.362   4.650
  828    HG2  LYS 103           HG2      LYS 103  20.134  -5.700   4.021
  829    HG3  LYS 103           HG3      LYS 103  18.970  -5.128   5.212
  830    HD2  LYS 103           HD2      LYS 103  17.276  -4.895   3.510
  831    HD3  LYS 103           HD3      LYS 103  18.443  -5.289   2.246
  832    HE2  LYS 103           HE2      LYS 103  16.966  -7.184   2.833
  833    HE3  LYS 103           HE3      LYS 103  18.671  -7.533   3.089
  834    HZ1  LYS 103           HZ1      LYS 103  17.263  -8.312   4.912
  835    HZ2  LYS 103           HZ2      LYS 103  16.769  -6.726   5.218
  836    HZ3  LYS 103           HZ3      LYS 103  18.387  -7.164   5.437
  837    H    ASN 104           H        ASN 104  19.113  -0.456   2.670
  838    HA   ASN 104           HA       ASN 104  20.394   0.925   4.924
  839    HB2  ASN 104           HB2      ASN 104  21.652   0.714   2.778
  840    HB3  ASN 104           HB3      ASN 104  20.413   1.691   1.996
  841   HD21  ASN 104          HD21      ASN 104  20.270   3.898   2.495
  842   HD22  ASN 104          HD22      ASN 104  21.556   4.744   3.276
  843    H    ILE 105           H        ILE 105  17.562   1.049   2.919
  844    HA   ILE 105           HA       ILE 105  17.175   3.888   3.423
  845    HB   ILE 105           HB       ILE 105  16.754   2.892   1.185
  846   HG12  ILE 105          HG12      ILE 105  14.438   4.033   0.934
  847   HG13  ILE 105          HG13      ILE 105  14.653   4.458   2.628
  848   HG21  ILE 105          HG21      ILE 105  15.702   0.814   1.853
  849   HG22  ILE 105          HG22      ILE 105  14.644   1.724   0.776
  850   HG23  ILE 105          HG23      ILE 105  14.331   1.703   2.513
  851   HD11  ILE 105          HD11      ILE 105  16.791   5.542   2.033
  852   HD12  ILE 105          HD12      ILE 105  15.387   6.273   1.258
  853   HD13  ILE 105          HD13      ILE 105  16.448   5.207   0.337
  854    H    THR 106           H        THR 106  15.393   4.779   4.385
  855    HA   THR 106           HA       THR 106  14.475   3.406   6.690
  856    HB   THR 106           HB       THR 106  14.988   5.904   6.336
  857    HG1  THR 106           HG1      THR 106  14.185   5.840   8.291
  858   HG21  THR 106          HG21      THR 106  12.118   5.838   5.403
  859   HG22  THR 106          HG22      THR 106  13.520   6.358   4.469
  860   HG23  THR 106          HG23      THR 106  12.991   7.296   5.867
  861    H    ALA 107           H        ALA 107  13.155   3.965   3.512
  862    HA   ALA 107           HA       ALA 107  10.466   3.228   4.343
  863    HB1  ALA 107           HB1      ALA 107   9.832   3.699   2.038
  864    HB2  ALA 107           HB2      ALA 107  11.529   3.908   1.602
  865    HB3  ALA 107           HB3      ALA 107  10.758   5.042   2.713
  866    H    LYS 108           H        LYS 108   9.698   1.219   4.232
  867    HA   LYS 108           HA       LYS 108  11.295  -0.823   2.910
  868    HB2  LYS 108           HB2      LYS 108   8.791  -1.065   4.584
  869    HB3  LYS 108           HB3      LYS 108   9.716  -2.416   3.948
  870    HG2  LYS 108           HG2      LYS 108  10.832  -0.367   5.851
  871    HG3  LYS 108           HG3      LYS 108  10.123  -1.897   6.354
  872    HD2  LYS 108           HD2      LYS 108  12.284  -2.570   6.268
  873    HD3  LYS 108           HD3      LYS 108  11.887  -2.819   4.571
  874    HE2  LYS 108           HE2      LYS 108  14.020  -1.668   4.808
  875    HE3  LYS 108           HE3      LYS 108  12.840  -0.625   4.026
  876    HZ1  LYS 108           HZ1      LYS 108  14.078   0.600   5.667
  877    HZ2  LYS 108           HZ2      LYS 108  13.670  -0.514   6.870
  878    HZ3  LYS 108           HZ3      LYS 108  12.469   0.458   6.184
  879    H    ARG 109           H        ARG 109  11.058  -0.832   0.831
  880    HA   ARG 109           HA       ARG 109   8.346  -0.753  -0.314
  881    HB2  ARG 109           HB2      ARG 109  10.954   0.159  -1.555
  882    HB3  ARG 109           HB3      ARG 109   9.386   0.183  -2.348
  883    HG2  ARG 109           HG2      ARG 109   8.588   1.894  -0.938
  884    HG3  ARG 109           HG3      ARG 109   9.939   1.703   0.181
  885    HD2  ARG 109           HD2      ARG 109  10.231   2.583  -2.686
  886    HD3  ARG 109           HD3      ARG 109  10.113   3.696  -1.323
  887    HE   ARG 109           HE       ARG 109  12.213   1.665  -1.247
  888   HH11  ARG 109          HH11      ARG 109  11.363   5.017  -1.809
  889   HH12  ARG 109          HH12      ARG 109  12.979   5.591  -1.592
  890   HH21  ARG 109          HH21      ARG 109  14.348   2.425  -0.974
  891   HH22  ARG 109          HH22      ARG 109  14.678   4.119  -1.110
  892    H    SER 110           H        SER 110   7.894  -2.246  -1.922
  893    HA   SER 110           HA       SER 110   9.551  -4.617  -1.878
  894    HB2  SER 110           HB2      SER 110   7.099  -4.826  -1.704
  895    HB3  SER 110           HB3      SER 110   6.923  -4.084  -3.294
  896    HG   SER 110           HG       SER 110   7.324  -6.641  -2.705
  897    H    ARG 111           H        ARG 111  10.130  -5.718  -3.911
  898    HA   ARG 111           HA       ARG 111  11.674  -4.126  -5.598
  899    HB2  ARG 111           HB2      ARG 111  10.526  -6.878  -6.099
  900    HB3  ARG 111           HB3      ARG 111  11.773  -6.129  -7.083
  901    HG2  ARG 111           HG2      ARG 111  12.065  -6.670  -4.139
  902    HG3  ARG 111           HG3      ARG 111  12.613  -7.766  -5.408
  903    HD2  ARG 111           HD2      ARG 111  14.144  -6.134  -6.246
  904    HD3  ARG 111           HD3      ARG 111  13.495  -4.900  -5.170
  905    HE   ARG 111           HE       ARG 111  14.397  -6.258  -3.310
  906   HH11  ARG 111          HH11      ARG 111  15.754  -6.606  -6.523
  907   HH12  ARG 111          HH12      ARG 111  17.304  -7.155  -5.942
  908   HH21  ARG 111          HH21      ARG 111  16.396  -7.057  -2.562
  909   HH22  ARG 111          HH22      ARG 111  17.660  -7.421  -3.706
  910    H    ALA 112           H        ALA 112   8.412  -5.383  -6.004
  911    HA   ALA 112           HA       ALA 112   7.976  -4.625  -8.655
  912    HB1  ALA 112           HB1      ALA 112   5.977  -4.803  -6.404
  913    HB2  ALA 112           HB2      ALA 112   6.501  -6.136  -7.433
  914    HB3  ALA 112           HB3      ALA 112   5.596  -4.790  -8.124
  915    H    ARG 113           H        ARG 113   7.695  -2.769  -5.665
  916    HA   ARG 113           HA       ARG 113   6.379  -0.548  -6.907
  917    HB2  ARG 113           HB2      ARG 113   7.913  -0.566  -4.308
  918    HB3  ARG 113           HB3      ARG 113   6.757   0.648  -4.834
  919    HG2  ARG 113           HG2      ARG 113   5.029  -1.213  -4.819
  920    HG3  ARG 113           HG3      ARG 113   6.233  -2.168  -3.944
  921    HD2  ARG 113           HD2      ARG 113   6.404  -0.101  -2.405
  922    HD3  ARG 113           HD3      ARG 113   4.860   0.361  -3.115
  923    HE   ARG 113           HE       ARG 113   4.886  -2.329  -2.082
  924   HH11  ARG 113          HH11      ARG 113   4.283   1.046  -1.343
  925   HH12  ARG 113          HH12      ARG 113   3.345   0.705   0.070
  926   HH21  ARG 113          HH21      ARG 113   3.658  -2.770  -0.201
  927   HH22  ARG 113          HH22      ARG 113   2.987  -1.458   0.719
  928    H    ILE 114           H        ILE 114   9.700  -1.393  -6.112
  929    HA   ILE 114           HA       ILE 114  10.700   1.240  -6.566
  930    HB   ILE 114           HB       ILE 114  12.171  -1.385  -6.312
  931   HG12  ILE 114          HG12      ILE 114  11.803   0.891  -4.353
  932   HG13  ILE 114          HG13      ILE 114  10.920  -0.630  -4.301
  933   HG21  ILE 114          HG21      ILE 114  13.520   0.187  -7.572
  934   HG22  ILE 114          HG22      ILE 114  14.179   0.001  -5.946
  935   HG23  ILE 114          HG23      ILE 114  13.241   1.433  -6.358
  936   HD11  ILE 114          HD11      ILE 114  13.889  -0.286  -3.973
  937   HD12  ILE 114          HD12      ILE 114  13.027  -1.827  -3.933
  938   HD13  ILE 114          HD13      ILE 114  12.727  -0.610  -2.690
  939    H    VAL 115           H        VAL 115  10.930  -1.824  -8.405
  940    HA   VAL 115           HA       VAL 115  12.485  -0.728 -10.486
  941    HB   VAL 115           HB       VAL 115  11.991  -2.709 -11.783
  942   HG11  VAL 115          HG11      VAL 115  13.606  -2.923  -9.964
  943   HG12  VAL 115          HG12      VAL 115  12.729  -4.432 -10.215
  944   HG13  VAL 115          HG13      VAL 115  12.309  -3.384  -8.861
  945   HG21  VAL 115          HG21      VAL 115   9.595  -2.882 -11.387
  946   HG22  VAL 115          HG22      VAL 115   9.896  -3.354  -9.715
  947   HG23  VAL 115          HG23      VAL 115  10.407  -4.407 -11.034
  948    H    ASP 116           H        ASP 116   9.017  -1.021 -10.030
  949    HA   ASP 116           HA       ASP 116   8.117  -0.172 -12.532
  950    HB2  ASP 116           HB2      ASP 116   6.565  -1.056 -10.968
  951    HB3  ASP 116           HB3      ASP 116   7.004   0.121  -9.740
  952    H    LYS 117           H        LYS 117   9.179   1.648  -9.713
  953    HA   LYS 117           HA       LYS 117   8.387   4.150 -10.877
  954    HB2  LYS 117           HB2      LYS 117   9.631   3.321  -8.290
  955    HB3  LYS 117           HB3      LYS 117   9.681   5.013  -8.777
  956    HG2  LYS 117           HG2      LYS 117   7.106   3.488  -8.806
  957    HG3  LYS 117           HG3      LYS 117   7.727   4.198  -7.313
  958    HD2  LYS 117           HD2      LYS 117   7.275   6.298  -7.965
  959    HD3  LYS 117           HD3      LYS 117   7.744   5.993  -9.643
  960    HE2  LYS 117           HE2      LYS 117   5.151   5.123  -8.369
  961    HE3  LYS 117           HE3      LYS 117   5.349   6.544  -9.387
  962    HZ1  LYS 117           HZ1      LYS 117   5.800   3.723 -10.246
  963    HZ2  LYS 117           HZ2      LYS 117   5.989   5.099 -11.217
  964    HZ3  LYS 117           HZ3      LYS 117   4.462   4.685 -10.638
  965    H    LEU 118           H        LEU 118  11.395   2.336 -10.598
  966    HA   LEU 118           HA       LEU 118  13.122   4.431 -11.359
  967    HB2  LEU 118           HB2      LEU 118  13.331   1.473 -11.860
  968    HB3  LEU 118           HB3      LEU 118  14.591   2.613 -12.284
  969    HG   LEU 118           HG       LEU 118  13.747   1.629  -9.602
  970   HD11  LEU 118          HD11      LEU 118  15.652   0.647 -10.716
  971   HD12  LEU 118          HD12      LEU 118  16.185   1.565  -9.307
  972   HD13  LEU 118          HD13      LEU 118  16.380   2.240 -10.927
  973   HD21  LEU 118          HD21      LEU 118  15.102   4.282 -10.069
  974   HD22  LEU 118          HD22      LEU 118  14.911   3.482  -8.509
  975   HD23  LEU 118          HD23      LEU 118  13.491   4.048  -9.390
  976    H    LEU 119           H        LEU 119  11.249   2.138 -13.277
  977    HA   LEU 119           HA       LEU 119  12.183   3.036 -15.807
  978    HB2  LEU 119           HB2      LEU 119   9.830   1.433 -14.874
  979    HB3  LEU 119           HB3      LEU 119   9.895   1.990 -16.533
  980    HG   LEU 119           HG       LEU 119  10.676  -0.315 -16.355
  981   HD11  LEU 119          HD11      LEU 119  11.608   1.120 -18.090
  982   HD12  LEU 119          HD12      LEU 119  12.784  -0.073 -17.540
  983   HD13  LEU 119          HD13      LEU 119  12.909   1.599 -17.001
  984   HD21  LEU 119          HD21      LEU 119  12.854   0.783 -14.574
  985   HD22  LEU 119          HD22      LEU 119  12.768  -0.863 -15.204
  986   HD23  LEU 119          HD23      LEU 119  11.536  -0.285 -14.075
  987    H    ALA 120           H        ALA 120   9.822   4.165 -13.579
  988    HA   ALA 120           HA       ALA 120   8.392   5.754 -15.525
  989    HB1  ALA 120           HB1      ALA 120   8.153   5.726 -12.522
  990    HB2  ALA 120           HB2      ALA 120   7.266   4.670 -13.621
  991    HB3  ALA 120           HB3      ALA 120   7.002   6.416 -13.668
  992    H    LEU 121           H        LEU 121  10.554   6.357 -12.762
  993    HA   LEU 121           HA       LEU 121  10.733   9.155 -13.038
  994    HB2  LEU 121           HB2      LEU 121  12.413   7.027 -11.797
  995    HB3  LEU 121           HB3      LEU 121  13.108   8.618 -12.006
  996    HG   LEU 121           HG       LEU 121  11.407   9.592 -10.587
  997   HD11  LEU 121          HD11      LEU 121  10.313   6.800 -10.315
  998   HD12  LEU 121          HD12      LEU 121   9.514   8.166 -11.095
  999   HD13  LEU 121          HD13      LEU 121   9.816   8.196  -9.357
 1000   HD21  LEU 121          HD21      LEU 121  12.762   7.160  -9.444
 1001   HD22  LEU 121          HD22      LEU 121  12.048   8.455  -8.482
 1002   HD23  LEU 121          HD23      LEU 121  13.414   8.795  -9.544
 1003    H    GLY 122           H        GLY 122  12.097   6.552 -14.818
 1004    HA2  GLY 122           HA2      GLY 122  13.436   6.554 -16.695
 1005    HA3  GLY 122           HA3      GLY 122  13.476   8.312 -16.624
 1006    H    LEU 123           H        LEU 123  14.321   6.210 -13.959
 1007    HA   LEU 123           HA       LEU 123  16.980   7.352 -13.861
 1008    HB2  LEU 123           HB2      LEU 123  15.567   5.345 -12.108
 1009    HB3  LEU 123           HB3      LEU 123  17.212   5.887 -11.833
 1010    HG   LEU 123           HG       LEU 123  14.699   7.536 -11.663
 1011   HD11  LEU 123          HD11      LEU 123  16.779   6.745  -9.635
 1012   HD12  LEU 123          HD12      LEU 123  15.109   6.183  -9.715
 1013   HD13  LEU 123          HD13      LEU 123  15.454   7.870  -9.341
 1014   HD21  LEU 123          HD21      LEU 123  16.190   9.405 -11.024
 1015   HD22  LEU 123          HD22      LEU 123  16.376   8.913 -12.706
 1016   HD23  LEU 123          HD23      LEU 123  17.575   8.426 -11.508
 1017    H    VAL 124           H        VAL 124  15.396   4.652 -15.125
 1018    HA   VAL 124           HA       VAL 124  17.897   3.710 -16.227
 1019    HB   VAL 124           HB       VAL 124  17.209   2.413 -14.115
 1020   HG11  VAL 124          HG11      VAL 124  15.781   0.418 -14.657
 1021   HG12  VAL 124          HG12      VAL 124  15.228   1.351 -16.049
 1022   HG13  VAL 124          HG13      VAL 124  14.961   1.959 -14.417
 1023   HG21  VAL 124          HG21      VAL 124  17.738   0.526 -16.271
 1024   HG22  VAL 124          HG22      VAL 124  18.546   0.747 -14.719
 1025   HG23  VAL 124          HG23      VAL 124  18.859   1.862 -16.047
 1026    H    ALA 125           H        ALA 125  17.249   1.762 -17.651
 1027    HA   ALA 125           HA       ALA 125  14.922   2.594 -19.272
 1028    HB1  ALA 125           HB1      ALA 125  17.511   1.428 -20.294
 1029    HB2  ALA 125           HB2      ALA 125  17.068   3.133 -20.356
 1030    HB3  ALA 125           HB3      ALA 125  16.136   1.949 -21.271
 1031    H    GLU 126           H        GLU 126  16.075   0.230 -17.309
 1032    HA   GLU 126           HA       GLU 126  14.403  -1.875 -18.192
 1033    HB2  GLU 126           HB2      GLU 126  16.284  -3.399 -18.954
 1034    HB3  GLU 126           HB3      GLU 126  15.886  -2.089 -20.063
 1035    HG2  GLU 126           HG2      GLU 126  17.748  -0.807 -18.790
 1036    HG3  GLU 126           HG3      GLU 126  18.260  -2.412 -18.293
 1037    H    ARG 127           H        ARG 127  14.494  -3.673 -16.748
 1038    HA   ARG 127           HA       ARG 127  15.350  -2.913 -14.143
 1039    HB2  ARG 127           HB2      ARG 127  14.165  -5.476 -15.199
 1040    HB3  ARG 127           HB3      ARG 127  14.548  -5.220 -13.501
 1041    HG2  ARG 127           HG2      ARG 127  13.027  -3.272 -13.492
 1042    HG3  ARG 127           HG3      ARG 127  12.590  -3.647 -15.160
 1043    HD2  ARG 127           HD2      ARG 127  12.236  -5.498 -12.810
 1044    HD3  ARG 127           HD3      ARG 127  10.963  -4.499 -13.506
 1045    HE   ARG 127           HE       ARG 127  12.260  -6.798 -14.813
 1046   HH11  ARG 127          HH11      ARG 127   9.634  -4.496 -14.602
 1047   HH12  ARG 127          HH12      ARG 127   8.654  -5.313 -15.770
 1048   HH21  ARG 127          HH21      ARG 127  10.949  -7.893 -16.349
 1049   HH22  ARG 127          HH22      ARG 127   9.400  -7.235 -16.763
 1050    H    ARG 128           H        ARG 128  16.689  -4.955 -16.604
 1051    HA   ARG 128           HA       ARG 128  18.463  -6.451 -15.017
 1052    HB2  ARG 128           HB2      ARG 128  19.647  -6.889 -17.140
 1053    HB3  ARG 128           HB3      ARG 128  17.907  -7.127 -17.257
 1054    HG2  ARG 128           HG2      ARG 128  17.782  -4.781 -18.195
 1055    HG3  ARG 128           HG3      ARG 128  19.539  -4.845 -18.316
 1056    HD2  ARG 128           HD2      ARG 128  19.476  -6.596 -19.867
 1057    HD3  ARG 128           HD3      ARG 128  17.781  -6.950 -19.524
 1058    HE   ARG 128           HE       ARG 128  18.708  -4.492 -20.878
 1059   HH11  ARG 128          HH11      ARG 128  16.342  -7.035 -20.406
 1060   HH12  ARG 128          HH12      ARG 128  15.312  -6.495 -21.692
 1061   HH21  ARG 128          HH21      ARG 128  17.348  -3.763 -22.563
 1062   HH22  ARG 128          HH22      ARG 128  15.885  -4.620 -22.918
 1063    H    GLU 129           H        GLU 129  18.535  -3.156 -15.612
 1064    HA   GLU 129           HA       GLU 129  21.433  -2.924 -15.505
 1065    HB2  GLU 129           HB2      GLU 129  19.205  -0.915 -15.671
 1066    HB3  GLU 129           HB3      GLU 129  20.896  -0.455 -15.512
 1067    HG2  GLU 129           HG2      GLU 129  19.993  -2.284 -17.687
 1068    HG3  GLU 129           HG3      GLU 129  19.825  -0.537 -17.843
 1069    H    LEU 130           H        LEU 130  18.704  -2.815 -13.419
 1070    HA   LEU 130           HA       LEU 130  20.290  -1.739 -11.215
 1071    HB2  LEU 130           HB2      LEU 130  17.952  -2.158 -10.033
 1072    HB3  LEU 130           HB3      LEU 130  18.272  -0.719 -10.977
 1073    HG   LEU 130           HG       LEU 130  17.107  -3.015 -12.445
 1074   HD11  LEU 130          HD11      LEU 130  15.810  -3.120 -10.425
 1075   HD12  LEU 130          HD12      LEU 130  14.845  -2.396 -11.713
 1076   HD13  LEU 130          HD13      LEU 130  15.554  -1.377 -10.461
 1077   HD21  LEU 130          HD21      LEU 130  17.520  -0.994 -13.650
 1078   HD22  LEU 130          HD22      LEU 130  16.703  -0.028 -12.420
 1079   HD23  LEU 130          HD23      LEU 130  15.775  -1.139 -13.429
 1080    H    TYR 131           H        TYR 131  20.144  -4.512 -12.657
 1081    HA   TYR 131           HA       TYR 131  20.673  -5.988 -10.175
 1082    HB2  TYR 131           HB2      TYR 131  19.307  -7.054 -12.661
 1083    HB3  TYR 131           HB3      TYR 131  19.903  -8.065 -11.353
 1084    HD1  TYR 131           HD1      TYR 131  18.892  -7.714  -9.031
 1085    HD2  TYR 131           HD2      TYR 131  17.159  -6.142 -12.582
 1086    HE1  TYR 131           HE1      TYR 131  16.736  -7.497  -7.877
 1087    HE2  TYR 131           HE2      TYR 131  14.998  -5.915 -11.438
 1088    HH   TYR 131           HH       TYR 131  13.829  -6.894  -9.521
 1089    H    LYS 132           H        LYS 132  22.816  -6.233 -10.157
 1090    HA   LYS 132           HA       LYS 132  24.433  -6.170 -12.481
 1091    HB2  LYS 132           HB2      LYS 132  25.319  -5.492 -10.332
 1092    HB3  LYS 132           HB3      LYS 132  25.016  -7.088  -9.667
 1093    HG2  LYS 132           HG2      LYS 132  26.722  -8.049 -11.066
 1094    HG3  LYS 132           HG3      LYS 132  26.955  -6.510 -11.896
 1095    HD2  LYS 132           HD2      LYS 132  27.841  -5.489  -9.944
 1096    HD3  LYS 132           HD3      LYS 132  27.343  -6.843  -8.930
 1097    HE2  LYS 132           HE2      LYS 132  29.373  -7.028 -11.144
 1098    HE3  LYS 132           HE3      LYS 132  29.772  -6.798  -9.443
 1099    HZ1  LYS 132           HZ1      LYS 132  28.594  -8.913  -8.979
 1100    HZ2  LYS 132           HZ2      LYS 132  29.952  -9.105  -9.972
 1101    HZ3  LYS 132           HZ3      LYS 132  28.403  -9.140 -10.647
 1102    H    LYS 133           H        LYS 133  24.004  -7.665 -13.963
 1103    HA   LYS 133           HA       LYS 133  23.932 -10.496 -13.160
 1104    HB2  LYS 133           HB2      LYS 133  21.695  -9.246 -13.661
 1105    HB3  LYS 133           HB3      LYS 133  22.190  -9.383 -15.336
 1106    HG2  LYS 133           HG2      LYS 133  20.727 -11.183 -14.893
 1107    HG3  LYS 133           HG3      LYS 133  22.353 -11.863 -14.976
 1108    HD2  LYS 133           HD2      LYS 133  22.487 -11.996 -12.589
 1109    HD3  LYS 133           HD3      LYS 133  20.979 -11.099 -12.404
 1110    HE2  LYS 133           HE2      LYS 133  19.780 -12.931 -13.524
 1111    HE3  LYS 133           HE3      LYS 133  21.292 -13.830 -13.641
 1112    HZ1  LYS 133           HZ1      LYS 133  19.961 -14.535 -11.749
 1113    HZ2  LYS 133           HZ2      LYS 133  20.000 -12.970 -11.110
 1114    HZ3  LYS 133           HZ3      LYS 133  21.429 -13.868 -11.243
 1115    H    ARG 134           H        ARG 134  24.503 -11.974 -14.881
 1116    HA   ARG 134           HA       ARG 134  26.272 -10.732 -16.847
 1117    HB2  ARG 134           HB2      ARG 134  25.963 -13.679 -16.288
 1118    HB3  ARG 134           HB3      ARG 134  27.271 -12.884 -17.150
 1119    HG2  ARG 134           HG2      ARG 134  26.694 -12.867 -14.205
 1120    HG3  ARG 134           HG3      ARG 134  28.143 -13.427 -15.038
 1121    HD2  ARG 134           HD2      ARG 134  28.514 -11.046 -15.764
 1122    HD3  ARG 134           HD3      ARG 134  27.193 -10.590 -14.681
 1123    HE   ARG 134           HE       ARG 134  29.007 -12.093 -13.189
 1124   HH11  ARG 134          HH11      ARG 134  28.901  -9.016 -14.859
 1125   HH12  ARG 134          HH12      ARG 134  30.131  -8.290 -13.868
 1126   HH21  ARG 134          HH21      ARG 134  30.609 -11.138 -11.872
 1127   HH22  ARG 134          HH22      ARG 134  31.100  -9.498 -12.174
 1128    H    GLN 135           H        GLN 135  24.883  -9.968 -18.361
 1129    HA   GLN 135           HA       GLN 135  22.740 -11.551 -19.424
 1130    HB2  GLN 135           HB2      GLN 135  23.925  -8.913 -20.310
 1131    HB3  GLN 135           HB3      GLN 135  22.548  -9.672 -21.091
 1132    HG2  GLN 135           HG2      GLN 135  21.173  -9.383 -19.191
 1133    HG3  GLN 135           HG3      GLN 135  22.560  -8.971 -18.167
 1134   HE21  GLN 135          HE21      GLN 135  21.781  -6.982 -17.541
 1135   HE22  GLN 135          HE22      GLN 135  21.618  -5.640 -18.622
 1136    H    LYS 136           H        LYS 136  22.631 -12.567 -21.375
 1137    HA   LYS 136           HA       LYS 136  25.170 -13.370 -22.551
 1138    HB2  LYS 136           HB2      LYS 136  22.612 -14.327 -23.726
 1139    HB3  LYS 136           HB3      LYS 136  24.076 -15.223 -23.363
 1140    HG2  LYS 136           HG2      LYS 136  21.935 -14.418 -21.400
 1141    HG3  LYS 136           HG3      LYS 136  22.227 -16.028 -22.042
 1142    HD2  LYS 136           HD2      LYS 136  24.396 -16.100 -20.941
 1143    HD3  LYS 136           HD3      LYS 136  24.158 -14.457 -20.335
 1144    HE2  LYS 136           HE2      LYS 136  22.150 -15.234 -19.119
 1145    HE3  LYS 136           HE3      LYS 136  22.479 -16.875 -19.667
 1146    HZ1  LYS 136           HZ1      LYS 136  24.315 -15.251 -17.995
 1147    HZ2  LYS 136           HZ2      LYS 136  24.543 -16.863 -18.460
 1148    HZ3  LYS 136           HZ3      LYS 136  23.281 -16.456 -17.414
 1149    H    LYS 137           H        LYS 137  23.906 -13.824 -25.229
 1150    HA   LYS 137           HA       LYS 137  24.012 -11.355 -26.526
 1151    HB2  LYS 137           HB2      LYS 137  23.921 -13.601 -27.643
 1152    HB3  LYS 137           HB3      LYS 137  22.233 -13.724 -27.193
 1153    HG2  LYS 137           HG2      LYS 137  23.222 -11.472 -28.904
 1154    HG3  LYS 137           HG3      LYS 137  22.817 -13.046 -29.589
 1155    HD2  LYS 137           HD2      LYS 137  20.567 -12.783 -28.399
 1156    HD3  LYS 137           HD3      LYS 137  21.016 -11.091 -28.183
 1157    HE2  LYS 137           HE2      LYS 137  20.664 -12.577 -30.780
 1158    HE3  LYS 137           HE3      LYS 137  19.655 -11.283 -30.142
 1159    HZ1  LYS 137           HZ1      LYS 137  22.469 -11.042 -31.057
 1160    HZ2  LYS 137           HZ2      LYS 137  21.585  -9.795 -30.336
 1161    HZ3  LYS 137           HZ3      LYS 137  21.098 -10.420 -31.825
 1162    H    LEU 138           H        LEU 138  22.327  -9.849 -27.041
 1163    HA   LEU 138           HA       LEU 138  20.991  -8.925 -24.867
 1164    HB2  LEU 138           HB2      LEU 138  21.406  -7.628 -26.900
 1165    HB3  LEU 138           HB3      LEU 138  20.169  -8.546 -27.740
 1166    HG   LEU 138           HG       LEU 138  18.460  -7.630 -26.216
 1167   HD11  LEU 138          HD11      LEU 138  19.047  -5.739 -24.759
 1168   HD12  LEU 138          HD12      LEU 138  20.753  -6.020 -25.106
 1169   HD13  LEU 138          HD13      LEU 138  19.813  -7.242 -24.250
 1170   HD21  LEU 138          HD21      LEU 138  18.451  -5.374 -27.111
 1171   HD22  LEU 138          HD22      LEU 138  18.943  -6.530 -28.348
 1172   HD23  LEU 138          HD23      LEU 138  20.152  -5.524 -27.550
 1173    H    ALA 139           H        ALA 139  19.675 -10.057 -23.664
 1174    HA   ALA 139           HA       ALA 139  17.249 -11.198 -24.877
 1175    HB1  ALA 139           HB1      ALA 139  18.784 -12.963 -24.079
 1176    HB2  ALA 139           HB2      ALA 139  17.274 -12.931 -23.171
 1177    HB3  ALA 139           HB3      ALA 139  18.738 -12.247 -22.464
 1178    H    SER 140           H        SER 140  15.489 -11.421 -23.105
 1179    HA   SER 140           HA       SER 140  15.324  -8.849 -21.792
 1180    HB2  SER 140           HB2      SER 140  13.016  -9.602 -21.186
 1181    HB3  SER 140           HB3      SER 140  13.332  -9.626 -22.921
 1182    HG   SER 140           HG       SER 140  13.836 -11.953 -21.450
 1183    H    SER 141           H        SER 141  17.106  -9.247 -20.324
 1184    HA   SER 141           HA       SER 141  16.531 -11.017 -18.103
 1185    HB2  SER 141           HB2      SER 141  18.863 -10.678 -18.944
 1186    HB3  SER 141           HB3      SER 141  18.762  -8.991 -18.438
 1187    HG   SER 141           HG       SER 141  18.210  -9.977 -16.282
  Start of MODEL    6
    1    H1   ASP   1           HT1      ASP   1 -22.338  12.032 -11.137
    2    H2   ASP   1           HT2      ASP   1 -20.893  11.157 -11.165
    3    H3   ASP   1           HT3      ASP   1 -21.086  12.437 -10.079
    4    HA   ASP   1           HA       ASP   1 -21.293  10.275  -9.007
    5    HB2  ASP   1           HB2      ASP   1 -23.505  10.758  -7.908
    6    HB3  ASP   1           HB3      ASP   1 -22.407  12.131  -7.962
    7    HA   PRO   2           HA       PRO   2 -23.367   7.046 -11.207
    8    HB2  PRO   2           HB2      PRO   2 -24.087   5.434  -9.125
    9    HB3  PRO   2           HB3      PRO   2 -22.443   5.529  -9.764
   10    HG2  PRO   2           HG2      PRO   2 -23.620   6.865  -7.357
   11    HG3  PRO   2           HG3      PRO   2 -22.036   6.090  -7.543
   12    HD2  PRO   2           HD2      PRO   2 -22.351   8.769  -7.630
   13    HD3  PRO   2           HD3      PRO   2 -21.123   7.930  -8.598
   14    H    SER   3           H        SER   3 -24.988   8.221  -8.287
   15    HA   SER   3           HA       SER   3 -27.502   8.359  -9.779
   16    HB2  SER   3           HB2      SER   3 -27.568   6.298  -8.389
   17    HB3  SER   3           HB3      SER   3 -27.245   7.273  -6.956
   18    HG   SER   3           HG       SER   3 -29.572   7.017  -8.463
   19    H    ARG   4           H        ARG   4 -26.030   9.063  -6.631
   20    HA   ARG   4           HA       ARG   4 -26.252  11.907  -7.141
   21    HB2  ARG   4           HB2      ARG   4 -27.530  10.539  -4.770
   22    HB3  ARG   4           HB3      ARG   4 -27.054  12.232  -4.721
   23    HG2  ARG   4           HG2      ARG   4 -28.524  12.680  -6.637
   24    HG3  ARG   4           HG3      ARG   4 -29.026  10.991  -6.629
   25    HD2  ARG   4           HD2      ARG   4 -30.002  11.242  -4.444
   26    HD3  ARG   4           HD3      ARG   4 -29.376  12.885  -4.311
   27    HE   ARG   4           HE       ARG   4 -31.008  12.615  -6.616
   28   HH11  ARG   4          HH11      ARG   4 -31.204  12.888  -3.133
   29   HH12  ARG   4          HH12      ARG   4 -32.759  13.648  -3.149
   30   HH21  ARG   4          HH21      ARG   4 -33.055  13.606  -6.648
   31   HH22  ARG   4          HH22      ARG   4 -33.821  14.052  -5.156
   32    H    ARG   5           H        ARG   5 -24.901  13.125  -5.505
   33    HA   ARG   5           HA       ARG   5 -22.384  11.869  -5.291
   34    HB2  ARG   5           HB2      ARG   5 -21.680  13.882  -4.049
   35    HB3  ARG   5           HB3      ARG   5 -22.514  14.266  -5.544
   36    HG2  ARG   5           HG2      ARG   5 -23.387  15.799  -4.061
   37    HG3  ARG   5           HG3      ARG   5 -24.602  14.523  -4.049
   38    HD2  ARG   5           HD2      ARG   5 -23.703  13.637  -1.984
   39    HD3  ARG   5           HD3      ARG   5 -22.393  14.816  -2.019
   40    HE   ARG   5           HE       ARG   5 -24.927  16.100  -2.085
   41   HH11  ARG   5          HH11      ARG   5 -22.702  14.464   0.067
   42   HH12  ARG   5          HH12      ARG   5 -23.236  15.317   1.479
   43   HH21  ARG   5          HH21      ARG   5 -25.636  17.232  -0.239
   44   HH22  ARG   5          HH22      ARG   5 -24.912  16.896   1.302
   45    H    ALA   6           H        ALA   6 -21.139  11.562  -3.285
   46    HA   ALA   6           HA       ALA   6 -22.678   9.817  -1.603
   47    HB1  ALA   6           HB1      ALA   6 -19.747  10.484  -1.523
   48    HB2  ALA   6           HB2      ALA   6 -20.486   9.123  -2.368
   49    HB3  ALA   6           HB3      ALA   6 -20.543   9.204  -0.605
   50    HA   PRO   7           HA       PRO   7 -23.120  12.691   1.851
   51    HB2  PRO   7           HB2      PRO   7 -24.275  10.285   3.068
   52    HB3  PRO   7           HB3      PRO   7 -25.017  11.872   2.825
   53    HG2  PRO   7           HG2      PRO   7 -25.785   9.724   1.417
   54    HG3  PRO   7           HG3      PRO   7 -25.733  11.342   0.688
   55    HD2  PRO   7           HD2      PRO   7 -23.765   9.092   0.454
   56    HD3  PRO   7           HD3      PRO   7 -24.388  10.181  -0.804
   57    H    THR   8           H        THR   8 -22.768  12.125   4.303
   58    HA   THR   8           HA       THR   8 -20.218  10.737   4.550
   59    HB   THR   8           HB       THR   8 -21.747  12.145   6.742
   60    HG1  THR   8           HG1      THR   8 -20.749  13.229   4.520
   61   HG21  THR   8          HG21      THR   8 -19.867  10.730   7.449
   62   HG22  THR   8          HG22      THR   8 -19.521  12.438   7.722
   63   HG23  THR   8          HG23      THR   8 -18.798  11.601   6.347
   64    H    TRP   9           H        TRP   9 -20.014   8.750   5.464
   65    HA   TRP   9           HA       TRP   9 -22.328   7.153   5.889
   66    HB2  TRP   9           HB2      TRP   9 -19.414   6.653   6.492
   67    HB3  TRP   9           HB3      TRP   9 -20.672   5.453   6.728
   68    HD1  TRP   9           HD1      TRP   9 -19.481   7.653   3.736
   69    HE1  TRP   9           HE1      TRP   9 -19.460   6.146   1.648
   70    HE3  TRP   9           HE3      TRP   9 -21.214   3.329   5.836
   71    HZ2  TRP   9           HZ2      TRP   9 -20.067   3.478   0.993
   72    HZ3  TRP   9           HZ3      TRP   9 -21.474   1.345   4.405
   73    HH2  TRP   9           HH2      TRP   9 -20.917   1.423   2.030
   74    H    SER  10           H        SER  10 -23.223   6.368   7.763
   75    HA   SER  10           HA       SER  10 -22.640   7.816  10.216
   76    HB2  SER  10           HB2      SER  10 -24.680   5.632   9.708
   77    HB3  SER  10           HB3      SER  10 -24.639   6.732  11.087
   78    HG   SER  10           HG       SER  10 -25.382   7.217   8.427
   79    HA   PRO  11           HA       PRO  11 -19.907   4.937  12.196
   80    HB2  PRO  11           HB2      PRO  11 -21.895   4.894  14.426
   81    HB3  PRO  11           HB3      PRO  11 -20.148   5.153  14.483
   82    HG2  PRO  11           HG2      PRO  11 -21.812   7.208  14.721
   83    HG3  PRO  11           HG3      PRO  11 -20.316   7.359  13.779
   84    HD2  PRO  11           HD2      PRO  11 -23.132   7.098  12.837
   85    HD3  PRO  11           HD3      PRO  11 -21.780   7.999  12.125
   86    H    GLU  12           H        GLU  12 -23.324   4.133  12.819
   87    HA   GLU  12           HA       GLU  12 -22.977   1.344  13.057
   88    HB2  GLU  12           HB2      GLU  12 -25.444   2.813  12.110
   89    HB3  GLU  12           HB3      GLU  12 -25.384   1.214  12.841
   90    HG2  GLU  12           HG2      GLU  12 -24.909   2.063  14.953
   91    HG3  GLU  12           HG3      GLU  12 -24.415   3.631  14.314
   92    H    GLU  13           H        GLU  13 -23.481   3.461  10.357
   93    HA   GLU  13           HA       GLU  13 -24.202   1.475   8.448
   94    HB2  GLU  13           HB2      GLU  13 -24.817   3.894   8.369
   95    HB3  GLU  13           HB3      GLU  13 -23.139   4.269   8.019
   96    HG2  GLU  13           HG2      GLU  13 -23.259   3.191   5.908
   97    HG3  GLU  13           HG3      GLU  13 -24.845   2.511   6.284
   98    H    GLU  14           H        GLU  14 -21.204   3.124   9.344
   99    HA   GLU  14           HA       GLU  14 -19.579   1.866   7.380
  100    HB2  GLU  14           HB2      GLU  14 -18.784   3.030  10.057
  101    HB3  GLU  14           HB3      GLU  14 -17.685   2.647   8.738
  102    HG2  GLU  14           HG2      GLU  14 -18.814   4.302   7.327
  103    HG3  GLU  14           HG3      GLU  14 -19.891   4.691   8.665
  104    H    ALA  15           H        ALA  15 -20.723   0.963  10.541
  105    HA   ALA  15           HA       ALA  15 -19.052  -1.303  10.915
  106    HB1  ALA  15           HB1      ALA  15 -20.643  -1.989  12.604
  107    HB2  ALA  15           HB2      ALA  15 -21.839  -0.855  11.980
  108    HB3  ALA  15           HB3      ALA  15 -20.364  -0.251  12.735
  109    H    HIS  16           H        HIS  16 -21.921  -0.681   9.101
  110    HA   HIS  16           HA       HIS  16 -22.463  -3.428   8.458
  111    HB2  HIS  16           HB2      HIS  16 -24.271  -1.722   8.635
  112    HB3  HIS  16           HB3      HIS  16 -23.598  -0.900   7.234
  113    HD1  HIS  16           HD1      HIS  16 -25.982  -1.296   6.143
  114    HD2  HIS  16           HD2      HIS  16 -23.760  -4.735   6.853
  115    HE1  HIS  16           HE1      HIS  16 -27.067  -3.104   4.770
  116    HE2  HIS  16           HE2      HIS  16 -25.786  -5.204   5.316
  117    H    LEU  17           H        LEU  17 -20.704  -0.746   7.164
  118    HA   LEU  17           HA       LEU  17 -20.266  -1.678   4.542
  119    HB2  LEU  17           HB2      LEU  17 -19.825   0.627   5.445
  120    HB3  LEU  17           HB3      LEU  17 -18.436  -0.016   6.285
  121    HG   LEU  17           HG       LEU  17 -18.211   1.262   3.988
  122   HD11  LEU  17          HD11      LEU  17 -16.641  -1.214   4.665
  123   HD12  LEU  17          HD12      LEU  17 -16.355   0.410   5.290
  124   HD13  LEU  17          HD13      LEU  17 -16.123   0.073   3.575
  125   HD21  LEU  17          HD21      LEU  17 -18.057  -0.223   2.090
  126   HD22  LEU  17          HD22      LEU  17 -19.690  -0.255   2.753
  127   HD23  LEU  17          HD23      LEU  17 -18.580  -1.584   3.079
  128    H    ARG  18           H        ARG  18 -18.276  -1.968   7.498
  129    HA   ARG  18           HA       ARG  18 -16.534  -3.913   6.379
  130    HB2  ARG  18           HB2      ARG  18 -15.800  -4.284   8.720
  131    HB3  ARG  18           HB3      ARG  18 -15.789  -2.590   8.257
  132    HG2  ARG  18           HG2      ARG  18 -17.927  -2.275   9.417
  133    HG3  ARG  18           HG3      ARG  18 -17.881  -3.962   9.925
  134    HD2  ARG  18           HD2      ARG  18 -15.709  -1.984  10.563
  135    HD3  ARG  18           HD3      ARG  18 -17.086  -2.275  11.622
  136    HE   ARG  18           HE       ARG  18 -16.135  -4.746  11.322
  137   HH11  ARG  18          HH11      ARG  18 -14.479  -1.743  11.991
  138   HH12  ARG  18          HH12      ARG  18 -13.251  -2.482  12.964
  139   HH21  ARG  18          HH21      ARG  18 -14.522  -5.737  12.621
  140   HH22  ARG  18          HH22      ARG  18 -13.280  -4.754  13.329
  141    H    GLU  19           H        GLU  19 -19.582  -4.014   8.081
  142    HA   GLU  19           HA       GLU  19 -19.762  -6.590   8.949
  143    HB2  GLU  19           HB2      GLU  19 -21.522  -4.950   9.296
  144    HB3  GLU  19           HB3      GLU  19 -21.904  -4.981   7.582
  145    HG2  GLU  19           HG2      GLU  19 -23.526  -6.241   8.843
  146    HG3  GLU  19           HG3      GLU  19 -22.611  -7.302   7.776
  147    H    LEU  20           H        LEU  20 -20.765  -5.418   5.768
  148    HA   LEU  20           HA       LEU  20 -21.349  -7.904   4.630
  149    HB2  LEU  20           HB2      LEU  20 -21.061  -5.140   3.751
  150    HB3  LEU  20           HB3      LEU  20 -20.583  -6.292   2.518
  151    HG   LEU  20           HG       LEU  20 -23.237  -6.434   3.933
  152   HD11  LEU  20          HD11      LEU  20 -23.018  -4.281   2.766
  153   HD12  LEU  20          HD12      LEU  20 -24.212  -5.336   2.016
  154   HD13  LEU  20          HD13      LEU  20 -22.621  -5.144   1.278
  155   HD21  LEU  20          HD21      LEU  20 -22.493  -8.491   2.885
  156   HD22  LEU  20          HD22      LEU  20 -22.180  -7.633   1.377
  157   HD23  LEU  20          HD23      LEU  20 -23.833  -7.793   1.975
  158    H    TYR  21           H        TYR  21 -18.341  -6.072   4.799
  159    HA   TYR  21           HA       TYR  21 -16.977  -7.662   2.868
  160    HB2  TYR  21           HB2      TYR  21 -16.298  -5.356   3.441
  161    HB3  TYR  21           HB3      TYR  21 -15.821  -5.911   5.043
  162    HD1  TYR  21           HD1      TYR  21 -13.579  -6.303   5.361
  163    HD2  TYR  21           HD2      TYR  21 -15.228  -6.841   1.481
  164    HE1  TYR  21           HE1      TYR  21 -11.346  -6.852   4.498
  165    HE2  TYR  21           HE2      TYR  21 -12.995  -7.392   0.604
  166    HH   TYR  21           HH       TYR  21 -10.654  -7.036   1.164
  167    H    LEU  22           H        LEU  22 -17.171  -7.696   6.378
  168    HA   LEU  22           HA       LEU  22 -15.163  -9.674   6.744
  169    HB2  LEU  22           HB2      LEU  22 -17.418  -8.945   8.610
  170    HB3  LEU  22           HB3      LEU  22 -15.918  -9.737   9.036
  171    HG   LEU  22           HG       LEU  22 -16.193  -6.900   8.050
  172   HD11  LEU  22          HD11      LEU  22 -17.024  -7.156  10.301
  173   HD12  LEU  22          HD12      LEU  22 -15.491  -6.286  10.305
  174   HD13  LEU  22          HD13      LEU  22 -15.541  -7.984  10.779
  175   HD21  LEU  22          HD21      LEU  22 -13.739  -8.367   9.007
  176   HD22  LEU  22          HD22      LEU  22 -13.834  -6.665   8.543
  177   HD23  LEU  22          HD23      LEU  22 -14.087  -7.925   7.336
  178    H    ALA  23           H        ALA  23 -18.468  -9.813   5.850
  179    HA   ALA  23           HA       ALA  23 -18.770 -12.596   6.623
  180    HB1  ALA  23           HB1      ALA  23 -20.642 -10.788   5.099
  181    HB2  ALA  23           HB2      ALA  23 -20.664 -11.061   6.841
  182    HB3  ALA  23           HB3      ALA  23 -21.028 -12.386   5.737
  183    H    ASN  24           H        ASN  24 -18.495 -10.693   3.628
  184    HA   ASN  24           HA       ASN  24 -18.844 -13.044   2.010
  185    HB2  ASN  24           HB2      ASN  24 -18.399 -10.148   1.377
  186    HB3  ASN  24           HB3      ASN  24 -18.327 -11.380   0.119
  187   HD21  ASN  24          HD21      ASN  24 -20.360  -9.716   2.391
  188   HD22  ASN  24          HD22      ASN  24 -21.872 -10.259   1.741
  189    H    LYS  25           H        LYS  25 -16.161 -11.599   3.509
  190    HA   LYS  25           HA       LYS  25 -14.174 -12.279   1.608
  191    HB2  LYS  25           HB2      LYS  25 -12.581 -12.206   3.518
  192    HB3  LYS  25           HB3      LYS  25 -13.589 -10.771   3.393
  193    HG2  LYS  25           HG2      LYS  25 -14.842 -11.335   5.275
  194    HG3  LYS  25           HG3      LYS  25 -14.342 -13.025   5.219
  195    HD2  LYS  25           HD2      LYS  25 -13.276 -11.745   7.058
  196    HD3  LYS  25           HD3      LYS  25 -12.111 -12.438   5.930
  197    HE2  LYS  25           HE2      LYS  25 -11.962 -10.234   4.807
  198    HE3  LYS  25           HE3      LYS  25 -13.050  -9.574   6.027
  199    HZ1  LYS  25           HZ1      LYS  25 -11.436 -10.084   7.726
  200    HZ2  LYS  25           HZ2      LYS  25 -10.706  -9.143   6.526
  201    HZ3  LYS  25           HZ3      LYS  25 -10.408 -10.802   6.592
  202    H    ASP  26           H        ASP  26 -16.095 -14.131   3.722
  203    HA   ASP  26           HA       ASP  26 -14.299 -16.422   3.767
  204    HB2  ASP  26           HB2      ASP  26 -15.611 -15.791   5.782
  205    HB3  ASP  26           HB3      ASP  26 -17.096 -16.109   4.892
  206    H    VAL  27           H        VAL  27 -16.521 -15.136   1.685
  207    HA   VAL  27           HA       VAL  27 -17.643 -17.671   0.790
  208    HB   VAL  27           HB       VAL  27 -18.179 -14.888  -0.265
  209   HG11  VAL  27          HG11      VAL  27 -19.688 -17.473  -0.647
  210   HG12  VAL  27          HG12      VAL  27 -18.692 -16.669  -1.860
  211   HG13  VAL  27          HG13      VAL  27 -20.164 -15.895  -1.273
  212   HG21  VAL  27          HG21      VAL  27 -18.842 -15.078   2.082
  213   HG22  VAL  27          HG22      VAL  27 -19.782 -16.521   1.702
  214   HG23  VAL  27          HG23      VAL  27 -20.251 -14.960   1.029
  215    H    GLU  28           H        GLU  28 -16.861 -18.741  -0.900
  216    HA   GLU  28           HA       GLU  28 -14.555 -17.578  -2.259
  217    HB2  GLU  28           HB2      GLU  28 -15.530 -20.433  -2.194
  218    HB3  GLU  28           HB3      GLU  28 -14.006 -19.872  -2.870
  219    HG2  GLU  28           HG2      GLU  28 -13.261 -19.160  -0.681
  220    HG3  GLU  28           HG3      GLU  28 -14.806 -19.636   0.026
  221    H    GLY  29           H        GLY  29 -14.524 -17.103  -4.363
  222    HA2  GLY  29           HA2      GLY  29 -15.135 -17.334  -6.630
  223    HA3  GLY  29           HA3      GLY  29 -16.584 -18.193  -6.133
  224    H    GLN  30           H        GLN  30 -17.367 -16.223  -4.156
  225    HA   GLN  30           HA       GLN  30 -18.692 -14.380  -5.930
  226    HB2  GLN  30           HB2      GLN  30 -19.746 -15.474  -3.905
  227    HB3  GLN  30           HB3      GLN  30 -18.764 -14.422  -2.909
  228    HG2  GLN  30           HG2      GLN  30 -20.710 -13.389  -4.963
  229    HG3  GLN  30           HG3      GLN  30 -21.157 -13.712  -3.293
  230   HE21  GLN  30          HE21      GLN  30 -18.719 -12.722  -2.107
  231   HE22  GLN  30          HE22      GLN  30 -18.707 -11.019  -2.342
  232    H    ASP  31           H        ASP  31 -18.025 -12.433  -6.455
  233    HA   ASP  31           HA       ASP  31 -15.501 -11.412  -5.753
  234    HB2  ASP  31           HB2      ASP  31 -16.961 -10.901  -7.816
  235    HB3  ASP  31           HB3      ASP  31 -17.778  -9.735  -6.786
  236    H    VAL  32           H        VAL  32 -14.955 -10.620  -3.773
  237    HA   VAL  32           HA       VAL  32 -16.921 -10.074  -1.835
  238    HB   VAL  32           HB       VAL  32 -14.427 -10.728  -1.479
  239   HG11  VAL  32          HG11      VAL  32 -13.418  -8.820  -2.588
  240   HG12  VAL  32          HG12      VAL  32 -12.982  -8.825  -0.880
  241   HG13  VAL  32          HG13      VAL  32 -14.226  -7.715  -1.475
  242   HG21  VAL  32          HG21      VAL  32 -16.025 -10.500   0.318
  243   HG22  VAL  32          HG22      VAL  32 -15.849  -8.745   0.293
  244   HG23  VAL  32          HG23      VAL  32 -14.496  -9.760   0.790
  245    H    VAL  33           H        VAL  33 -15.069  -7.960  -3.963
  246    HA   VAL  33           HA       VAL  33 -15.724  -5.562  -2.601
  247    HB   VAL  33           HB       VAL  33 -14.380  -4.517  -4.066
  248   HG11  VAL  33          HG11      VAL  33 -13.849  -7.296  -5.078
  249   HG12  VAL  33          HG12      VAL  33 -13.160  -6.581  -3.619
  250   HG13  VAL  33          HG13      VAL  33 -12.763  -5.913  -5.204
  251   HG21  VAL  33          HG21      VAL  33 -16.054  -4.381  -5.824
  252   HG22  VAL  33          HG22      VAL  33 -15.613  -5.997  -6.380
  253   HG23  VAL  33          HG23      VAL  33 -14.450  -4.676  -6.498
  254    H    GLU  34           H        GLU  34 -17.074  -7.341  -5.289
  255    HA   GLU  34           HA       GLU  34 -19.010  -5.417  -5.998
  256    HB2  GLU  34           HB2      GLU  34 -18.102  -7.567  -7.247
  257    HB3  GLU  34           HB3      GLU  34 -19.479  -8.327  -6.462
  258    HG2  GLU  34           HG2      GLU  34 -19.778  -5.830  -8.088
  259    HG3  GLU  34           HG3      GLU  34 -19.785  -7.432  -8.829
  260    H    ALA  35           H        ALA  35 -18.998  -8.185  -3.812
  261    HA   ALA  35           HA       ALA  35 -21.714  -8.277  -3.176
  262    HB1  ALA  35           HB1      ALA  35 -19.345  -8.811  -1.396
  263    HB2  ALA  35           HB2      ALA  35 -20.192  -9.979  -2.410
  264    HB3  ALA  35           HB3      ALA  35 -21.010  -9.258  -1.025
  265    H    ILE  36           H        ILE  36 -19.137  -6.266  -1.859
  266    HA   ILE  36           HA       ILE  36 -20.702  -5.157   0.240
  267    HB   ILE  36           HB       ILE  36 -18.373  -3.702  -0.950
  268   HG12  ILE  36          HG12      ILE  36 -17.561  -5.970  -0.874
  269   HG13  ILE  36          HG13      ILE  36 -16.855  -5.079   0.468
  270   HG21  ILE  36          HG21      ILE  36 -19.522  -2.646   0.865
  271   HG22  ILE  36          HG22      ILE  36 -17.939  -3.190   1.423
  272   HG23  ILE  36          HG23      ILE  36 -19.388  -4.102   1.849
  273   HD11  ILE  36          HD11      ILE  36 -19.222  -6.918   0.679
  274   HD12  ILE  36          HD12      ILE  36 -18.387  -6.112   2.007
  275   HD13  ILE  36          HD13      ILE  36 -17.559  -7.352   1.062
  276    H    LEU  37           H        LEU  37 -19.517  -3.814  -2.829
  277    HA   LEU  37           HA       LEU  37 -20.943  -1.383  -2.546
  278    HB2  LEU  37           HB2      LEU  37 -20.410  -1.098  -5.006
  279    HB3  LEU  37           HB3      LEU  37 -19.060  -1.270  -3.912
  280    HG   LEU  37           HG       LEU  37 -19.065  -3.764  -4.612
  281   HD11  LEU  37          HD11      LEU  37 -19.861  -4.052  -6.972
  282   HD12  LEU  37          HD12      LEU  37 -20.706  -2.512  -6.818
  283   HD13  LEU  37          HD13      LEU  37 -21.154  -3.870  -5.786
  284   HD21  LEU  37          HD21      LEU  37 -17.317  -2.166  -5.173
  285   HD22  LEU  37          HD22      LEU  37 -18.253  -1.618  -6.564
  286   HD23  LEU  37          HD23      LEU  37 -17.638  -3.268  -6.511
  287    H    ALA  38           H        ALA  38 -21.976  -4.450  -3.530
  288    HA   ALA  38           HA       ALA  38 -24.115  -3.620  -5.255
  289    HB1  ALA  38           HB1      ALA  38 -23.539  -6.271  -3.946
  290    HB2  ALA  38           HB2      ALA  38 -23.043  -5.766  -5.562
  291    HB3  ALA  38           HB3      ALA  38 -24.753  -5.992  -5.197
  292    H    HIS  39           H        HIS  39 -23.968  -4.904  -1.919
  293    HA   HIS  39           HA       HIS  39 -26.865  -4.970  -1.830
  294    HB2  HIS  39           HB2      HIS  39 -24.768  -5.777   0.181
  295    HB3  HIS  39           HB3      HIS  39 -26.497  -5.902   0.479
  296    HD1  HIS  39           HD1      HIS  39 -27.774  -7.785  -0.737
  297    HD2  HIS  39           HD2      HIS  39 -23.704  -7.691  -1.562
  298    HE1  HIS  39           HE1      HIS  39 -27.263  -9.966  -1.872
  299    HE2  HIS  39           HE2      HIS  39 -24.760  -9.968  -2.159
  300    H    LEU  40           H        LEU  40 -24.342  -2.880  -0.759
  301    HA   LEU  40           HA       LEU  40 -25.861  -1.627   1.321
  302    HB2  LEU  40           HB2      LEU  40 -23.387  -0.704  -0.124
  303    HB3  LEU  40           HB3      LEU  40 -24.068   0.069   1.293
  304    HG   LEU  40           HG       LEU  40 -23.263  -2.811   1.395
  305   HD11  LEU  40          HD11      LEU  40 -21.054  -2.038   2.209
  306   HD12  LEU  40          HD12      LEU  40 -21.473  -0.411   1.672
  307   HD13  LEU  40          HD13      LEU  40 -21.339  -1.722   0.496
  308   HD21  LEU  40          HD21      LEU  40 -22.912  -2.282   3.754
  309   HD22  LEU  40          HD22      LEU  40 -24.555  -1.881   3.252
  310   HD23  LEU  40          HD23      LEU  40 -23.356  -0.603   3.450
  311    H    ASN  41           H        ASN  41 -27.818  -1.180   0.097
  312    HA   ASN  41           HA       ASN  41 -27.569   1.298  -1.465
  313    HB2  ASN  41           HB2      ASN  41 -29.792  -0.724  -1.230
  314    HB3  ASN  41           HB3      ASN  41 -30.063   0.875  -1.912
  315   HD21  ASN  41          HD21      ASN  41 -28.526  -2.208  -2.356
  316   HD22  ASN  41          HD22      ASN  41 -28.116  -1.986  -4.022
  317    H    THR  42           H        THR  42 -27.056   1.264   1.246
  318    HA   THR  42           HA       THR  42 -29.329   2.582   2.519
  319    HB   THR  42           HB       THR  42 -28.126   0.923   3.865
  320    HG1  THR  42           HG1      THR  42 -27.294   3.393   4.975
  321   HG21  THR  42          HG21      THR  42 -25.795   1.255   4.529
  322   HG22  THR  42          HG22      THR  42 -25.698   2.690   3.504
  323   HG23  THR  42          HG23      THR  42 -25.929   1.099   2.777
  324    H    VAL  43           H        VAL  43 -26.486   3.211   0.802
  325    HA   VAL  43           HA       VAL  43 -26.669   6.057   1.282
  326    HB   VAL  43           HB       VAL  43 -25.156   5.371   3.055
  327   HG11  VAL  43          HG11      VAL  43 -24.404   3.250   2.155
  328   HG12  VAL  43          HG12      VAL  43 -23.027   4.259   2.598
  329   HG13  VAL  43          HG13      VAL  43 -23.488   4.088   0.904
  330   HG21  VAL  43          HG21      VAL  43 -23.184   6.690   2.493
  331   HG22  VAL  43          HG22      VAL  43 -24.667   7.483   1.961
  332   HG23  VAL  43          HG23      VAL  43 -23.642   6.651   0.790
  333    HA   PRO  44           HA       PRO  44 -25.617   5.648  -3.055
  334    HB2  PRO  44           HB2      PRO  44 -25.922   8.260  -3.707
  335    HB3  PRO  44           HB3      PRO  44 -27.291   7.168  -3.473
  336    HG2  PRO  44           HG2      PRO  44 -26.169   9.226  -1.627
  337    HG3  PRO  44           HG3      PRO  44 -27.858   8.777  -1.915
  338    HD2  PRO  44           HD2      PRO  44 -26.372   7.939   0.243
  339    HD3  PRO  44           HD3      PRO  44 -27.783   7.077  -0.395
  340    H    ARG  45           H        ARG  45 -23.579   5.399  -3.661
  341    HA   ARG  45           HA       ARG  45 -21.738   7.610  -3.583
  342    HB2  ARG  45           HB2      ARG  45 -19.986   6.536  -2.325
  343    HB3  ARG  45           HB3      ARG  45 -21.433   6.546  -1.328
  344    HG2  ARG  45           HG2      ARG  45 -21.111   4.141  -2.966
  345    HG3  ARG  45           HG3      ARG  45 -19.849   4.387  -1.761
  346    HD2  ARG  45           HD2      ARG  45 -21.448   4.487  -0.005
  347    HD3  ARG  45           HD3      ARG  45 -22.784   4.488  -1.140
  348    HE   ARG  45           HE       ARG  45 -21.217   2.215  -0.285
  349   HH11  ARG  45          HH11      ARG  45 -23.618   3.454  -2.501
  350   HH12  ARG  45          HH12      ARG  45 -24.111   1.890  -3.055
  351   HH21  ARG  45          HH21      ARG  45 -21.862   0.131  -1.028
  352   HH22  ARG  45          HH22      ARG  45 -23.113   0.003  -2.223
  353    H    THR  46           H        THR  46 -19.686   7.014  -4.682
  354    HA   THR  46           HA       THR  46 -20.128   5.252  -6.903
  355    HB   THR  46           HB       THR  46 -18.794   7.251  -7.271
  356    HG1  THR  46           HG1      THR  46 -16.996   6.256  -8.263
  357   HG21  THR  46          HG21      THR  46 -16.879   6.097  -5.245
  358   HG22  THR  46          HG22      THR  46 -17.851   7.553  -5.045
  359   HG23  THR  46          HG23      THR  46 -16.564   7.509  -6.247
  360    H    ARG  47           H        ARG  47 -18.822   3.365  -7.369
  361    HA   ARG  47           HA       ARG  47 -18.699   1.562  -5.219
  362    HB2  ARG  47           HB2      ARG  47 -17.697   1.463  -8.048
  363    HB3  ARG  47           HB3      ARG  47 -17.304   0.173  -6.927
  364    HG2  ARG  47           HG2      ARG  47 -19.224  -0.433  -8.245
  365    HG3  ARG  47           HG3      ARG  47 -19.690  -0.231  -6.561
  366    HD2  ARG  47           HD2      ARG  47 -21.379   0.747  -7.933
  367    HD3  ARG  47           HD3      ARG  47 -20.507   2.045  -7.116
  368    HE   ARG  47           HE       ARG  47 -19.198   2.006  -9.408
  369   HH11  ARG  47          HH11      ARG  47 -22.646   1.736  -8.850
  370   HH12  ARG  47          HH12      ARG  47 -23.075   2.452 -10.369
  371   HH21  ARG  47          HH21      ARG  47 -19.767   2.958 -11.403
  372   HH22  ARG  47          HH22      ARG  47 -21.442   3.144 -11.820
  373    H    LYS  48           H        LYS  48 -16.411   3.757  -6.515
  374    HA   LYS  48           HA       LYS  48 -13.978   2.775  -5.626
  375    HB2  LYS  48           HB2      LYS  48 -14.215   4.740  -7.054
  376    HB3  LYS  48           HB3      LYS  48 -14.968   5.627  -5.740
  377    HG2  LYS  48           HG2      LYS  48 -12.814   5.330  -4.463
  378    HG3  LYS  48           HG3      LYS  48 -12.109   4.735  -5.968
  379    HD2  LYS  48           HD2      LYS  48 -11.606   7.078  -5.779
  380    HD3  LYS  48           HD3      LYS  48 -12.803   6.872  -7.059
  381    HE2  LYS  48           HE2      LYS  48 -14.575   7.445  -5.403
  382    HE3  LYS  48           HE3      LYS  48 -13.306   7.790  -4.231
  383    HZ1  LYS  48           HZ1      LYS  48 -13.760   9.185  -6.807
  384    HZ2  LYS  48           HZ2      LYS  48 -12.459   9.485  -5.770
  385    HZ3  LYS  48           HZ3      LYS  48 -14.037   9.811  -5.260
  386    H    GLN  49           H        GLN  49 -16.493   4.508  -3.828
  387    HA   GLN  49           HA       GLN  49 -14.913   5.093  -1.560
  388    HB2  GLN  49           HB2      GLN  49 -17.911   4.817  -1.764
  389    HB3  GLN  49           HB3      GLN  49 -17.048   5.531  -0.412
  390    HG2  GLN  49           HG2      GLN  49 -17.060   6.556  -3.227
  391    HG3  GLN  49           HG3      GLN  49 -17.984   7.224  -1.891
  392   HE21  GLN  49          HE21      GLN  49 -16.911   8.409  -0.308
  393   HE22  GLN  49          HE22      GLN  49 -15.305   8.995  -0.534
  394    H    ILE  50           H        ILE  50 -16.853   2.300  -2.444
  395    HA   ILE  50           HA       ILE  50 -16.946   1.083   0.092
  396    HB   ILE  50           HB       ILE  50 -17.058  -0.051  -2.694
  397   HG12  ILE  50          HG12      ILE  50 -19.383  -0.713  -1.701
  398   HG13  ILE  50          HG13      ILE  50 -19.024   0.530  -0.510
  399   HG21  ILE  50          HG21      ILE  50 -17.573  -2.235  -1.794
  400   HG22  ILE  50          HG22      ILE  50 -17.347  -1.640  -0.148
  401   HG23  ILE  50          HG23      ILE  50 -15.975  -1.722  -1.255
  402   HD11  ILE  50          HD11      ILE  50 -19.194   0.902  -3.486
  403   HD12  ILE  50          HD12      ILE  50 -18.761   2.160  -2.328
  404   HD13  ILE  50          HD13      ILE  50 -20.371   1.437  -2.288
  405    H    ILE  51           H        ILE  51 -14.814   0.385  -2.645
  406    HA   ILE  51           HA       ILE  51 -12.989  -1.266  -1.375
  407    HB   ILE  51           HB       ILE  51 -12.726   0.628  -3.698
  408   HG12  ILE  51          HG12      ILE  51 -12.441  -1.568  -4.923
  409   HG13  ILE  51          HG13      ILE  51 -12.861  -2.369  -3.419
  410   HG21  ILE  51          HG21      ILE  51 -10.529   0.561  -2.701
  411   HG22  ILE  51          HG22      ILE  51 -10.537  -0.377  -4.199
  412   HG23  ILE  51          HG23      ILE  51 -10.581  -1.204  -2.642
  413   HD11  ILE  51          HD11      ILE  51 -14.742  -2.212  -4.968
  414   HD12  ILE  51          HD12      ILE  51 -14.639  -0.450  -4.898
  415   HD13  ILE  51          HD13      ILE  51 -15.048  -1.373  -3.450
  416    H    HIS  52           H        HIS  52 -13.074   2.232  -1.645
  417    HA   HIS  52           HA       HIS  52 -10.561   2.694  -0.460
  418    HB2  HIS  52           HB2      HIS  52 -12.883   4.338  -1.256
  419    HB3  HIS  52           HB3      HIS  52 -11.813   5.040  -0.048
  420    HD1  HIS  52           HD1      HIS  52 -10.028   6.423  -1.078
  421    HD2  HIS  52           HD2      HIS  52 -11.147   3.258  -3.538
  422    HE1  HIS  52           HE1      HIS  52  -8.553   6.584  -3.097
  423    HE2  HIS  52           HE2      HIS  52  -9.206   4.634  -4.556
  424    H    HIS  53           H        HIS  53 -13.852   2.936   0.949
  425    HA   HIS  53           HA       HIS  53 -12.974   3.801   3.473
  426    HB2  HIS  53           HB2      HIS  53 -15.469   2.281   2.719
  427    HB3  HIS  53           HB3      HIS  53 -15.183   2.984   4.308
  428    HD1  HIS  53           HD1      HIS  53 -13.828   5.621   2.933
  429    HD2  HIS  53           HD2      HIS  53 -17.629   4.037   2.264
  430    HE1  HIS  53           HE1      HIS  53 -15.199   7.512   2.024
  431    HE2  HIS  53           HE2      HIS  53 -17.542   6.617   2.015
  432    H    LEU  54           H        LEU  54 -13.257   0.587   2.136
  433    HA   LEU  54           HA       LEU  54 -13.081  -0.850   4.558
  434    HB2  LEU  54           HB2      LEU  54 -12.448  -1.585   1.713
  435    HB3  LEU  54           HB3      LEU  54 -12.289  -2.725   3.034
  436    HG   LEU  54           HG       LEU  54 -14.875  -1.319   2.374
  437   HD11  LEU  54          HD11      LEU  54 -15.569  -3.349   1.267
  438   HD12  LEU  54          HD12      LEU  54 -14.000  -4.089   1.586
  439   HD13  LEU  54          HD13      LEU  54 -14.118  -2.712   0.491
  440   HD21  LEU  54          HD21      LEU  54 -14.272  -3.766   4.034
  441   HD22  LEU  54          HD22      LEU  54 -15.869  -3.086   3.732
  442   HD23  LEU  54          HD23      LEU  54 -14.686  -2.172   4.666
  443    H    VAL  55           H        VAL  55 -10.575   0.040   2.180
  444    HA   VAL  55           HA       VAL  55  -8.484  -1.036   3.831
  445    HB   VAL  55           HB       VAL  55  -6.922  -0.224   2.208
  446   HG11  VAL  55          HG11      VAL  55  -7.821  -1.207   0.137
  447   HG12  VAL  55          HG12      VAL  55  -9.429  -1.216   0.864
  448   HG13  VAL  55          HG13      VAL  55  -8.139  -2.200   1.558
  449   HG21  VAL  55          HG21      VAL  55  -7.781   2.018   1.854
  450   HG22  VAL  55          HG22      VAL  55  -9.189   1.367   1.017
  451   HG23  VAL  55          HG23      VAL  55  -7.584   1.188   0.309
  452    H    GLN  56           H        GLN  56 -10.090   1.987   3.493
  453    HA   GLN  56           HA       GLN  56  -8.190   3.671   4.716
  454    HB2  GLN  56           HB2      GLN  56 -11.113   3.792   4.179
  455    HB3  GLN  56           HB3      GLN  56 -10.429   4.953   5.301
  456    HG2  GLN  56           HG2      GLN  56  -9.034   5.882   3.639
  457    HG3  GLN  56           HG3      GLN  56  -9.338   4.542   2.534
  458   HE21  GLN  56          HE21      GLN  56  -9.983   5.977   0.941
  459   HE22  GLN  56          HE22      GLN  56 -11.521   6.771   0.980
  460    H    MET  57           H        MET  57 -10.655   1.541   6.002
  461    HA   MET  57           HA       MET  57 -10.142   2.525   8.687
  462    HB2  MET  57           HB2      MET  57 -12.172   0.634   7.549
  463    HB3  MET  57           HB3      MET  57 -11.918   0.762   9.286
  464    HG2  MET  57           HG2      MET  57 -12.413   3.162   9.172
  465    HG3  MET  57           HG3      MET  57 -12.699   3.013   7.442
  466    HE1  MET  57           HE1      MET  57 -14.369   0.594   6.868
  467    HE2  MET  57           HE2      MET  57 -14.927   2.194   6.377
  468    HE3  MET  57           HE3      MET  57 -16.027   1.091   7.200
  469    H    GLY  58           H        GLY  58  -8.426   0.703   6.809
  470    HA2  GLY  58           HA2      GLY  58  -6.628  -0.639   7.260
  471    HA3  GLY  58           HA3      GLY  58  -6.950  -0.385   8.965
  472    H    LEU  59           H        LEU  59  -9.658  -1.605   7.405
  473    HA   LEU  59           HA       LEU  59  -9.185  -4.183   8.675
  474    HB2  LEU  59           HB2      LEU  59 -11.575  -4.593   8.288
  475    HB3  LEU  59           HB3      LEU  59 -11.277  -3.125   9.195
  476    HG   LEU  59           HG       LEU  59 -11.488  -1.987   6.836
  477   HD11  LEU  59          HD11      LEU  59 -13.168  -4.450   6.454
  478   HD12  LEU  59          HD12      LEU  59 -11.629  -4.151   5.647
  479   HD13  LEU  59          HD13      LEU  59 -13.000  -3.084   5.350
  480   HD21  LEU  59          HD21      LEU  59 -12.939  -1.493   8.682
  481   HD22  LEU  59          HD22      LEU  59 -13.807  -3.012   8.454
  482   HD23  LEU  59          HD23      LEU  59 -13.914  -1.744   7.233
  483    H    ALA  60           H        ALA  60  -9.198  -2.726   5.607
  484    HA   ALA  60           HA       ALA  60  -8.879  -5.380   4.350
  485    HB1  ALA  60           HB1      ALA  60  -9.489  -2.709   3.094
  486    HB2  ALA  60           HB2      ALA  60 -10.582  -4.088   3.233
  487    HB3  ALA  60           HB3      ALA  60  -9.159  -4.186   2.194
  488    H    ASP  61           H        ASP  61  -7.117  -5.537   2.743
  489    HA   ASP  61           HA       ASP  61  -4.698  -4.468   3.800
  490    HB2  ASP  61           HB2      ASP  61  -5.316  -6.057   1.320
  491    HB3  ASP  61           HB3      ASP  61  -3.693  -5.480   1.678
  492    H    SER  62           H        SER  62  -6.008  -4.182   0.494
  493    HA   SER  62           HA       SER  62  -5.534  -1.374   0.390
  494    HB2  SER  62           HB2      SER  62  -3.602  -3.227  -1.000
  495    HB3  SER  62           HB3      SER  62  -3.804  -1.533  -1.413
  496    HG   SER  62           HG       SER  62  -3.436  -1.928   1.264
  497    H    VAL  63           H        VAL  63  -5.581  -0.622  -1.975
  498    HA   VAL  63           HA       VAL  63  -7.977  -1.376  -3.217
  499    HB   VAL  63           HB       VAL  63  -5.617   0.301  -4.009
  500   HG11  VAL  63          HG11      VAL  63  -6.719   0.933  -6.102
  501   HG12  VAL  63          HG12      VAL  63  -7.937  -0.312  -5.831
  502   HG13  VAL  63          HG13      VAL  63  -6.251  -0.769  -6.092
  503   HG21  VAL  63          HG21      VAL  63  -7.281   1.211  -2.474
  504   HG22  VAL  63          HG22      VAL  63  -8.544   0.921  -3.669
  505   HG23  VAL  63          HG23      VAL  63  -7.267   2.089  -4.005
  506    H    LYS  64           H        LYS  64  -4.797  -2.621  -3.421
  507    HA   LYS  64           HA       LYS  64  -4.742  -3.702  -5.998
  508    HB2  LYS  64           HB2      LYS  64  -3.349  -4.592  -3.477
  509    HB3  LYS  64           HB3      LYS  64  -2.939  -5.144  -5.088
  510    HG2  LYS  64           HG2      LYS  64  -2.306  -2.905  -5.737
  511    HG3  LYS  64           HG3      LYS  64  -2.810  -2.283  -4.166
  512    HD2  LYS  64           HD2      LYS  64  -0.636  -4.337  -4.569
  513    HD3  LYS  64           HD3      LYS  64  -0.347  -2.606  -4.389
  514    HE2  LYS  64           HE2      LYS  64  -1.425  -2.680  -2.177
  515    HE3  LYS  64           HE3      LYS  64  -1.676  -4.413  -2.364
  516    HZ1  LYS  64           HZ1      LYS  64   0.704  -4.734  -2.425
  517    HZ2  LYS  64           HZ2      LYS  64   0.272  -3.911  -1.013
  518    HZ3  LYS  64           HZ3      LYS  64   0.970  -3.069  -2.303
  519    H    ASP  65           H        ASP  65  -6.164  -4.899  -3.036
  520    HA   ASP  65           HA       ASP  65  -6.482  -7.580  -4.056
  521    HB2  ASP  65           HB2      ASP  65  -6.122  -7.220  -1.664
  522    HB3  ASP  65           HB3      ASP  65  -7.581  -6.243  -1.571
  523    H    PHE  66           H        PHE  66  -8.175  -4.646  -4.296
  524    HA   PHE  66           HA       PHE  66 -10.764  -5.979  -4.611
  525    HB2  PHE  66           HB2      PHE  66 -10.052  -3.082  -4.169
  526    HB3  PHE  66           HB3      PHE  66 -11.682  -3.636  -4.526
  527    HD1  PHE  66           HD1      PHE  66  -8.902  -4.084  -2.114
  528    HD2  PHE  66           HD2      PHE  66 -13.103  -4.289  -2.804
  529    HE1  PHE  66           HE1      PHE  66  -9.273  -4.490   0.278
  530    HE2  PHE  66           HE2      PHE  66 -13.472  -4.699  -0.414
  531    HZ   PHE  66           HZ       PHE  66 -11.562  -4.794   1.135
  532    H    GLN  67           H        GLN  67  -8.613  -3.703  -6.323
  533    HA   GLN  67           HA       GLN  67 -10.157  -4.201  -8.754
  534    HB2  GLN  67           HB2      GLN  67  -9.779  -1.552  -7.436
  535    HB3  GLN  67           HB3      GLN  67  -9.946  -1.644  -9.185
  536    HG2  GLN  67           HG2      GLN  67 -12.115  -2.696  -8.947
  537    HG3  GLN  67           HG3      GLN  67 -11.940  -2.699  -7.192
  538   HE21  GLN  67          HE21      GLN  67 -13.859  -1.481  -7.034
  539   HE22  GLN  67          HE22      GLN  67 -13.872   0.214  -7.361
  540    H    ARG  68           H        ARG  68  -7.318  -2.615  -7.422
  541    HA   ARG  68           HA       ARG  68  -6.235  -2.269 -10.092
  542    HB2  ARG  68           HB2      ARG  68  -6.046  -0.447  -8.397
  543    HB3  ARG  68           HB3      ARG  68  -5.034  -1.504  -7.425
  544    HG2  ARG  68           HG2      ARG  68  -3.511  -1.638  -9.466
  545    HG3  ARG  68           HG3      ARG  68  -4.413  -0.248 -10.068
  546    HD2  ARG  68           HD2      ARG  68  -2.961  -0.374  -7.427
  547    HD3  ARG  68           HD3      ARG  68  -2.344   0.391  -8.887
  548    HE   ARG  68           HE       ARG  68  -4.856   1.494  -8.254
  549   HH11  ARG  68          HH11      ARG  68  -1.561   1.435  -7.072
  550   HH12  ARG  68          HH12      ARG  68  -1.654   3.015  -6.341
  551   HH21  ARG  68          HH21      ARG  68  -4.963   3.587  -7.314
  552   HH22  ARG  68          HH22      ARG  68  -3.561   4.244  -6.518
  553    H    LYS  69           H        LYS  69  -4.646  -3.479 -10.949
  554    HA   LYS  69           HA       LYS  69  -3.756  -5.875  -9.923
  555    HB2  LYS  69           HB2      LYS  69  -3.343  -5.304 -12.236
  556    HB3  LYS  69           HB3      LYS  69  -2.338  -3.942 -11.764
  557    HG2  LYS  69           HG2      LYS  69  -0.715  -5.504 -10.787
  558    HG3  LYS  69           HG3      LYS  69  -1.716  -6.854 -11.321
  559    HD2  LYS  69           HD2      LYS  69  -0.553  -4.781 -13.173
  560    HD3  LYS  69           HD3      LYS  69   0.214  -6.330 -12.822
  561    HE2  LYS  69           HE2      LYS  69  -1.803  -7.481 -13.663
  562    HE3  LYS  69           HE3      LYS  69  -2.499  -5.915 -14.077
  563    HZ1  LYS  69           HZ1      LYS  69   0.018  -7.025 -15.196
  564    HZ2  LYS  69           HZ2      LYS  69  -0.678  -5.542 -15.606
  565    HZ3  LYS  69           HZ3      LYS  69  -1.474  -6.981 -15.991
  566    H    GLY  70           H        GLY  70  -2.552  -6.408  -8.283
  567    HA2  GLY  70           HA2      GLY  70  -1.429  -4.970  -6.349
  568    HA3  GLY  70           HA3      GLY  70  -0.657  -6.437  -6.935
  569    H    THR  71           H        THR  71  -0.121  -3.355  -6.205
  570    HA   THR  71           HA       THR  71   0.959  -2.080  -8.369
  571    HB   THR  71           HB       THR  71   2.246  -0.736  -6.664
  572    HG1  THR  71           HG1      THR  71   2.148  -2.746  -5.183
  573   HG21  THR  71          HG21      THR  71   0.165   0.179  -5.657
  574   HG22  THR  71          HG22      THR  71  -0.715  -1.217  -6.286
  575   HG23  THR  71          HG23      THR  71   0.038  -0.072  -7.397
  576    H    HIS  72           H        HIS  72   2.774  -2.218  -9.507
  577    HA   HIS  72           HA       HIS  72   4.689  -4.285  -9.014
  578    HB2  HIS  72           HB2      HIS  72   5.381  -3.868 -11.158
  579    HB3  HIS  72           HB3      HIS  72   3.922  -2.887 -11.252
  580    HD1  HIS  72           HD1      HIS  72   7.641  -2.506 -10.622
  581    HD2  HIS  72           HD2      HIS  72   4.353  -0.202 -11.687
  582    HE1  HIS  72           HE1      HIS  72   8.538  -0.200 -11.015
  583    HE2  HIS  72           HE2      HIS  72   6.598   1.023 -12.078
  584    H    ILE  73           H        ILE  73   4.204  -1.392  -7.617
  585    HA   ILE  73           HA       ILE  73   5.826   0.502  -7.894
  586    HB   ILE  73           HB       ILE  73   4.606  -0.498  -5.555
  587   HG12  ILE  73          HG12      ILE  73   4.221   1.561  -6.974
  588   HG13  ILE  73          HG13      ILE  73   4.142   1.807  -5.228
  589   HG21  ILE  73          HG21      ILE  73   5.994   0.585  -3.828
  590   HG22  ILE  73          HG22      ILE  73   7.270   0.804  -5.027
  591   HG23  ILE  73          HG23      ILE  73   6.778  -0.820  -4.550
  592   HD11  ILE  73          HD11      ILE  73   6.434   2.496  -7.059
  593   HD12  ILE  73          HD12      ILE  73   6.461   2.667  -5.304
  594   HD13  ILE  73          HD13      ILE  73   5.331   3.622  -6.266
  595    H    VAL  74           H        VAL  74   7.681   1.209  -8.000
  596    HA   VAL  74           HA       VAL  74   9.948  -0.325  -8.323
  597    HB   VAL  74           HB       VAL  74  11.162   1.716  -8.483
  598   HG11  VAL  74          HG11      VAL  74   8.322   2.350  -9.252
  599   HG12  VAL  74          HG12      VAL  74   9.465   1.420 -10.217
  600   HG13  VAL  74          HG13      VAL  74   9.777   3.122  -9.881
  601   HG21  VAL  74          HG21      VAL  74   8.962   3.137  -7.004
  602   HG22  VAL  74          HG22      VAL  74  10.531   3.783  -7.496
  603   HG23  VAL  74          HG23      VAL  74  10.439   2.550  -6.241
  604    H    LEU  75           H        LEU  75  11.802  -0.563  -7.038
  605    HA   LEU  75           HA       LEU  75  11.432  -1.419  -4.470
  606    HB2  LEU  75           HB2      LEU  75  13.987  -1.106  -4.316
  607    HB3  LEU  75           HB3      LEU  75  13.321  -2.205  -5.508
  608    HG   LEU  75           HG       LEU  75  13.474   0.087  -6.976
  609   HD11  LEU  75          HD11      LEU  75  15.655   1.100  -6.568
  610   HD12  LEU  75          HD12      LEU  75  15.864   0.100  -5.129
  611   HD13  LEU  75          HD13      LEU  75  14.589   1.318  -5.179
  612   HD21  LEU  75          HD21      LEU  75  15.620  -1.992  -6.585
  613   HD22  LEU  75          HD22      LEU  75  15.482  -0.905  -7.966
  614   HD23  LEU  75          HD23      LEU  75  14.230  -2.109  -7.661
  615    H    TRP  76           H        TRP  76  10.231   0.095  -3.261
  616    HA   TRP  76           HA       TRP  76  11.597   2.505  -2.372
  617    HB2  TRP  76           HB2      TRP  76   8.941   1.247  -1.761
  618    HB3  TRP  76           HB3      TRP  76   9.587   2.486  -0.697
  619    HD1  TRP  76           HD1      TRP  76   8.840   2.141  -4.504
  620    HE1  TRP  76           HE1      TRP  76   7.814   4.369  -5.291
  621    HE3  TRP  76           HE3      TRP  76   9.116   4.762  -0.133
  622    HZ2  TRP  76           HZ2      TRP  76   7.216   6.897  -4.211
  623    HZ3  TRP  76           HZ3      TRP  76   8.287   7.080  -0.091
  624    HH2  TRP  76           HH2      TRP  76   7.355   8.121  -2.085
  625    H    THR  77           H        THR  77  13.277   2.175  -1.068
  626    HA   THR  77           HA       THR  77  13.112   0.132   1.018
  627    HB   THR  77           HB       THR  77  15.535   0.563   1.331
  628    HG1  THR  77           HG1      THR  77  16.397   2.287   0.462
  629   HG21  THR  77          HG21      THR  77  16.291  -0.404  -0.805
  630   HG22  THR  77          HG22      THR  77  14.726  -0.022  -1.524
  631   HG23  THR  77          HG23      THR  77  14.831  -1.195  -0.212
  632    H    GLY  78           H        GLY  78  13.884   0.760   3.206
  633    HA2  GLY  78           HA2      GLY  78  12.384   2.830   4.271
  634    HA3  GLY  78           HA3      GLY  78  13.744   2.073   5.080
  635    H    ASP  79           H        ASP  79  15.754   2.917   3.205
  636    HA   ASP  79           HA       ASP  79  16.238   5.483   4.376
  637    HB2  ASP  79           HB2      ASP  79  18.405   5.385   3.345
  638    HB3  ASP  79           HB3      ASP  79  18.027   3.790   3.979
  639    H    GLN  80           H        GLN  80  15.480   4.368   1.078
  640    HA   GLN  80           HA       GLN  80  15.764   7.045   0.050
  641    HB2  GLN  80           HB2      GLN  80  15.418   6.159  -2.088
  642    HB3  GLN  80           HB3      GLN  80  16.260   4.881  -1.232
  643    HG2  GLN  80           HG2      GLN  80  14.683   3.548  -2.054
  644    HG3  GLN  80           HG3      GLN  80  13.647   4.229  -0.798
  645   HE21  GLN  80          HE21      GLN  80  12.958   3.188  -3.475
  646   HE22  GLN  80          HE22      GLN  80  12.166   4.494  -4.280
  647    H    GLU  81           H        GLU  81  13.206   5.042   1.270
  648    HA   GLU  81           HA       GLU  81  11.022   6.563   0.305
  649    HB2  GLU  81           HB2      GLU  81  10.725   4.315   1.215
  650    HB3  GLU  81           HB3      GLU  81  11.270   4.859   2.794
  651    HG2  GLU  81           HG2      GLU  81   9.320   6.129   3.146
  652    HG3  GLU  81           HG3      GLU  81   8.852   6.019   1.452
  653    H    LEU  82           H        LEU  82  12.905   6.680   3.307
  654    HA   LEU  82           HA       LEU  82  11.612   8.913   4.440
  655    HB2  LEU  82           HB2      LEU  82  13.103   7.500   5.742
  656    HB3  LEU  82           HB3      LEU  82  14.463   7.960   4.732
  657    HG   LEU  82           HG       LEU  82  13.966  10.367   5.508
  658   HD11  LEU  82          HD11      LEU  82  12.928  10.521   7.720
  659   HD12  LEU  82          HD12      LEU  82  12.518   8.807   7.640
  660   HD13  LEU  82          HD13      LEU  82  11.793   9.940   6.500
  661   HD21  LEU  82          HD21      LEU  82  15.020   8.348   7.473
  662   HD22  LEU  82          HD22      LEU  82  15.368  10.077   7.454
  663   HD23  LEU  82          HD23      LEU  82  15.929   9.047   6.134
  664    H    GLU  83           H        GLU  83  14.347   8.593   2.248
  665    HA   GLU  83           HA       GLU  83  15.193  11.233   2.092
  666    HB2  GLU  83           HB2      GLU  83  16.332   9.263   1.075
  667    HB3  GLU  83           HB3      GLU  83  15.084   9.211  -0.161
  668    HG2  GLU  83           HG2      GLU  83  16.955  10.274  -1.119
  669    HG3  GLU  83           HG3      GLU  83  15.764  11.534  -0.805
  670    H    LEU  84           H        LEU  84  12.737   9.546   0.134
  671    HA   LEU  84           HA       LEU  84  12.017  11.905  -1.309
  672    HB2  LEU  84           HB2      LEU  84  11.722   9.649  -2.246
  673    HB3  LEU  84           HB3      LEU  84  10.525   9.293  -1.014
  674    HG   LEU  84           HG       LEU  84   8.990  10.903  -1.943
  675   HD11  LEU  84          HD11      LEU  84   9.567  12.130  -4.023
  676   HD12  LEU  84          HD12      LEU  84  11.238  11.598  -3.824
  677   HD13  LEU  84          HD13      LEU  84  10.493  12.644  -2.614
  678   HD21  LEU  84          HD21      LEU  84   8.546   9.913  -4.095
  679   HD22  LEU  84          HD22      LEU  84   9.087   8.658  -2.982
  680   HD23  LEU  84          HD23      LEU  84  10.195   9.299  -4.195
  681    H    GLN  85           H        GLN  85  10.856  10.322   1.602
  682    HA   GLN  85           HA       GLN  85   8.477  11.704   2.022
  683    HB2  GLN  85           HB2      GLN  85   9.308   9.827   3.426
  684    HB3  GLN  85           HB3      GLN  85  10.525  10.894   4.105
  685    HG2  GLN  85           HG2      GLN  85   7.659  11.667   4.327
  686    HG3  GLN  85           HG3      GLN  85   8.278  10.392   5.367
  687   HE21  GLN  85          HE21      GLN  85   9.872  10.899   6.904
  688   HE22  GLN  85          HE22      GLN  85  10.140  12.524   7.425
  689    H    ARG  86           H        ARG  86  11.692  12.527   3.332
  690    HA   ARG  86           HA       ARG  86  11.053  15.082   4.248
  691    HB2  ARG  86           HB2      ARG  86  13.633  13.900   3.259
  692    HB3  ARG  86           HB3      ARG  86  13.536  15.550   3.849
  693    HG2  ARG  86           HG2      ARG  86  12.605  14.582   5.995
  694    HG3  ARG  86           HG3      ARG  86  13.093  13.004   5.369
  695    HD2  ARG  86           HD2      ARG  86  14.766  14.202   6.872
  696    HD3  ARG  86           HD3      ARG  86  15.370  13.598   5.328
  697    HE   ARG  86           HE       ARG  86  14.469  16.303   5.144
  698   HH11  ARG  86          HH11      ARG  86  17.153  14.363   6.252
  699   HH12  ARG  86          HH12      ARG  86  18.338  15.576   5.907
  700   HH21  ARG  86          HH21      ARG  86  15.986  17.902   4.692
  701   HH22  ARG  86          HH22      ARG  86  17.672  17.611   5.019
  702    H    LEU  87           H        LEU  87  12.215  14.023   1.095
  703    HA   LEU  87           HA       LEU  87  12.757  16.506  -0.042
  704    HB2  LEU  87           HB2      LEU  87  13.052  13.973  -0.842
  705    HB3  LEU  87           HB3      LEU  87  11.615  14.378  -1.763
  706    HG   LEU  87           HG       LEU  87  12.935  16.404  -2.603
  707   HD11  LEU  87          HD11      LEU  87  15.193  14.730  -1.509
  708   HD12  LEU  87          HD12      LEU  87  14.727  16.345  -0.970
  709   HD13  LEU  87          HD13      LEU  87  15.376  16.106  -2.592
  710   HD21  LEU  87          HD21      LEU  87  12.377  14.460  -3.964
  711   HD22  LEU  87          HD22      LEU  87  13.812  13.628  -3.370
  712   HD23  LEU  87          HD23      LEU  87  13.980  15.079  -4.357
  713    H    PHE  88           H        PHE  88   9.805  14.537  -0.252
  714    HA   PHE  88           HA       PHE  88   8.293  16.278  -1.803
  715    HB2  PHE  88           HB2      PHE  88   7.415  14.129  -1.586
  716    HB3  PHE  88           HB3      PHE  88   7.615  14.126   0.161
  717    HD1  PHE  88           HD1      PHE  88   5.734  14.280   1.427
  718    HD2  PHE  88           HD2      PHE  88   5.736  16.030  -2.450
  719    HE1  PHE  88           HE1      PHE  88   3.378  14.907   1.716
  720    HE2  PHE  88           HE2      PHE  88   3.379  16.674  -2.163
  721    HZ   PHE  88           HZ       PHE  88   2.200  16.117  -0.075
  722    H    GLU  89           H        GLU  89   8.553  16.070   1.691
  723    HA   GLU  89           HA       GLU  89   6.666  18.087   2.239
  724    HB2  GLU  89           HB2      GLU  89   9.036  17.205   3.885
  725    HB3  GLU  89           HB3      GLU  89   7.632  18.081   4.451
  726    HG2  GLU  89           HG2      GLU  89   7.277  15.457   3.135
  727    HG3  GLU  89           HG3      GLU  89   7.794  15.530   4.820
  728    H    GLU  90           H        GLU  90  10.063  18.163   1.445
  729    HA   GLU  90           HA       GLU  90  10.408  20.850   2.447
  730    HB2  GLU  90           HB2      GLU  90  12.151  18.724   1.331
  731    HB3  GLU  90           HB3      GLU  90  12.735  20.387   1.249
  732    HG2  GLU  90           HG2      GLU  90  12.422  20.583   3.682
  733    HG3  GLU  90           HG3      GLU  90  11.897  18.903   3.735
  734    H    PHE  91           H        PHE  91   9.745  19.356  -0.631
  735    HA   PHE  91           HA       PHE  91  10.308  21.922  -1.952
  736    HB2  PHE  91           HB2      PHE  91  10.179  19.123  -3.059
  737    HB3  PHE  91           HB3      PHE  91  10.196  20.555  -4.089
  738    HD1  PHE  91           HD1      PHE  91  12.154  21.970  -4.237
  739    HD2  PHE  91           HD2      PHE  91  12.148  18.463  -1.830
  740    HE1  PHE  91           HE1      PHE  91  14.605  22.077  -4.084
  741    HE2  PHE  91           HE2      PHE  91  14.599  18.566  -1.667
  742    HZ   PHE  91           HZ       PHE  91  15.830  20.374  -2.796
  743    H    ARG  92           H        ARG  92   7.728  20.278  -0.708
  744    HA   ARG  92           HA       ARG  92   5.796  20.895  -2.722
  745    HB2  ARG  92           HB2      ARG  92   4.123  20.240  -1.177
  746    HB3  ARG  92           HB3      ARG  92   5.481  19.158  -0.927
  747    HG2  ARG  92           HG2      ARG  92   6.136  20.376   1.048
  748    HG3  ARG  92           HG3      ARG  92   4.838  21.547   0.787
  749    HD2  ARG  92           HD2      ARG  92   3.287  19.484   0.829
  750    HD3  ARG  92           HD3      ARG  92   4.652  18.660   1.577
  751    HE   ARG  92           HE       ARG  92   3.991  21.139   2.863
  752   HH11  ARG  92          HH11      ARG  92   3.293  17.713   2.737
  753   HH12  ARG  92          HH12      ARG  92   2.499  17.689   4.278
  754   HH21  ARG  92          HH21      ARG  92   2.948  21.101   4.901
  755   HH22  ARG  92          HH22      ARG  92   2.306  19.605   5.504
  756    H    ASP  93           H        ASP  93   7.554  22.724  -0.580
  757    HA   ASP  93           HA       ASP  93   5.941  24.940  -0.045
  758    HB2  ASP  93           HB2      ASP  93   8.137  24.683   0.949
  759    HB3  ASP  93           HB3      ASP  93   8.903  24.729  -0.634
  760    H    SER  94           H        SER  94   7.139  23.736  -3.017
  761    HA   SER  94           HA       SER  94   6.617  26.277  -4.396
  762    HB2  SER  94           HB2      SER  94   8.815  25.152  -4.803
  763    HB3  SER  94           HB3      SER  94   7.949  23.763  -5.453
  764    HG   SER  94           HG       SER  94   7.964  26.412  -6.482
  765    H    ASP  95           H        ASP  95   5.749  25.650  -6.800
  766    HA   ASP  95           HA       ASP  95   3.074  24.770  -6.314
  767    HB2  ASP  95           HB2      ASP  95   4.483  25.387  -8.921
  768    HB3  ASP  95           HB3      ASP  95   2.756  25.101  -8.758
  769    H    ASP  96           H        ASP  96   5.757  23.467  -8.246
  770    HA   ASP  96           HA       ASP  96   4.328  20.893  -8.296
  771    HB2  ASP  96           HB2      ASP  96   4.804  22.002 -10.531
  772    HB3  ASP  96           HB3      ASP  96   6.514  21.731 -10.207
  773    H    VAL  97           H        VAL  97   5.071  19.751  -6.656
  774    HA   VAL  97           HA       VAL  97   7.744  20.043  -5.685
  775    HB   VAL  97           HB       VAL  97   5.897  19.649  -4.143
  776   HG11  VAL  97          HG11      VAL  97   4.498  18.206  -5.498
  777   HG12  VAL  97          HG12      VAL  97   4.833  17.474  -3.928
  778   HG13  VAL  97          HG13      VAL  97   5.689  16.912  -5.366
  779   HG21  VAL  97          HG21      VAL  97   6.917  17.977  -2.733
  780   HG22  VAL  97          HG22      VAL  97   8.158  18.977  -3.492
  781   HG23  VAL  97          HG23      VAL  97   7.838  17.353  -4.104
  782    H    LEU  98           H        LEU  98   6.093  17.742  -7.762
  783    HA   LEU  98           HA       LEU  98   7.991  15.655  -7.365
  784    HB2  LEU  98           HB2      LEU  98   5.843  16.024  -9.426
  785    HB3  LEU  98           HB3      LEU  98   6.896  14.623  -9.387
  786    HG   LEU  98           HG       LEU  98   5.975  14.651  -6.827
  787   HD11  LEU  98          HD11      LEU  98   4.452  16.497  -7.274
  788   HD12  LEU  98          HD12      LEU  98   3.571  15.014  -6.908
  789   HD13  LEU  98          HD13      LEU  98   3.705  15.572  -8.576
  790   HD21  LEU  98          HD21      LEU  98   4.518  12.823  -7.540
  791   HD22  LEU  98          HD22      LEU  98   6.115  12.724  -8.282
  792   HD23  LEU  98          HD23      LEU  98   4.740  13.310  -9.222
  793    H    GLY  99           H        GLY  99   7.653  18.211  -9.755
  794    HA2  GLY  99           HA2      GLY  99   9.627  17.370 -11.557
  795    HA3  GLY  99           HA3      GLY  99   9.214  19.051 -11.220
  796    H    HIS 100           H        HIS 100   9.915  19.113  -8.504
  797    HA   HIS 100           HA       HIS 100  12.764  19.388  -8.720
  798    HB2  HIS 100           HB2      HIS 100  10.817  19.900  -6.473
  799    HB3  HIS 100           HB3      HIS 100  12.556  20.079  -6.273
  800    HD1  HIS 100           HD1      HIS 100  13.679  22.106  -7.386
  801    HD2  HIS 100           HD2      HIS 100   9.579  21.889  -8.028
  802    HE1  HIS 100           HE1      HIS 100  13.022  24.350  -8.308
  803    HE2  HIS 100           HE2      HIS 100  10.564  24.141  -8.834
  804    H    ILE 101           H        ILE 101  10.475  17.177  -7.277
  805    HA   ILE 101           HA       ILE 101  12.177  15.621  -5.722
  806    HB   ILE 101           HB       ILE 101   9.721  14.906  -7.316
  807   HG12  ILE 101          HG12      ILE 101  10.278  15.027  -4.339
  808   HG13  ILE 101          HG13      ILE 101   9.470  16.282  -5.269
  809   HG21  ILE 101          HG21      ILE 101  11.086  12.908  -7.312
  810   HG22  ILE 101          HG22      ILE 101   9.730  12.704  -6.205
  811   HG23  ILE 101          HG23      ILE 101  11.339  13.049  -5.572
  812   HD11  ILE 101          HD11      ILE 101   7.944  14.834  -3.968
  813   HD12  ILE 101          HD12      ILE 101   8.444  13.472  -4.969
  814   HD13  ILE 101          HD13      ILE 101   7.608  14.840  -5.697
  815    H    MET 102           H        MET 102  11.232  15.074  -9.112
  816    HA   MET 102           HA       MET 102  12.859  12.904  -9.647
  817    HB2  MET 102           HB2      MET 102  11.907  15.119 -11.456
  818    HB3  MET 102           HB3      MET 102  12.704  13.665 -12.040
  819    HG2  MET 102           HG2      MET 102  10.210  13.579 -10.374
  820    HG3  MET 102           HG3      MET 102  10.184  13.688 -12.122
  821    HE1  MET 102           HE1      MET 102   8.662  11.583 -10.711
  822    HE2  MET 102           HE2      MET 102   9.090  10.090 -11.545
  823    HE3  MET 102           HE3      MET 102   8.828  11.574 -12.464
  824    H    LYS 103           H        LYS 103  13.655  16.324  -9.730
  825    HA   LYS 103           HA       LYS 103  16.213  15.811 -10.992
  826    HB2  LYS 103           HB2      LYS 103  15.036  18.398  -9.971
  827    HB3  LYS 103           HB3      LYS 103  16.485  18.243 -10.956
  828    HG2  LYS 103           HG2      LYS 103  13.693  17.491 -11.791
  829    HG3  LYS 103           HG3      LYS 103  14.579  18.932 -12.292
  830    HD2  LYS 103           HD2      LYS 103  16.272  17.510 -13.355
  831    HD3  LYS 103           HD3      LYS 103  15.378  16.074 -12.855
  832    HE2  LYS 103           HE2      LYS 103  14.928  16.645 -15.188
  833    HE3  LYS 103           HE3      LYS 103  13.474  16.768 -14.197
  834    HZ1  LYS 103           HZ1      LYS 103  13.777  18.636 -15.764
  835    HZ2  LYS 103           HZ2      LYS 103  15.182  19.083 -14.935
  836    HZ3  LYS 103           HZ3      LYS 103  13.685  19.130 -14.152
  837    H    ASN 104           H        ASN 104  15.067  15.867  -7.797
  838    HA   ASN 104           HA       ASN 104  17.796  16.477  -6.840
  839    HB2  ASN 104           HB2      ASN 104  15.807  17.959  -6.114
  840    HB3  ASN 104           HB3      ASN 104  15.361  16.603  -5.082
  841   HD21  ASN 104          HD21      ASN 104  15.739  17.671  -3.174
  842   HD22  ASN 104          HD22      ASN 104  17.322  18.099  -2.635
  843    H    ILE 105           H        ILE 105  15.461  14.000  -7.091
  844    HA   ILE 105           HA       ILE 105  16.495  12.545  -4.784
  845    HB   ILE 105           HB       ILE 105  14.061  12.558  -5.288
  846   HG12  ILE 105          HG12      ILE 105  13.714  10.106  -4.942
  847   HG13  ILE 105          HG13      ILE 105  15.436   9.883  -5.223
  848   HG21  ILE 105          HG21      ILE 105  14.153  12.413  -7.716
  849   HG22  ILE 105          HG22      ILE 105  13.181  11.103  -7.043
  850   HG23  ILE 105          HG23      ILE 105  14.826  10.786  -7.592
  851   HD11  ILE 105          HD11      ILE 105  14.215  11.516  -3.012
  852   HD12  ILE 105          HD12      ILE 105  15.939  11.260  -3.285
  853   HD13  ILE 105          HD13      ILE 105  14.902   9.901  -2.854
  854    H    THR 106           H        THR 106  17.216  10.374  -4.963
  855    HA   THR 106           HA       THR 106  19.128  10.079  -7.066
  856    HB   THR 106           HB       THR 106  19.575   9.560  -4.700
  857    HG1  THR 106           HG1      THR 106  20.992   8.560  -6.045
  858   HG21  THR 106          HG21      THR 106  17.752   7.207  -5.169
  859   HG22  THR 106          HG22      THR 106  17.475   8.549  -4.060
  860   HG23  THR 106          HG23      THR 106  18.795   7.417  -3.760
  861    H    ALA 107           H        ALA 107  16.178   8.346  -6.062
  862    HA   ALA 107           HA       ALA 107  16.477   6.434  -8.216
  863    HB1  ALA 107           HB1      ALA 107  14.411   5.452  -7.346
  864    HB2  ALA 107           HB2      ALA 107  14.238   6.804  -6.227
  865    HB3  ALA 107           HB3      ALA 107  15.595   5.690  -6.058
  866    H    LYS 108           H        LYS 108  15.633   6.659 -10.178
  867    HA   LYS 108           HA       LYS 108  13.894   8.935 -10.670
  868    HB2  LYS 108           HB2      LYS 108  15.716   7.295 -12.327
  869    HB3  LYS 108           HB3      LYS 108  14.277   7.908 -13.133
  870    HG2  LYS 108           HG2      LYS 108  16.152   9.423 -13.424
  871    HG3  LYS 108           HG3      LYS 108  14.867  10.181 -12.487
  872    HD2  LYS 108           HD2      LYS 108  16.192   9.399 -10.424
  873    HD3  LYS 108           HD3      LYS 108  17.530   9.162 -11.551
  874    HE2  LYS 108           HE2      LYS 108  17.212  11.535 -12.283
  875    HE3  LYS 108           HE3      LYS 108  16.050  11.718 -10.970
  876    HZ1  LYS 108           HZ1      LYS 108  18.900  10.964 -10.620
  877    HZ2  LYS 108           HZ2      LYS 108  17.776  11.245  -9.383
  878    HZ3  LYS 108           HZ3      LYS 108  18.269  12.515 -10.385
  879    H    ARG 109           H        ARG 109  11.889   8.545 -10.224
  880    HA   ARG 109           HA       ARG 109  10.681   5.979 -10.960
  881    HB2  ARG 109           HB2      ARG 109  10.118   8.039  -8.876
  882    HB3  ARG 109           HB3      ARG 109   8.788   7.054  -9.468
  883    HG2  ARG 109           HG2      ARG 109   9.723   5.092  -8.660
  884    HG3  ARG 109           HG3      ARG 109  11.325   5.812  -8.490
  885    HD2  ARG 109           HD2      ARG 109   8.954   6.750  -6.897
  886    HD3  ARG 109           HD3      ARG 109  10.009   5.444  -6.343
  887    HE   ARG 109           HE       ARG 109  11.223   8.006  -7.060
  888   HH11  ARG 109          HH11      ARG 109  10.156   5.814  -4.569
  889   HH12  ARG 109          HH12      ARG 109  11.245   6.438  -3.371
  890   HH21  ARG 109          HH21      ARG 109  12.654   8.847  -5.481
  891   HH22  ARG 109          HH22      ARG 109  12.663   8.155  -3.887
  892    H    SER 110           H        SER 110   8.215   6.320 -11.388
  893    HA   SER 110           HA       SER 110   7.883   8.584 -13.234
  894    HB2  SER 110           HB2      SER 110   6.034   6.217 -12.792
  895    HB3  SER 110           HB3      SER 110   5.915   7.416 -14.079
  896    HG   SER 110           HG       SER 110   8.168   6.651 -14.591
  897    H    ARG 111           H        ARG 111   6.052   9.993 -13.029
  898    HA   ARG 111           HA       ARG 111   5.826  10.868 -10.349
  899    HB2  ARG 111           HB2      ARG 111   4.297  11.743 -12.804
  900    HB3  ARG 111           HB3      ARG 111   4.284  12.585 -11.260
  901    HG2  ARG 111           HG2      ARG 111   6.757  12.860 -11.475
  902    HG3  ARG 111           HG3      ARG 111   6.629  12.194 -13.104
  903    HD2  ARG 111           HD2      ARG 111   6.656  14.597 -13.231
  904    HD3  ARG 111           HD3      ARG 111   5.055  14.012 -13.678
  905    HE   ARG 111           HE       ARG 111   4.892  14.545 -10.997
  906   HH11  ARG 111          HH11      ARG 111   5.777  16.398 -13.832
  907   HH12  ARG 111          HH12      ARG 111   5.214  17.902 -13.180
  908   HH21  ARG 111          HH21      ARG 111   4.115  16.543 -10.156
  909   HH22  ARG 111          HH22      ARG 111   4.296  17.998 -11.092
  910    H    ALA 112           H        ALA 112   3.647   9.053 -12.431
  911    HA   ALA 112           HA       ALA 112   1.277   9.351 -10.987
  912    HB1  ALA 112           HB1      ALA 112   2.164   6.965 -12.605
  913    HB2  ALA 112           HB2      ALA 112   1.371   8.408 -13.237
  914    HB3  ALA 112           HB3      ALA 112   0.507   7.341 -12.131
  915    H    ARG 113           H        ARG 113   3.927   7.076 -10.536
  916    HA   ARG 113           HA       ARG 113   2.468   5.693  -8.452
  917    HB2  ARG 113           HB2      ARG 113   4.552   4.301  -8.282
  918    HB3  ARG 113           HB3      ARG 113   3.741   4.262  -9.841
  919    HG2  ARG 113           HG2      ARG 113   5.398   6.058 -10.560
  920    HG3  ARG 113           HG3      ARG 113   6.293   5.641  -9.095
  921    HD2  ARG 113           HD2      ARG 113   7.072   4.439 -11.116
  922    HD3  ARG 113           HD3      ARG 113   6.524   3.376  -9.818
  923    HE   ARG 113           HE       ARG 113   4.324   3.389 -11.156
  924   HH11  ARG 113          HH11      ARG 113   7.513   3.543 -12.609
  925   HH12  ARG 113          HH12      ARG 113   7.004   2.774 -14.078
  926   HH21  ARG 113          HH21      ARG 113   3.664   2.403 -13.081
  927   HH22  ARG 113          HH22      ARG 113   4.824   2.122 -14.345
  928    H    ILE 114           H        ILE 114   4.730   8.279  -8.686
  929    HA   ILE 114           HA       ILE 114   5.732   8.092  -6.023
  930    HB   ILE 114           HB       ILE 114   5.467  10.522  -7.815
  931   HG12  ILE 114          HG12      ILE 114   7.881   8.841  -7.108
  932   HG13  ILE 114          HG13      ILE 114   7.021   8.782  -8.643
  933   HG21  ILE 114          HG21      ILE 114   7.062  11.595  -6.254
  934   HG22  ILE 114          HG22      ILE 114   6.905  10.204  -5.181
  935   HG23  ILE 114          HG23      ILE 114   5.506  11.231  -5.503
  936   HD11  ILE 114          HD11      ILE 114   8.528  11.143  -7.533
  937   HD12  ILE 114          HD12      ILE 114   7.629  11.133  -9.050
  938   HD13  ILE 114          HD13      ILE 114   9.041  10.096  -8.855
  939    H    VAL 115           H        VAL 115   3.171   9.973  -7.568
  940    HA   VAL 115           HA       VAL 115   2.250  11.278  -5.265
  941    HB   VAL 115           HB       VAL 115   0.239  11.807  -6.541
  942   HG11  VAL 115          HG11      VAL 115   2.681  11.893  -8.301
  943   HG12  VAL 115          HG12      VAL 115   2.314  13.036  -7.009
  944   HG13  VAL 115          HG13      VAL 115   1.263  12.934  -8.422
  945   HG21  VAL 115          HG21      VAL 115   1.261   9.898  -8.633
  946   HG22  VAL 115          HG22      VAL 115  -0.181  10.906  -8.744
  947   HG23  VAL 115          HG23      VAL 115  -0.109   9.596  -7.566
  948    H    ASP 116           H        ASP 116   1.414   8.176  -6.682
  949    HA   ASP 116           HA       ASP 116  -0.854   7.735  -5.001
  950    HB2  ASP 116           HB2      ASP 116  -0.249   6.725  -7.319
  951    HB3  ASP 116           HB3      ASP 116   0.675   5.557  -6.387
  952    H    LYS 117           H        LYS 117   2.572   6.994  -4.858
  953    HA   LYS 117           HA       LYS 117   2.376   5.190  -2.662
  954    HB2  LYS 117           HB2      LYS 117   4.394   5.995  -4.406
  955    HB3  LYS 117           HB3      LYS 117   4.934   6.544  -2.826
  956    HG2  LYS 117           HG2      LYS 117   4.023   3.724  -3.375
  957    HG3  LYS 117           HG3      LYS 117   5.701   4.247  -3.507
  958    HD2  LYS 117           HD2      LYS 117   5.667   4.918  -1.147
  959    HD3  LYS 117           HD3      LYS 117   3.994   4.369  -1.018
  960    HE2  LYS 117           HE2      LYS 117   4.682   2.093  -1.519
  961    HE3  LYS 117           HE3      LYS 117   6.346   2.623  -1.750
  962    HZ1  LYS 117           HZ1      LYS 117   4.822   2.731   0.802
  963    HZ2  LYS 117           HZ2      LYS 117   6.411   3.285   0.595
  964    HZ3  LYS 117           HZ3      LYS 117   6.056   1.639   0.425
  965    H    LEU 118           H        LEU 118   2.624   8.683  -2.969
  966    HA   LEU 118           HA       LEU 118   3.254   9.365  -0.330
  967    HB2  LEU 118           HB2      LEU 118   1.265  10.724  -2.143
  968    HB3  LEU 118           HB3      LEU 118   1.901  11.401  -0.665
  969    HG   LEU 118           HG       LEU 118   3.291  11.003  -3.286
  970   HD11  LEU 118          HD11      LEU 118   3.686  13.383  -3.026
  971   HD12  LEU 118          HD12      LEU 118   2.925  13.349  -1.428
  972   HD13  LEU 118          HD13      LEU 118   1.963  13.022  -2.868
  973   HD21  LEU 118          HD21      LEU 118   4.779  10.164  -1.483
  974   HD22  LEU 118          HD22      LEU 118   4.615  11.722  -0.672
  975   HD23  LEU 118          HD23      LEU 118   5.381  11.630  -2.256
  976    H    LEU 119           H        LEU 119   0.139   8.693  -1.843
  977    HA   LEU 119           HA       LEU 119  -1.525   9.034   0.360
  978    HB2  LEU 119           HB2      LEU 119  -1.672   7.339  -2.105
  979    HB3  LEU 119           HB3      LEU 119  -2.898   7.170  -0.865
  980    HG   LEU 119           HG       LEU 119  -3.608   8.655  -2.702
  981   HD11  LEU 119          HD11      LEU 119  -4.549   8.923  -0.477
  982   HD12  LEU 119          HD12      LEU 119  -4.434  10.470  -1.316
  983   HD13  LEU 119          HD13      LEU 119  -3.264  10.058  -0.062
  984   HD21  LEU 119          HD21      LEU 119  -1.356  10.431  -1.762
  985   HD22  LEU 119          HD22      LEU 119  -2.630  10.916  -2.878
  986   HD23  LEU 119          HD23      LEU 119  -1.494   9.646  -3.336
  987    H    ALA 120           H        ALA 120   0.470   6.334  -0.600
  988    HA   ALA 120           HA       ALA 120  -0.617   4.474   1.274
  989    HB1  ALA 120           HB1      ALA 120   1.150   3.011   0.562
  990    HB2  ALA 120           HB2      ALA 120   2.030   4.360  -0.158
  991    HB3  ALA 120           HB3      ALA 120   0.491   3.844  -0.849
  992    H    LEU 121           H        LEU 121   2.198   6.627   1.257
  993    HA   LEU 121           HA       LEU 121   3.210   5.810   3.793
  994    HB2  LEU 121           HB2      LEU 121   3.610   8.147   1.985
  995    HB3  LEU 121           HB3      LEU 121   4.145   8.282   3.646
  996    HG   LEU 121           HG       LEU 121   5.628   6.359   3.330
  997   HD11  LEU 121          HD11      LEU 121   6.027   5.458   1.109
  998   HD12  LEU 121          HD12      LEU 121   4.711   6.442   0.469
  999   HD13  LEU 121          HD13      LEU 121   4.370   5.160   1.632
 1000   HD21  LEU 121          HD21      LEU 121   5.929   8.537   1.272
 1001   HD22  LEU 121          HD22      LEU 121   7.219   7.466   1.827
 1002   HD23  LEU 121          HD23      LEU 121   6.470   8.602   2.950
 1003    H    GLY 122           H        GLY 122   0.618   7.829   2.789
 1004    HA2  GLY 122           HA2      GLY 122  -0.926   9.013   4.042
 1005    HA3  GLY 122           HA3      GLY 122  -0.046   8.559   5.499
 1006    H    LEU 123           H        LEU 123   1.542  10.026   2.761
 1007    HA   LEU 123           HA       LEU 123   2.430  12.256   4.359
 1008    HB2  LEU 123           HB2      LEU 123   2.806  11.526   1.457
 1009    HB3  LEU 123           HB3      LEU 123   3.488  12.973   2.182
 1010    HG   LEU 123           HG       LEU 123   4.145  10.112   2.879
 1011   HD11  LEU 123          HD11      LEU 123   5.716  12.339   1.606
 1012   HD12  LEU 123          HD12      LEU 123   5.250  10.799   0.885
 1013   HD13  LEU 123          HD13      LEU 123   6.428  10.838   2.193
 1014   HD21  LEU 123          HD21      LEU 123   5.119  12.661   4.161
 1015   HD22  LEU 123          HD22      LEU 123   5.766  11.047   4.462
 1016   HD23  LEU 123          HD23      LEU 123   4.106  11.428   4.913
 1017    H    VAL 124           H        VAL 124  -0.101  11.517   2.237
 1018    HA   VAL 124           HA       VAL 124  -1.309  14.120   2.708
 1019    HB   VAL 124           HB       VAL 124  -2.090  14.222   0.313
 1020   HG11  VAL 124          HG11      VAL 124  -0.351  15.720   1.129
 1021   HG12  VAL 124          HG12      VAL 124  -0.034  15.247  -0.539
 1022   HG13  VAL 124          HG13      VAL 124   0.878  14.506   0.775
 1023   HG21  VAL 124          HG21      VAL 124   0.081  12.164  -0.039
 1024   HG22  VAL 124          HG22      VAL 124  -0.704  13.032  -1.355
 1025   HG23  VAL 124          HG23      VAL 124  -1.642  11.945  -0.332
 1026    H    ALA 125           H        ALA 125  -3.590  14.016   1.656
 1027    HA   ALA 125           HA       ALA 125  -4.734  11.336   2.150
 1028    HB1  ALA 125           HB1      ALA 125  -6.762  12.403   2.944
 1029    HB2  ALA 125           HB2      ALA 125  -6.080  13.995   2.622
 1030    HB3  ALA 125           HB3      ALA 125  -5.382  12.974   3.878
 1031    H    GLU 126           H        GLU 126  -4.031  13.610  -0.094
 1032    HA   GLU 126           HA       GLU 126  -5.775  12.539  -2.108
 1033    HB2  GLU 126           HB2      GLU 126  -6.782  14.742  -2.665
 1034    HB3  GLU 126           HB3      GLU 126  -7.284  14.161  -1.081
 1035    HG2  GLU 126           HG2      GLU 126  -5.329  15.586  -0.197
 1036    HG3  GLU 126           HG3      GLU 126  -5.400  16.380  -1.765
 1037    H    ARG 127           H        ARG 127  -5.083  13.181  -4.221
 1038    HA   ARG 127           HA       ARG 127  -2.307  13.890  -4.372
 1039    HB2  ARG 127           HB2      ARG 127  -4.410  13.134  -6.346
 1040    HB3  ARG 127           HB3      ARG 127  -2.949  13.923  -6.927
 1041    HG2  ARG 127           HG2      ARG 127  -1.592  12.189  -5.931
 1042    HG3  ARG 127           HG3      ARG 127  -3.034  11.409  -5.282
 1043    HD2  ARG 127           HD2      ARG 127  -2.720  11.921  -8.217
 1044    HD3  ARG 127           HD3      ARG 127  -2.012  10.497  -7.459
 1045    HE   ARG 127           HE       ARG 127  -4.891  11.110  -7.613
 1046   HH11  ARG 127          HH11      ARG 127  -2.261   8.855  -7.084
 1047   HH12  ARG 127          HH12      ARG 127  -3.270   7.446  -7.079
 1048   HH21  ARG 127          HH21      ARG 127  -6.247   9.258  -7.624
 1049   HH22  ARG 127          HH22      ARG 127  -5.548   7.685  -7.415
 1050    H    ARG 128           H        ARG 128  -5.249  15.523  -4.453
 1051    HA   ARG 128           HA       ARG 128  -4.883  17.740  -6.017
 1052    HB2  ARG 128           HB2      ARG 128  -6.966  17.172  -4.914
 1053    HB3  ARG 128           HB3      ARG 128  -6.251  17.477  -3.341
 1054    HG2  ARG 128           HG2      ARG 128  -6.032  19.838  -3.892
 1055    HG3  ARG 128           HG3      ARG 128  -6.741  19.528  -5.478
 1056    HD2  ARG 128           HD2      ARG 128  -8.129  18.894  -2.884
 1057    HD3  ARG 128           HD3      ARG 128  -8.324  20.424  -3.736
 1058    HE   ARG 128           HE       ARG 128  -9.262  19.141  -5.595
 1059   HH11  ARG 128          HH11      ARG 128  -9.048  17.486  -2.503
 1060   HH12  ARG 128          HH12      ARG 128 -10.421  16.469  -2.822
 1061   HH21  ARG 128          HH21      ARG 128 -11.055  17.805  -6.009
 1062   HH22  ARG 128          HH22      ARG 128 -11.563  16.646  -4.819
 1063    H    GLU 129           H        GLU 129  -3.528  17.114  -2.832
 1064    HA   GLU 129           HA       GLU 129  -2.743  19.812  -2.340
 1065    HB2  GLU 129           HB2      GLU 129  -1.924  17.208  -1.060
 1066    HB3  GLU 129           HB3      GLU 129  -1.391  18.784  -0.490
 1067    HG2  GLU 129           HG2      GLU 129  -4.229  17.812  -0.648
 1068    HG3  GLU 129           HG3      GLU 129  -3.258  17.982   0.816
 1069    H    LEU 130           H        LEU 130  -1.215  17.061  -3.832
 1070    HA   LEU 130           HA       LEU 130   1.395  18.359  -3.817
 1071    HB2  LEU 130           HB2      LEU 130   1.928  16.136  -5.131
 1072    HB3  LEU 130           HB3      LEU 130   1.791  16.159  -3.384
 1073    HG   LEU 130           HG       LEU 130  -0.695  15.586  -4.897
 1074   HD11  LEU 130          HD11      LEU 130   0.812  14.256  -6.167
 1075   HD12  LEU 130          HD12      LEU 130  -0.048  13.199  -5.047
 1076   HD13  LEU 130          HD13      LEU 130   1.615  13.678  -4.707
 1077   HD21  LEU 130          HD21      LEU 130   0.595  14.476  -2.408
 1078   HD22  LEU 130          HD22      LEU 130  -0.964  13.963  -3.052
 1079   HD23  LEU 130          HD23      LEU 130  -0.745  15.622  -2.488
 1080    H    TYR 131           H        TYR 131  -1.011  19.179  -5.401
 1081    HA   TYR 131           HA       TYR 131   0.297  19.299  -8.016
 1082    HB2  TYR 131           HB2      TYR 131  -2.657  19.076  -7.407
 1083    HB3  TYR 131           HB3      TYR 131  -2.035  19.565  -8.978
 1084    HD1  TYR 131           HD1      TYR 131   0.384  17.627  -8.906
 1085    HD2  TYR 131           HD2      TYR 131  -3.774  17.088  -8.176
 1086    HE1  TYR 131           HE1      TYR 131   0.583  15.273  -9.564
 1087    HE2  TYR 131           HE2      TYR 131  -3.584  14.726  -8.836
 1088    HH   TYR 131           HH       TYR 131  -0.526  13.197  -9.333
 1089    H    LYS 132           H        LYS 132   0.446  21.197  -8.939
 1090    HA   LYS 132           HA       LYS 132   1.315  23.264  -7.592
 1091    HB2  LYS 132           HB2      LYS 132   0.903  24.650  -9.668
 1092    HB3  LYS 132           HB3      LYS 132   1.754  23.134  -9.861
 1093    HG2  LYS 132           HG2      LYS 132  -0.382  22.081 -10.581
 1094    HG3  LYS 132           HG3      LYS 132  -1.125  23.679 -10.552
 1095    HD2  LYS 132           HD2      LYS 132   0.403  24.479 -12.226
 1096    HD3  LYS 132           HD3      LYS 132   1.320  22.976 -12.167
 1097    HE2  LYS 132           HE2      LYS 132  -0.724  21.781 -12.937
 1098    HE3  LYS 132           HE3      LYS 132  -1.506  23.349 -13.139
 1099    HZ1  LYS 132           HZ1      LYS 132   0.971  22.487 -14.524
 1100    HZ2  LYS 132           HZ2      LYS 132   0.166  23.956 -14.751
 1101    HZ3  LYS 132           HZ3      LYS 132  -0.573  22.508 -15.212
 1102    H    LYS 133           H        LYS 133  -0.733  25.290  -9.198
 1103    HA   LYS 133           HA       LYS 133  -1.142  26.793  -6.963
 1104    HB2  LYS 133           HB2      LYS 133  -2.988  27.933  -8.181
 1105    HB3  LYS 133           HB3      LYS 133  -1.472  27.834  -9.066
 1106    HG2  LYS 133           HG2      LYS 133  -2.435  25.890 -10.308
 1107    HG3  LYS 133           HG3      LYS 133  -3.964  26.194  -9.484
 1108    HD2  LYS 133           HD2      LYS 133  -2.498  28.098 -11.313
 1109    HD3  LYS 133           HD3      LYS 133  -3.967  27.201 -11.698
 1110    HE2  LYS 133           HE2      LYS 133  -3.683  29.322  -9.570
 1111    HE3  LYS 133           HE3      LYS 133  -4.468  29.522 -11.134
 1112    HZ1  LYS 133           HZ1      LYS 133  -6.123  27.915 -10.504
 1113    HZ2  LYS 133           HZ2      LYS 133  -6.051  29.130  -9.332
 1114    HZ3  LYS 133           HZ3      LYS 133  -5.347  27.623  -9.031
 1115    H    ARG 134           H        ARG 134  -2.722  27.183  -5.528
 1116    HA   ARG 134           HA       ARG 134  -3.897  24.714  -4.670
 1117    HB2  ARG 134           HB2      ARG 134  -4.144  27.337  -3.229
 1118    HB3  ARG 134           HB3      ARG 134  -4.111  25.706  -2.563
 1119    HG2  ARG 134           HG2      ARG 134  -1.819  27.151  -3.843
 1120    HG3  ARG 134           HG3      ARG 134  -2.027  26.855  -2.118
 1121    HD2  ARG 134           HD2      ARG 134  -1.947  24.420  -2.589
 1122    HD3  ARG 134           HD3      ARG 134  -1.629  24.793  -4.284
 1123    HE   ARG 134           HE       ARG 134   0.233  25.986  -2.424
 1124   HH11  ARG 134          HH11      ARG 134  -0.484  23.181  -4.392
 1125   HH12  ARG 134          HH12      ARG 134   1.171  22.672  -4.496
 1126   HH21  ARG 134          HH21      ARG 134   2.420  25.331  -2.571
 1127   HH22  ARG 134          HH22      ARG 134   2.835  23.901  -3.462
 1128    H    GLN 135           H        GLN 135  -5.355  24.586  -6.335
 1129    HA   GLN 135           HA       GLN 135  -7.612  25.903  -6.938
 1130    HB2  GLN 135           HB2      GLN 135  -8.604  23.326  -6.388
 1131    HB3  GLN 135           HB3      GLN 135  -8.090  23.969  -7.934
 1132    HG2  GLN 135           HG2      GLN 135  -7.053  21.804  -7.452
 1133    HG3  GLN 135           HG3      GLN 135  -5.837  23.089  -7.565
 1134   HE21  GLN 135          HE21      GLN 135  -4.304  22.055  -6.354
 1135   HE22  GLN 135          HE22      GLN 135  -4.476  21.740  -4.666
 1136    H    LYS 136           H        LYS 136  -8.455  27.248  -5.346
 1137    HA   LYS 136           HA       LYS 136  -9.878  25.907  -3.171
 1138    HB2  LYS 136           HB2      LYS 136  -9.461  28.830  -3.820
 1139    HB3  LYS 136           HB3      LYS 136 -10.532  28.274  -2.539
 1140    HG2  LYS 136           HG2      LYS 136  -8.626  27.127  -1.477
 1141    HG3  LYS 136           HG3      LYS 136  -7.568  27.774  -2.729
 1142    HD2  LYS 136           HD2      LYS 136  -9.235  29.500  -0.916
 1143    HD3  LYS 136           HD3      LYS 136  -7.578  29.025  -0.546
 1144    HE2  LYS 136           HE2      LYS 136  -6.848  30.070  -2.665
 1145    HE3  LYS 136           HE3      LYS 136  -8.504  30.614  -2.938
 1146    HZ1  LYS 136           HZ1      LYS 136  -8.385  31.891  -0.893
 1147    HZ2  LYS 136           HZ2      LYS 136  -7.148  32.354  -1.952
 1148    HZ3  LYS 136           HZ3      LYS 136  -6.798  31.368  -0.626
 1149    H    LYS 137           H        LYS 137 -10.700  24.925  -5.270
 1150    HA   LYS 137           HA       LYS 137 -13.334  25.963  -5.898
 1151    HB2  LYS 137           HB2      LYS 137 -12.112  27.040  -7.641
 1152    HB3  LYS 137           HB3      LYS 137 -11.056  25.656  -7.864
 1153    HG2  LYS 137           HG2      LYS 137 -12.512  25.821  -9.742
 1154    HG3  LYS 137           HG3      LYS 137 -12.980  24.405  -8.800
 1155    HD2  LYS 137           HD2      LYS 137 -14.784  25.733  -7.772
 1156    HD3  LYS 137           HD3      LYS 137 -14.339  27.099  -8.794
 1157    HE2  LYS 137           HE2      LYS 137 -15.088  24.400  -9.888
 1158    HE3  LYS 137           HE3      LYS 137 -16.267  25.680  -9.608
 1159    HZ1  LYS 137           HZ1      LYS 137 -13.888  25.932 -11.370
 1160    HZ2  LYS 137           HZ2      LYS 137 -15.110  27.082 -11.161
 1161    HZ3  LYS 137           HZ3      LYS 137 -15.457  25.608 -11.908
 1162    H    LEU 138           H        LEU 138 -14.727  24.211  -6.494
 1163    HA   LEU 138           HA       LEU 138 -13.884  21.640  -5.650
 1164    HB2  LEU 138           HB2      LEU 138 -16.321  22.439  -7.245
 1165    HB3  LEU 138           HB3      LEU 138 -16.071  20.863  -6.522
 1166    HG   LEU 138           HG       LEU 138 -16.372  23.468  -5.027
 1167   HD11  LEU 138          HD11      LEU 138 -18.209  21.092  -5.287
 1168   HD12  LEU 138          HD12      LEU 138 -18.456  22.686  -5.999
 1169   HD13  LEU 138          HD13      LEU 138 -18.475  22.491  -4.247
 1170   HD21  LEU 138          HD21      LEU 138 -15.954  20.652  -4.032
 1171   HD22  LEU 138          HD22      LEU 138 -16.424  22.016  -3.019
 1172   HD23  LEU 138          HD23      LEU 138 -14.860  22.020  -3.833
 1173    H    ALA 139           H        ALA 139 -11.994  21.365  -6.951
 1174    HA   ALA 139           HA       ALA 139 -12.598  20.382  -9.665
 1175    HB1  ALA 139           HB1      ALA 139 -11.110  22.399  -9.595
 1176    HB2  ALA 139           HB2      ALA 139 -10.378  20.984 -10.350
 1177    HB3  ALA 139           HB3      ALA 139  -9.932  21.427  -8.704
 1178    H    SER 140           H        SER 140 -12.034  18.316 -10.115
 1179    HA   SER 140           HA       SER 140 -10.852  16.774  -7.958
 1180    HB2  SER 140           HB2      SER 140 -11.861  15.864 -10.667
 1181    HB3  SER 140           HB3      SER 140 -11.413  14.816  -9.321
 1182    HG   SER 140           HG       SER 140 -13.356  16.816  -8.950
 1183    H    SER 141           H        SER 141  -8.786  17.933  -8.144
 1184    HA   SER 141           HA       SER 141  -7.147  16.954 -10.348
 1185    HB2  SER 141           HB2      SER 141  -6.669  18.981  -8.152
 1186    HB3  SER 141           HB3      SER 141  -5.415  18.478  -9.295
 1187    HG   SER 141           HG       SER 141  -7.490  19.050 -10.757
  Start of MODEL    7
    1    H1   ASP   1           HT1      ASP   1 -20.584   4.620 -10.789
    2    H2   ASP   1           HT2      ASP   1 -21.447   5.995 -11.263
    3    H3   ASP   1           HT3      ASP   1 -21.954   4.465 -11.769
    4    HA   ASP   1           HA       ASP   1 -22.503   3.831  -9.545
    5    HB2  ASP   1           HB2      ASP   1 -22.006   5.100  -7.678
    6    HB3  ASP   1           HB3      ASP   1 -20.666   5.570  -8.711
    7    HA   PRO   2           HA       PRO   2 -26.619   5.155 -10.259
    8    HB2  PRO   2           HB2      PRO   2 -27.389   6.131  -7.736
    9    HB3  PRO   2           HB3      PRO   2 -27.577   4.481  -8.334
   10    HG2  PRO   2           HG2      PRO   2 -25.462   5.638  -6.587
   11    HG3  PRO   2           HG3      PRO   2 -26.181   4.016  -6.566
   12    HD2  PRO   2           HD2      PRO   2 -23.737   4.421  -7.557
   13    HD3  PRO   2           HD3      PRO   2 -24.850   3.271  -8.324
   14    H    SER   3           H        SER   3 -24.908   7.594  -8.210
   15    HA   SER   3           HA       SER   3 -26.041   9.658  -9.919
   16    HB2  SER   3           HB2      SER   3 -27.784   9.253  -8.214
   17    HB3  SER   3           HB3      SER   3 -26.613   9.643  -6.954
   18    HG   SER   3           HG       SER   3 -27.599  11.363  -8.989
   19    H    ARG   4           H        ARG   4 -24.167   9.124  -6.900
   20    HA   ARG   4           HA       ARG   4 -22.475  11.394  -7.648
   21    HB2  ARG   4           HB2      ARG   4 -23.986  11.153  -5.044
   22    HB3  ARG   4           HB3      ARG   4 -22.679  12.294  -5.321
   23    HG2  ARG   4           HG2      ARG   4 -23.943  13.439  -6.995
   24    HG3  ARG   4           HG3      ARG   4 -25.212  12.214  -6.945
   25    HD2  ARG   4           HD2      ARG   4 -25.806  14.276  -5.716
   26    HD3  ARG   4           HD3      ARG   4 -25.791  12.843  -4.691
   27    HE   ARG   4           HE       ARG   4 -24.041  13.732  -3.503
   28   HH11  ARG   4          HH11      ARG   4 -24.543  15.621  -6.408
   29   HH12  ARG   4          HH12      ARG   4 -23.479  16.897  -5.914
   30   HH21  ARG   4          HH21      ARG   4 -22.657  15.423  -2.841
   31   HH22  ARG   4          HH22      ARG   4 -22.397  16.782  -3.890
   32    H    ARG   5           H        ARG   5 -20.379  11.151  -7.090
   33    HA   ARG   5           HA       ARG   5 -19.563   8.826  -5.592
   34    HB2  ARG   5           HB2      ARG   5 -17.235  10.053  -5.795
   35    HB3  ARG   5           HB3      ARG   5 -17.935   9.211  -7.161
   36    HG2  ARG   5           HG2      ARG   5 -16.988  11.288  -7.887
   37    HG3  ARG   5           HG3      ARG   5 -18.737  11.376  -8.049
   38    HD2  ARG   5           HD2      ARG   5 -18.895  12.721  -6.052
   39    HD3  ARG   5           HD3      ARG   5 -17.173  12.506  -5.733
   40    HE   ARG   5           HE       ARG   5 -17.730  13.712  -8.285
   41   HH11  ARG   5          HH11      ARG   5 -17.298  14.339  -4.869
   42   HH12  ARG   5          HH12      ARG   5 -16.764  15.971  -5.103
   43   HH21  ARG   5          HH21      ARG   5 -17.015  15.862  -8.600
   44   HH22  ARG   5          HH22      ARG   5 -16.617  16.841  -7.225
   45    H    ALA   6           H        ALA   6 -20.944   9.541  -3.796
   46    HA   ALA   6           HA       ALA   6 -19.835  11.774  -2.229
   47    HB1  ALA   6           HB1      ALA   6 -22.581  10.579  -2.275
   48    HB2  ALA   6           HB2      ALA   6 -22.095  12.131  -2.976
   49    HB3  ALA   6           HB3      ALA   6 -22.056  11.898  -1.222
   50    HA   PRO   7           HA       PRO   7 -19.807   8.895   1.229
   51    HB2  PRO   7           HB2      PRO   7 -18.603  10.861   2.843
   52    HB3  PRO   7           HB3      PRO   7 -17.835   9.453   2.116
   53    HG2  PRO   7           HG2      PRO   7 -17.251  12.077   1.450
   54    HG3  PRO   7           HG3      PRO   7 -16.965  10.684   0.392
   55    HD2  PRO   7           HD2      PRO   7 -19.272  12.609   0.397
   56    HD3  PRO   7           HD3      PRO   7 -18.371  11.929  -0.982
   57    H    THR   8           H        THR   8 -21.785   8.783   2.069
   58    HA   THR   8           HA       THR   8 -22.273  10.717   4.210
   59    HB   THR   8           HB       THR   8 -24.740  10.268   4.029
   60    HG1  THR   8           HG1      THR   8 -24.613   8.398   2.714
   61   HG21  THR   8          HG21      THR   8 -25.153  11.815   2.171
   62   HG22  THR   8          HG22      THR   8 -23.491  11.599   1.627
   63   HG23  THR   8          HG23      THR   8 -23.815  12.361   3.183
   64    H    TRP   9           H        TRP   9 -21.363   9.438   5.752
   65    HA   TRP   9           HA       TRP   9 -22.447   6.719   6.035
   66    HB2  TRP   9           HB2      TRP   9 -19.506   7.428   6.220
   67    HB3  TRP   9           HB3      TRP   9 -20.204   5.839   6.489
   68    HD1  TRP   9           HD1      TRP   9 -19.614   8.360   3.625
   69    HE1  TRP   9           HE1      TRP   9 -19.467   7.044   1.410
   70    HE3  TRP   9           HE3      TRP   9 -20.746   3.688   5.368
   71    HZ2  TRP   9           HZ2      TRP   9 -19.762   4.395   0.538
   72    HZ3  TRP   9           HZ3      TRP   9 -20.792   1.816   3.768
   73    HH2  TRP   9           HH2      TRP   9 -20.312   2.166   1.403
   74    H    SER  10           H        SER  10 -23.104   6.329   8.022
   75    HA   SER  10           HA       SER  10 -22.281   8.057  10.205
   76    HB2  SER  10           HB2      SER  10 -23.974   6.680  11.482
   77    HB3  SER  10           HB3      SER  10 -24.641   7.522  10.082
   78    HG   SER  10           HG       SER  10 -25.267   5.276  10.274
   79    HA   PRO  11           HA       PRO  11 -19.369   5.231  12.167
   80    HB2  PRO  11           HB2      PRO  11 -21.304   5.078  14.433
   81    HB3  PRO  11           HB3      PRO  11 -19.566   5.398  14.459
   82    HG2  PRO  11           HG2      PRO  11 -21.324   7.372  14.794
   83    HG3  PRO  11           HG3      PRO  11 -19.828   7.618  13.873
   84    HD2  PRO  11           HD2      PRO  11 -22.626   7.320  12.899
   85    HD3  PRO  11           HD3      PRO  11 -21.287   8.267  12.221
   86    H    GLU  12           H        GLU  12 -22.813   4.531  12.318
   87    HA   GLU  12           HA       GLU  12 -22.546   1.709  12.620
   88    HB2  GLU  12           HB2      GLU  12 -24.869   3.362  11.620
   89    HB3  GLU  12           HB3      GLU  12 -24.949   1.661  12.044
   90    HG2  GLU  12           HG2      GLU  12 -24.259   3.889  13.938
   91    HG3  GLU  12           HG3      GLU  12 -25.842   3.129  13.795
   92    H    GLU  13           H        GLU  13 -22.840   3.891   9.853
   93    HA   GLU  13           HA       GLU  13 -23.553   1.878   7.990
   94    HB2  GLU  13           HB2      GLU  13 -23.851   4.424   7.764
   95    HB3  GLU  13           HB3      GLU  13 -22.181   4.434   7.208
   96    HG2  GLU  13           HG2      GLU  13 -23.784   4.374   5.352
   97    HG3  GLU  13           HG3      GLU  13 -22.740   2.950   5.377
   98    H    GLU  14           H        GLU  14 -20.417   3.373   8.798
   99    HA   GLU  14           HA       GLU  14 -19.033   1.751   6.894
  100    HB2  GLU  14           HB2      GLU  14 -18.052   3.440   9.189
  101    HB3  GLU  14           HB3      GLU  14 -16.967   2.507   8.166
  102    HG2  GLU  14           HG2      GLU  14 -17.986   3.718   6.197
  103    HG3  GLU  14           HG3      GLU  14 -18.753   4.781   7.369
  104    H    ALA  15           H        ALA  15 -20.027   1.339  10.202
  105    HA   ALA  15           HA       ALA  15 -18.506  -1.019  10.697
  106    HB1  ALA  15           HB1      ALA  15 -20.062  -1.408  12.533
  107    HB2  ALA  15           HB2      ALA  15 -21.133  -0.156  11.903
  108    HB3  ALA  15           HB3      ALA  15 -19.534   0.274  12.511
  109    H    HIS  16           H        HIS  16 -21.398  -0.268   9.043
  110    HA   HIS  16           HA       HIS  16 -22.334  -2.944   8.662
  111    HB2  HIS  16           HB2      HIS  16 -23.912  -1.096   8.764
  112    HB3  HIS  16           HB3      HIS  16 -23.115  -0.298   7.417
  113    HD1  HIS  16           HD1      HIS  16 -24.962  -0.272   5.757
  114    HD2  HIS  16           HD2      HIS  16 -24.322  -4.052   7.383
  115    HE1  HIS  16           HE1      HIS  16 -26.413  -1.858   4.429
  116    HE2  HIS  16           HE2      HIS  16 -25.993  -4.136   5.411
  117    H    LEU  17           H        LEU  17 -20.331  -0.632   6.998
  118    HA   LEU  17           HA       LEU  17 -20.217  -1.931   4.490
  119    HB2  LEU  17           HB2      LEU  17 -19.485   0.432   5.051
  120    HB3  LEU  17           HB3      LEU  17 -18.038  -0.270   5.748
  121    HG   LEU  17           HG       LEU  17 -17.485  -1.242   3.528
  122   HD11  LEU  17          HD11      LEU  17 -19.900   0.330   2.668
  123   HD12  LEU  17          HD12      LEU  17 -19.670  -1.414   2.559
  124   HD13  LEU  17          HD13      LEU  17 -18.696  -0.331   1.567
  125   HD21  LEU  17          HD21      LEU  17 -16.540   0.892   4.245
  126   HD22  LEU  17          HD22      LEU  17 -17.919   1.735   3.539
  127   HD23  LEU  17          HD23      LEU  17 -16.802   0.847   2.501
  128    H    ARG  18           H        ARG  18 -18.143  -2.069   7.375
  129    HA   ARG  18           HA       ARG  18 -16.498  -4.157   6.346
  130    HB2  ARG  18           HB2      ARG  18 -15.624  -4.340   8.633
  131    HB3  ARG  18           HB3      ARG  18 -15.680  -2.657   8.126
  132    HG2  ARG  18           HG2      ARG  18 -17.931  -2.574   9.347
  133    HG3  ARG  18           HG3      ARG  18 -17.426  -4.089  10.092
  134    HD2  ARG  18           HD2      ARG  18 -15.782  -1.568  10.155
  135    HD3  ARG  18           HD3      ARG  18 -16.927  -2.012  11.414
  136    HE   ARG  18           HE       ARG  18 -15.031  -4.089  10.926
  137   HH11  ARG  18          HH11      ARG  18 -15.462  -0.987  12.485
  138   HH12  ARG  18          HH12      ARG  18 -14.287  -1.288  13.720
  139   HH21  ARG  18          HH21      ARG  18 -13.471  -4.496  12.574
  140   HH22  ARG  18          HH22      ARG  18 -13.175  -3.292  13.787
  141    H    GLU  19           H        GLU  19 -19.422  -3.887   8.201
  142    HA   GLU  19           HA       GLU  19 -19.816  -6.402   9.178
  143    HB2  GLU  19           HB2      GLU  19 -21.357  -4.545   9.559
  144    HB3  GLU  19           HB3      GLU  19 -21.865  -4.618   7.879
  145    HG2  GLU  19           HG2      GLU  19 -23.527  -5.649   9.239
  146    HG3  GLU  19           HG3      GLU  19 -22.724  -6.882   8.271
  147    H    LEU  20           H        LEU  20 -20.655  -5.172   5.989
  148    HA   LEU  20           HA       LEU  20 -21.652  -7.603   4.940
  149    HB2  LEU  20           HB2      LEU  20 -21.424  -4.889   4.170
  150    HB3  LEU  20           HB3      LEU  20 -20.693  -5.847   2.901
  151    HG   LEU  20           HG       LEU  20 -23.446  -6.448   3.942
  152   HD11  LEU  20          HD11      LEU  20 -24.337  -5.141   2.112
  153   HD12  LEU  20          HD12      LEU  20 -22.712  -4.668   1.626
  154   HD13  LEU  20          HD13      LEU  20 -23.366  -4.117   3.167
  155   HD21  LEU  20          HD21      LEU  20 -23.666  -7.499   1.719
  156   HD22  LEU  20          HD22      LEU  20 -22.388  -8.224   2.696
  157   HD23  LEU  20          HD23      LEU  20 -21.976  -7.108   1.398
  158    H    TYR  21           H        TYR  21 -18.479  -6.131   5.030
  159    HA   TYR  21           HA       TYR  21 -17.287  -7.704   2.982
  160    HB2  TYR  21           HB2      TYR  21 -16.318  -5.561   3.704
  161    HB3  TYR  21           HB3      TYR  21 -16.033  -6.218   5.310
  162    HD1  TYR  21           HD1      TYR  21 -14.956  -6.335   1.786
  163    HD2  TYR  21           HD2      TYR  21 -14.136  -7.609   5.757
  164    HE1  TYR  21           HE1      TYR  21 -12.725  -7.079   1.081
  165    HE2  TYR  21           HE2      TYR  21 -11.904  -8.363   5.061
  166    HH   TYR  21           HH       TYR  21 -10.544  -7.521   2.053
  167    H    LEU  22           H        LEU  22 -17.238  -7.833   6.496
  168    HA   LEU  22           HA       LEU  22 -15.639 -10.130   6.767
  169    HB2  LEU  22           HB2      LEU  22 -17.799  -9.303   8.690
  170    HB3  LEU  22           HB3      LEU  22 -16.289 -10.113   9.047
  171    HG   LEU  22           HG       LEU  22 -16.478  -7.275   8.057
  172   HD11  LEU  22          HD11      LEU  22 -16.116  -8.295  10.863
  173   HD12  LEU  22          HD12      LEU  22 -17.540  -7.476  10.224
  174   HD13  LEU  22          HD13      LEU  22 -16.010  -6.611  10.350
  175   HD21  LEU  22          HD21      LEU  22 -14.354  -8.463   7.597
  176   HD22  LEU  22          HD22      LEU  22 -14.170  -8.729   9.331
  177   HD23  LEU  22          HD23      LEU  22 -14.182  -7.086   8.685
  178    H    ALA  23           H        ALA  23 -18.994  -9.736   6.017
  179    HA   ALA  23           HA       ALA  23 -19.798 -12.347   6.917
  180    HB1  ALA  23           HB1      ALA  23 -21.318 -10.409   6.984
  181    HB2  ALA  23           HB2      ALA  23 -21.983 -11.766   6.077
  182    HB3  ALA  23           HB3      ALA  23 -21.320 -10.374   5.220
  183    H    ASN  24           H        ASN  24 -18.716 -10.961   3.884
  184    HA   ASN  24           HA       ASN  24 -19.445 -13.483   2.547
  185    HB2  ASN  24           HB2      ASN  24 -19.396 -10.681   1.420
  186    HB3  ASN  24           HB3      ASN  24 -19.612 -12.132   0.448
  187   HD21  ASN  24          HD21      ASN  24 -21.051  -9.983   2.752
  188   HD22  ASN  24          HD22      ASN  24 -22.660 -10.617   2.638
  189    H    LYS  25           H        LYS  25 -16.878 -12.588   3.890
  190    HA   LYS  25           HA       LYS  25 -15.033 -12.379   1.660
  191    HB2  LYS  25           HB2      LYS  25 -13.271 -12.289   3.366
  192    HB3  LYS  25           HB3      LYS  25 -14.535 -11.110   3.683
  193    HG2  LYS  25           HG2      LYS  25 -15.433 -12.434   5.451
  194    HG3  LYS  25           HG3      LYS  25 -14.390 -13.795   5.036
  195    HD2  LYS  25           HD2      LYS  25 -13.385 -11.103   5.957
  196    HD3  LYS  25           HD3      LYS  25 -13.632 -12.487   7.024
  197    HE2  LYS  25           HE2      LYS  25 -12.040 -13.783   5.631
  198    HE3  LYS  25           HE3      LYS  25 -11.744 -12.335   4.671
  199    HZ1  LYS  25           HZ1      LYS  25 -10.894 -11.239   6.641
  200    HZ2  LYS  25           HZ2      LYS  25 -10.047 -12.672   6.359
  201    HZ3  LYS  25           HZ3      LYS  25 -11.211 -12.609   7.581
  202    H    ASP  26           H        ASP  26 -16.546 -14.861   3.349
  203    HA   ASP  26           HA       ASP  26 -14.376 -16.781   2.891
  204    HB2  ASP  26           HB2      ASP  26 -15.536 -16.662   5.122
  205    HB3  ASP  26           HB3      ASP  26 -17.006 -17.213   4.328
  206    H    VAL  27           H        VAL  27 -16.049 -15.602   0.760
  207    HA   VAL  27           HA       VAL  27 -17.423 -18.014  -0.208
  208    HB   VAL  27           HB       VAL  27 -18.011 -15.175  -1.061
  209   HG11  VAL  27          HG11      VAL  27 -19.516 -17.755  -1.500
  210   HG12  VAL  27          HG12      VAL  27 -18.570 -16.888  -2.711
  211   HG13  VAL  27          HG13      VAL  27 -20.026 -16.156  -2.040
  212   HG21  VAL  27          HG21      VAL  27 -19.512 -16.902   0.908
  213   HG22  VAL  27          HG22      VAL  27 -20.049 -15.337   0.297
  214   HG23  VAL  27          HG23      VAL  27 -18.596 -15.444   1.289
  215    H    GLU  28           H        GLU  28 -16.140 -19.000  -1.578
  216    HA   GLU  28           HA       GLU  28 -14.190 -17.487  -3.090
  217    HB2  GLU  28           HB2      GLU  28 -14.609 -20.395  -2.513
  218    HB3  GLU  28           HB3      GLU  28 -13.519 -19.882  -3.799
  219    HG2  GLU  28           HG2      GLU  28 -13.283 -18.718  -1.061
  220    HG3  GLU  28           HG3      GLU  28 -12.576 -20.285  -1.432
  221    H    GLY  29           H        GLY  29 -14.005 -17.452  -5.290
  222    HA2  GLY  29           HA2      GLY  29 -14.779 -17.503  -7.487
  223    HA3  GLY  29           HA3      GLY  29 -16.102 -18.543  -6.963
  224    H    GLN  30           H        GLN  30 -15.309 -15.574  -5.376
  225    HA   GLN  30           HA       GLN  30 -17.626 -14.223  -6.506
  226    HB2  GLN  30           HB2      GLN  30 -18.669 -15.400  -4.733
  227    HB3  GLN  30           HB3      GLN  30 -17.329 -15.107  -3.642
  228    HG2  GLN  30           HG2      GLN  30 -18.699 -12.698  -4.610
  229    HG3  GLN  30           HG3      GLN  30 -19.664 -13.766  -3.590
  230   HE21  GLN  30          HE21      GLN  30 -19.671 -12.101  -2.008
  231   HE22  GLN  30          HE22      GLN  30 -18.301 -11.865  -0.984
  232    H    ASP  31           H        ASP  31 -17.624 -11.988  -6.188
  233    HA   ASP  31           HA       ASP  31 -15.103 -10.812  -5.271
  234    HB2  ASP  31           HB2      ASP  31 -17.506  -9.639  -6.679
  235    HB3  ASP  31           HB3      ASP  31 -16.117  -8.684  -6.168
  236    H    VAL  32           H        VAL  32 -15.092 -10.561  -3.078
  237    HA   VAL  32           HA       VAL  32 -17.360 -10.260  -1.463
  238    HB   VAL  32           HB       VAL  32 -15.005 -10.816  -0.676
  239   HG11  VAL  32          HG11      VAL  32 -13.789  -9.005  -1.702
  240   HG12  VAL  32          HG12      VAL  32 -13.616  -8.915   0.050
  241   HG13  VAL  32          HG13      VAL  32 -14.720  -7.819  -0.787
  242   HG21  VAL  32          HG21      VAL  32 -15.321  -9.682   1.520
  243   HG22  VAL  32          HG22      VAL  32 -16.755 -10.517   0.924
  244   HG23  VAL  32          HG23      VAL  32 -16.639  -8.759   0.798
  245    H    VAL  33           H        VAL  33 -15.393  -7.974  -3.170
  246    HA   VAL  33           HA       VAL  33 -16.293  -5.536  -2.239
  247    HB   VAL  33           HB       VAL  33 -15.932  -6.047  -5.164
  248   HG11  VAL  33          HG11      VAL  33 -15.118  -3.762  -3.393
  249   HG12  VAL  33          HG12      VAL  33 -16.504  -3.804  -4.481
  250   HG13  VAL  33          HG13      VAL  33 -14.869  -3.856  -5.137
  251   HG21  VAL  33          HG21      VAL  33 -14.154  -7.315  -4.326
  252   HG22  VAL  33          HG22      VAL  33 -13.796  -6.136  -3.069
  253   HG23  VAL  33          HG23      VAL  33 -13.448  -5.756  -4.755
  254    H    GLU  34           H        GLU  34 -17.503  -7.408  -4.993
  255    HA   GLU  34           HA       GLU  34 -19.604  -5.693  -5.654
  256    HB2  GLU  34           HB2      GLU  34 -18.557  -7.530  -7.066
  257    HB3  GLU  34           HB3      GLU  34 -19.558  -8.662  -6.164
  258    HG2  GLU  34           HG2      GLU  34 -20.715  -8.200  -8.157
  259    HG3  GLU  34           HG3      GLU  34 -21.534  -7.305  -6.876
  260    H    ALA  35           H        ALA  35 -19.395  -8.418  -3.469
  261    HA   ALA  35           HA       ALA  35 -22.112  -8.780  -2.893
  262    HB1  ALA  35           HB1      ALA  35 -19.772  -9.059  -0.999
  263    HB2  ALA  35           HB2      ALA  35 -20.313 -10.296  -2.134
  264    HB3  ALA  35           HB3      ALA  35 -21.366  -9.795  -0.811
  265    H    ILE  36           H        ILE  36 -19.684  -6.655  -1.451
  266    HA   ILE  36           HA       ILE  36 -21.462  -5.457   0.411
  267    HB   ILE  36           HB       ILE  36 -18.928  -4.261  -0.695
  268   HG12  ILE  36          HG12      ILE  36 -19.215  -6.050   1.719
  269   HG13  ILE  36          HG13      ILE  36 -18.669  -6.617   0.146
  270   HG21  ILE  36          HG21      ILE  36 -20.381  -3.884   1.921
  271   HG22  ILE  36          HG22      ILE  36 -20.300  -2.723   0.596
  272   HG23  ILE  36          HG23      ILE  36 -18.840  -3.145   1.491
  273   HD11  ILE  36          HD11      ILE  36 -17.325  -4.544   1.850
  274   HD12  ILE  36          HD12      ILE  36 -16.775  -5.083   0.263
  275   HD13  ILE  36          HD13      ILE  36 -16.807  -6.210   1.618
  276    H    LEU  37           H        LEU  37 -20.038  -4.312  -2.635
  277    HA   LEU  37           HA       LEU  37 -21.022  -1.780  -2.823
  278    HB2  LEU  37           HB2      LEU  37 -21.090  -3.642  -5.183
  279    HB3  LEU  37           HB3      LEU  37 -20.859  -1.919  -5.198
  280    HG   LEU  37           HG       LEU  37 -18.859  -3.909  -4.118
  281   HD11  LEU  37          HD11      LEU  37 -19.222  -4.051  -6.575
  282   HD12  LEU  37          HD12      LEU  37 -17.601  -3.531  -6.124
  283   HD13  LEU  37          HD13      LEU  37 -18.775  -2.354  -6.701
  284   HD21  LEU  37          HD21      LEU  37 -17.332  -2.025  -4.099
  285   HD22  LEU  37          HD22      LEU  37 -18.731  -1.703  -3.075
  286   HD23  LEU  37          HD23      LEU  37 -18.614  -0.960  -4.668
  287    H    ALA  38           H        ALA  38 -22.776  -4.733  -3.615
  288    HA   ALA  38           HA       ALA  38 -24.992  -3.275  -4.757
  289    HB1  ALA  38           HB1      ALA  38 -24.212  -5.320  -5.798
  290    HB2  ALA  38           HB2      ALA  38 -25.882  -5.498  -5.253
  291    HB3  ALA  38           HB3      ALA  38 -24.568  -6.221  -4.324
  292    H    HIS  39           H        HIS  39 -24.320  -4.961  -1.728
  293    HA   HIS  39           HA       HIS  39 -27.103  -5.405  -1.184
  294    HB2  HIS  39           HB2      HIS  39 -24.583  -5.915   0.329
  295    HB3  HIS  39           HB3      HIS  39 -26.126  -5.968   1.177
  296    HD1  HIS  39           HD1      HIS  39 -27.363  -8.123   1.068
  297    HD2  HIS  39           HD2      HIS  39 -24.456  -7.819  -1.883
  298    HE1  HIS  39           HE1      HIS  39 -27.351 -10.352  -0.098
  299    HE2  HIS  39           HE2      HIS  39 -25.716 -10.084  -1.993
  300    H    LEU  40           H        LEU  40 -24.809  -2.888  -0.290
  301    HA   LEU  40           HA       LEU  40 -26.858  -1.879   1.538
  302    HB2  LEU  40           HB2      LEU  40 -25.304  -0.694   2.735
  303    HB3  LEU  40           HB3      LEU  40 -24.428  -2.134   2.287
  304    HG   LEU  40           HG       LEU  40 -24.121   0.531   0.900
  305   HD11  LEU  40          HD11      LEU  40 -23.407   0.663   3.228
  306   HD12  LEU  40          HD12      LEU  40 -22.022   0.709   2.135
  307   HD13  LEU  40          HD13      LEU  40 -22.408  -0.775   3.009
  308   HD21  LEU  40          HD21      LEU  40 -22.065  -0.454   0.024
  309   HD22  LEU  40          HD22      LEU  40 -23.487  -1.358  -0.498
  310   HD23  LEU  40          HD23      LEU  40 -22.467  -1.985   0.797
  311    H    ASN  41           H        ASN  41 -28.276  -1.232  -0.063
  312    HA   ASN  41           HA       ASN  41 -27.569   1.008  -1.762
  313    HB2  ASN  41           HB2      ASN  41 -29.928   0.940  -2.470
  314    HB3  ASN  41           HB3      ASN  41 -29.179  -0.647  -2.589
  315   HD21  ASN  41          HD21      ASN  41 -31.995   0.245  -2.302
  316   HD22  ASN  41          HD22      ASN  41 -32.607  -0.621  -0.937
  317    H    THR  42           H        THR  42 -27.053   1.513   0.849
  318    HA   THR  42           HA       THR  42 -29.242   3.081   1.974
  319    HB   THR  42           HB       THR  42 -28.173   1.548   3.505
  320    HG1  THR  42           HG1      THR  42 -27.026   3.369   4.884
  321   HG21  THR  42          HG21      THR  42 -25.793   1.664   4.050
  322   HG22  THR  42          HG22      THR  42 -25.573   2.950   2.857
  323   HG23  THR  42          HG23      THR  42 -26.023   1.324   2.332
  324    H    VAL  43           H        VAL  43 -26.138   3.415   0.458
  325    HA   VAL  43           HA       VAL  43 -26.245   6.320   0.838
  326    HB   VAL  43           HB       VAL  43 -24.620   5.544   2.436
  327   HG11  VAL  43          HG11      VAL  43 -23.323   4.072   0.167
  328   HG12  VAL  43          HG12      VAL  43 -24.183   3.351   1.523
  329   HG13  VAL  43          HG13      VAL  43 -22.672   4.218   1.798
  330   HG21  VAL  43          HG21      VAL  43 -23.206   6.630   0.008
  331   HG22  VAL  43          HG22      VAL  43 -22.583   6.650   1.658
  332   HG23  VAL  43          HG23      VAL  43 -24.022   7.580   1.246
  333    HA   PRO  44           HA       PRO  44 -25.504   6.114  -3.563
  334    HB2  PRO  44           HB2      PRO  44 -25.670   8.746  -4.077
  335    HB3  PRO  44           HB3      PRO  44 -27.101   7.798  -3.653
  336    HG2  PRO  44           HG2      PRO  44 -25.468   9.632  -1.946
  337    HG3  PRO  44           HG3      PRO  44 -27.227   9.427  -2.007
  338    HD2  PRO  44           HD2      PRO  44 -25.592   8.282  -0.107
  339    HD3  PRO  44           HD3      PRO  44 -27.193   7.666  -0.561
  340    H    ARG  45           H        ARG  45 -23.433   5.467  -3.805
  341    HA   ARG  45           HA       ARG  45 -21.426   7.488  -4.179
  342    HB2  ARG  45           HB2      ARG  45 -19.856   6.003  -2.652
  343    HB3  ARG  45           HB3      ARG  45 -20.815   7.310  -1.975
  344    HG2  ARG  45           HG2      ARG  45 -21.194   5.597  -0.494
  345    HG3  ARG  45           HG3      ARG  45 -22.575   5.434  -1.586
  346    HD2  ARG  45           HD2      ARG  45 -20.878   3.916  -2.885
  347    HD3  ARG  45           HD3      ARG  45 -20.167   3.748  -1.290
  348    HE   ARG  45           HE       ARG  45 -22.164   2.719  -0.532
  349   HH11  ARG  45          HH11      ARG  45 -22.112   3.300  -4.000
  350   HH12  ARG  45          HH12      ARG  45 -23.327   2.109  -4.337
  351   HH21  ARG  45          HH21      ARG  45 -23.758   1.119  -1.019
  352   HH22  ARG  45          HH22      ARG  45 -24.238   0.873  -2.667
  353    H    THR  46           H        THR  46 -19.311   6.412  -4.902
  354    HA   THR  46           HA       THR  46 -19.985   4.613  -7.024
  355    HB   THR  46           HB       THR  46 -17.613   4.780  -7.653
  356    HG1  THR  46           HG1      THR  46 -16.404   6.377  -6.284
  357   HG21  THR  46          HG21      THR  46 -17.527   7.257  -7.944
  358   HG22  THR  46          HG22      THR  46 -18.945   7.374  -6.900
  359   HG23  THR  46          HG23      THR  46 -19.052   6.531  -8.444
  360    H    ARG  47           H        ARG  47 -18.279   2.780  -7.445
  361    HA   ARG  47           HA       ARG  47 -18.569   0.906  -5.302
  362    HB2  ARG  47           HB2      ARG  47 -16.931   0.644  -7.832
  363    HB3  ARG  47           HB3      ARG  47 -17.444  -0.667  -6.781
  364    HG2  ARG  47           HG2      ARG  47 -19.139   1.032  -8.592
  365    HG3  ARG  47           HG3      ARG  47 -18.884  -0.713  -8.650
  366    HD2  ARG  47           HD2      ARG  47 -20.010  -0.884  -6.442
  367    HD3  ARG  47           HD3      ARG  47 -20.370   0.833  -6.532
  368    HE   ARG  47           HE       ARG  47 -21.323  -0.492  -8.842
  369   HH11  ARG  47          HH11      ARG  47 -22.015  -0.106  -5.436
  370   HH12  ARG  47          HH12      ARG  47 -23.715  -0.376  -5.613
  371   HH21  ARG  47          HH21      ARG  47 -23.568  -0.859  -9.085
  372   HH22  ARG  47          HH22      ARG  47 -24.600  -0.805  -7.694
  373    H    LYS  48           H        LYS  48 -16.102   2.995  -6.534
  374    HA   LYS  48           HA       LYS  48 -13.851   2.028  -5.175
  375    HB2  LYS  48           HB2      LYS  48 -13.687   3.691  -6.942
  376    HB3  LYS  48           HB3      LYS  48 -14.607   4.841  -5.984
  377    HG2  LYS  48           HG2      LYS  48 -12.789   4.863  -4.321
  378    HG3  LYS  48           HG3      LYS  48 -11.863   3.777  -5.359
  379    HD2  LYS  48           HD2      LYS  48 -11.054   5.942  -5.823
  380    HD3  LYS  48           HD3      LYS  48 -12.110   5.528  -7.173
  381    HE2  LYS  48           HE2      LYS  48 -12.668   7.740  -6.628
  382    HE3  LYS  48           HE3      LYS  48 -13.947   6.766  -5.906
  383    HZ1  LYS  48           HZ1      LYS  48 -11.598   7.872  -4.461
  384    HZ2  LYS  48           HZ2      LYS  48 -12.845   6.965  -3.768
  385    HZ3  LYS  48           HZ3      LYS  48 -13.170   8.494  -4.407
  386    H    GLN  49           H        GLN  49 -16.470   4.140  -4.187
  387    HA   GLN  49           HA       GLN  49 -15.338   5.162  -1.840
  388    HB2  GLN  49           HB2      GLN  49 -18.222   4.700  -2.595
  389    HB3  GLN  49           HB3      GLN  49 -17.714   5.595  -1.168
  390    HG2  GLN  49           HG2      GLN  49 -16.892   6.331  -3.967
  391    HG3  GLN  49           HG3      GLN  49 -18.307   7.001  -3.164
  392   HE21  GLN  49          HE21      GLN  49 -18.054   8.421  -1.473
  393   HE22  GLN  49          HE22      GLN  49 -16.543   9.203  -1.145
  394    H    ILE  50           H        ILE  50 -17.191   2.208  -2.415
  395    HA   ILE  50           HA       ILE  50 -17.421   1.375   0.261
  396    HB   ILE  50           HB       ILE  50 -17.396  -0.126  -2.345
  397   HG12  ILE  50          HG12      ILE  50 -19.735  -0.729  -1.109
  398   HG13  ILE  50          HG13      ILE  50 -19.422   0.865  -0.435
  399   HG21  ILE  50          HG21      ILE  50 -17.558  -1.363   0.396
  400   HG22  ILE  50          HG22      ILE  50 -16.343  -1.664  -0.846
  401   HG23  ILE  50          HG23      ILE  50 -18.009  -2.185  -1.098
  402   HD11  ILE  50          HD11      ILE  50 -19.728   0.124  -3.334
  403   HD12  ILE  50          HD12      ILE  50 -19.170   1.706  -2.776
  404   HD13  ILE  50          HD13      ILE  50 -20.787   1.145  -2.355
  405    H    ILE  51           H        ILE  51 -15.029   0.526  -2.213
  406    HA   ILE  51           HA       ILE  51 -13.438  -1.141  -0.639
  407    HB   ILE  51           HB       ILE  51 -12.546   0.582  -2.951
  408   HG12  ILE  51          HG12      ILE  51 -13.570  -2.258  -2.988
  409   HG13  ILE  51          HG13      ILE  51 -14.536  -0.855  -3.431
  410   HG21  ILE  51          HG21      ILE  51 -10.681  -0.333  -1.712
  411   HG22  ILE  51          HG22      ILE  51 -10.835  -1.159  -3.264
  412   HG23  ILE  51          HG23      ILE  51 -11.390  -1.946  -1.787
  413   HD11  ILE  51          HD11      ILE  51 -12.977  -0.360  -5.242
  414   HD12  ILE  51          HD12      ILE  51 -13.673  -1.973  -5.398
  415   HD13  ILE  51          HD13      ILE  51 -12.025  -1.779  -4.804
  416    H    HIS  52           H        HIS  52 -13.211   2.324  -1.286
  417    HA   HIS  52           HA       HIS  52 -10.707   2.713  -0.103
  418    HB2  HIS  52           HB2      HIS  52 -12.902   4.455  -1.008
  419    HB3  HIS  52           HB3      HIS  52 -11.836   5.149   0.212
  420    HD1  HIS  52           HD1      HIS  52 -10.206   6.587  -0.962
  421    HD2  HIS  52           HD2      HIS  52 -10.893   3.031  -3.017
  422    HE1  HIS  52           HE1      HIS  52  -8.627   6.617  -2.906
  423    HE2  HIS  52           HE2      HIS  52  -8.941   4.389  -4.040
  424    H    HIS  53           H        HIS  53 -13.950   2.837   1.345
  425    HA   HIS  53           HA       HIS  53 -13.003   3.849   3.843
  426    HB2  HIS  53           HB2      HIS  53 -15.540   2.392   3.120
  427    HB3  HIS  53           HB3      HIS  53 -15.200   2.985   4.740
  428    HD1  HIS  53           HD1      HIS  53 -14.274   5.763   4.355
  429    HD2  HIS  53           HD2      HIS  53 -17.282   4.108   2.003
  430    HE1  HIS  53           HE1      HIS  53 -15.544   7.711   3.426
  431    HE2  HIS  53           HE2      HIS  53 -17.515   6.672   2.260
  432    H    LEU  54           H        LEU  54 -13.181   0.708   2.426
  433    HA   LEU  54           HA       LEU  54 -13.038  -0.775   4.876
  434    HB2  LEU  54           HB2      LEU  54 -12.635  -1.533   1.987
  435    HB3  LEU  54           HB3      LEU  54 -12.444  -2.683   3.294
  436    HG   LEU  54           HG       LEU  54 -15.007  -1.171   2.791
  437   HD11  LEU  54          HD11      LEU  54 -14.251  -3.953   1.901
  438   HD12  LEU  54          HD12      LEU  54 -14.418  -2.553   0.844
  439   HD13  LEU  54          HD13      LEU  54 -15.825  -3.186   1.697
  440   HD21  LEU  54          HD21      LEU  54 -14.460  -3.701   4.358
  441   HD22  LEU  54          HD22      LEU  54 -16.000  -2.850   4.225
  442   HD23  LEU  54          HD23      LEU  54 -14.649  -2.100   5.071
  443    H    VAL  55           H        VAL  55 -10.745   0.002   2.287
  444    HA   VAL  55           HA       VAL  55  -8.529  -1.225   3.585
  445    HB   VAL  55           HB       VAL  55  -7.150  -0.224   1.868
  446   HG11  VAL  55          HG11      VAL  55  -8.290  -1.080  -0.124
  447   HG12  VAL  55          HG12      VAL  55  -9.807  -1.130   0.773
  448   HG13  VAL  55          HG13      VAL  55  -8.465  -2.169   1.253
  449   HG21  VAL  55          HG21      VAL  55  -8.094   2.022   1.826
  450   HG22  VAL  55          HG22      VAL  55  -9.583   1.398   1.117
  451   HG23  VAL  55          HG23      VAL  55  -8.076   1.329   0.204
  452    H    GLN  56           H        GLN  56  -9.916   1.963   3.594
  453    HA   GLN  56           HA       GLN  56  -7.771   3.202   5.017
  454    HB2  GLN  56           HB2      GLN  56 -10.515   3.953   4.166
  455    HB3  GLN  56           HB3      GLN  56  -9.814   4.858   5.492
  456    HG2  GLN  56           HG2      GLN  56  -7.936   5.501   4.104
  457    HG3  GLN  56           HG3      GLN  56  -8.550   4.508   2.780
  458   HE21  GLN  56          HE21      GLN  56 -10.371   5.176   1.663
  459   HE22  GLN  56          HE22      GLN  56 -10.929   6.810   1.701
  460    H    MET  57           H        MET  57 -10.381   1.163   5.897
  461    HA   MET  57           HA       MET  57 -10.551   2.132   8.609
  462    HB2  MET  57           HB2      MET  57 -12.394   0.985   7.150
  463    HB3  MET  57           HB3      MET  57 -11.657  -0.502   7.728
  464    HG2  MET  57           HG2      MET  57 -12.057   0.184  10.032
  465    HG3  MET  57           HG3      MET  57 -12.776   1.689   9.463
  466    HE1  MET  57           HE1      MET  57 -14.261   0.185   6.770
  467    HE2  MET  57           HE2      MET  57 -14.813   1.611   7.654
  468    HE3  MET  57           HE3      MET  57 -15.885   0.224   7.463
  469    H    GLY  58           H        GLY  58  -8.482   0.157   6.896
  470    HA2  GLY  58           HA2      GLY  58  -6.527  -0.801   7.733
  471    HA3  GLY  58           HA3      GLY  58  -7.177  -0.650   9.359
  472    H    LEU  59           H        LEU  59  -9.546  -2.003   7.511
  473    HA   LEU  59           HA       LEU  59  -8.962  -4.645   8.570
  474    HB2  LEU  59           HB2      LEU  59 -11.234  -5.216   7.865
  475    HB3  LEU  59           HB3      LEU  59 -11.193  -3.807   8.902
  476    HG   LEU  59           HG       LEU  59 -11.178  -2.549   6.560
  477   HD11  LEU  59          HD11      LEU  59 -11.142  -4.593   5.234
  478   HD12  LEU  59          HD12      LEU  59 -12.626  -3.680   4.971
  479   HD13  LEU  59          HD13      LEU  59 -12.648  -5.117   5.992
  480   HD21  LEU  59          HD21      LEU  59 -12.788  -2.258   8.365
  481   HD22  LEU  59          HD22      LEU  59 -13.634  -3.715   7.847
  482   HD23  LEU  59          HD23      LEU  59 -13.578  -2.305   6.791
  483    H    ALA  60           H        ALA  60  -8.465  -2.919   5.763
  484    HA   ALA  60           HA       ALA  60  -7.672  -5.416   4.408
  485    HB1  ALA  60           HB1      ALA  60  -9.616  -4.691   3.218
  486    HB2  ALA  60           HB2      ALA  60  -8.205  -4.301   2.230
  487    HB3  ALA  60           HB3      ALA  60  -9.020  -3.036   3.147
  488    H    ASP  61           H        ASP  61  -5.945  -5.026   2.759
  489    HA   ASP  61           HA       ASP  61  -3.904  -3.331   3.838
  490    HB2  ASP  61           HB2      ASP  61  -4.047  -5.109   1.419
  491    HB3  ASP  61           HB3      ASP  61  -2.685  -4.021   1.656
  492    H    SER  62           H        SER  62  -5.305  -3.436   0.571
  493    HA   SER  62           HA       SER  62  -5.489  -0.570   0.481
  494    HB2  SER  62           HB2      SER  62  -3.974  -0.453  -1.544
  495    HB3  SER  62           HB3      SER  62  -3.161  -0.686   0.000
  496    HG   SER  62           HG       SER  62  -3.776  -3.085  -0.992
  497    H    VAL  63           H        VAL  63  -6.036   0.093  -1.876
  498    HA   VAL  63           HA       VAL  63  -8.458  -1.195  -2.516
  499    HB   VAL  63           HB       VAL  63  -6.865   0.822  -4.109
  500   HG11  VAL  63          HG11      VAL  63  -8.941   1.324  -5.276
  501   HG12  VAL  63          HG12      VAL  63  -9.773   0.059  -4.374
  502   HG13  VAL  63          HG13      VAL  63  -8.498  -0.366  -5.516
  503   HG21  VAL  63          HG21      VAL  63  -7.451   1.615  -1.901
  504   HG22  VAL  63          HG22      VAL  63  -9.131   1.139  -2.148
  505   HG23  VAL  63          HG23      VAL  63  -8.430   2.439  -3.114
  506    H    LYS  64           H        LYS  64  -5.231  -1.589  -3.684
  507    HA   LYS  64           HA       LYS  64  -5.725  -2.734  -6.206
  508    HB2  LYS  64           HB2      LYS  64  -3.450  -3.063  -6.255
  509    HB3  LYS  64           HB3      LYS  64  -3.579  -1.898  -4.953
  510    HG2  LYS  64           HG2      LYS  64  -3.582  -3.811  -3.348
  511    HG3  LYS  64           HG3      LYS  64  -3.133  -4.838  -4.712
  512    HD2  LYS  64           HD2      LYS  64  -1.162  -3.434  -5.107
  513    HD3  LYS  64           HD3      LYS  64  -1.611  -2.428  -3.729
  514    HE2  LYS  64           HE2      LYS  64  -0.882  -5.353  -3.651
  515    HE3  LYS  64           HE3      LYS  64   0.115  -4.008  -3.104
  516    HZ1  LYS  64           HZ1      LYS  64  -0.957  -5.047  -1.235
  517    HZ2  LYS  64           HZ2      LYS  64  -2.485  -4.861  -1.934
  518    HZ3  LYS  64           HZ3      LYS  64  -1.608  -3.501  -1.445
  519    H    ASP  65           H        ASP  65  -5.746  -3.983  -3.002
  520    HA   ASP  65           HA       ASP  65  -5.676  -6.752  -3.604
  521    HB2  ASP  65           HB2      ASP  65  -6.811  -5.302  -1.205
  522    HB3  ASP  65           HB3      ASP  65  -6.547  -7.041  -1.298
  523    H    PHE  66           H        PHE  66  -8.129  -4.384  -3.840
  524    HA   PHE  66           HA       PHE  66 -10.243  -6.401  -4.198
  525    HB2  PHE  66           HB2      PHE  66 -10.405  -3.374  -4.091
  526    HB3  PHE  66           HB3      PHE  66 -11.777  -4.455  -4.266
  527    HD1  PHE  66           HD1      PHE  66 -13.071  -4.479  -2.402
  528    HD2  PHE  66           HD2      PHE  66  -8.846  -4.304  -1.950
  529    HE1  PHE  66           HE1      PHE  66 -13.333  -4.527   0.040
  530    HE2  PHE  66           HE2      PHE  66  -9.101  -4.351   0.485
  531    HZ   PHE  66           HZ       PHE  66 -11.344  -4.458   1.489
  532    H    GLN  67           H        GLN  67  -8.707  -3.622  -5.692
  533    HA   GLN  67           HA       GLN  67  -9.380  -4.617  -8.366
  534    HB2  GLN  67           HB2      GLN  67  -9.689  -1.765  -7.371
  535    HB3  GLN  67           HB3      GLN  67  -9.827  -2.260  -9.059
  536    HG2  GLN  67           HG2      GLN  67 -11.721  -3.719  -8.428
  537    HG3  GLN  67           HG3      GLN  67 -11.609  -3.097  -6.784
  538   HE21  GLN  67          HE21      GLN  67 -13.828  -2.949  -8.610
  539   HE22  GLN  67          HE22      GLN  67 -14.167  -1.268  -8.839
  540    H    ARG  68           H        ARG  68  -7.236  -5.347  -8.510
  541    HA   ARG  68           HA       ARG  68  -4.991  -3.709  -7.998
  542    HB2  ARG  68           HB2      ARG  68  -4.964  -6.205  -8.021
  543    HB3  ARG  68           HB3      ARG  68  -5.122  -6.151  -9.771
  544    HG2  ARG  68           HG2      ARG  68  -2.985  -5.073  -9.986
  545    HG3  ARG  68           HG3      ARG  68  -2.837  -4.923  -8.233
  546    HD2  ARG  68           HD2      ARG  68  -1.508  -6.790  -9.107
  547    HD3  ARG  68           HD3      ARG  68  -2.777  -7.348  -8.018
  548    HE   ARG  68           HE       ARG  68  -3.151  -7.410 -10.937
  549   HH11  ARG  68          HH11      ARG  68  -3.048  -9.054  -7.848
  550   HH12  ARG  68          HH12      ARG  68  -3.640 -10.552  -8.485
  551   HH21  ARG  68          HH21      ARG  68  -3.947  -9.360 -11.773
  552   HH22  ARG  68          HH22      ARG  68  -4.164 -10.724 -10.722
  553    H    LYS  69           H        LYS  69  -5.504  -1.808  -9.057
  554    HA   LYS  69           HA       LYS  69  -4.375  -1.645 -11.705
  555    HB2  LYS  69           HB2      LYS  69  -6.618  -1.917 -12.428
  556    HB3  LYS  69           HB3      LYS  69  -7.244  -0.922 -11.120
  557    HG2  LYS  69           HG2      LYS  69  -6.243   1.056 -12.141
  558    HG3  LYS  69           HG3      LYS  69  -5.613   0.060 -13.451
  559    HD2  LYS  69           HD2      LYS  69  -7.762  -0.387 -14.290
  560    HD3  LYS  69           HD3      LYS  69  -8.544   0.168 -12.807
  561    HE2  LYS  69           HE2      LYS  69  -8.731   1.763 -14.711
  562    HE3  LYS  69           HE3      LYS  69  -7.966   2.442 -13.277
  563    HZ1  LYS  69           HZ1      LYS  69  -5.811   2.107 -14.304
  564    HZ2  LYS  69           HZ2      LYS  69  -6.794   3.060 -15.293
  565    HZ3  LYS  69           HZ3      LYS  69  -6.537   1.435 -15.677
  566    H    GLY  70           H        GLY  70  -6.145   0.089  -9.169
  567    HA2  GLY  70           HA2      GLY  70  -4.592   2.492  -9.617
  568    HA3  GLY  70           HA3      GLY  70  -5.884   2.283  -8.444
  569    H    THR  71           H        THR  71  -2.550   1.241  -9.110
  570    HA   THR  71           HA       THR  71  -2.067   0.779  -6.317
  571    HB   THR  71           HB       THR  71   0.433   0.864  -7.405
  572    HG1  THR  71           HG1      THR  71   0.210   0.827  -9.526
  573   HG21  THR  71          HG21      THR  71  -0.480  -0.943  -6.065
  574   HG22  THR  71          HG22      THR  71   0.240  -1.594  -7.539
  575   HG23  THR  71          HG23      THR  71  -1.513  -1.453  -7.402
  576    H    HIS  72           H        HIS  72  -1.249   2.092  -4.908
  577    HA   HIS  72           HA       HIS  72  -1.000   4.873  -5.316
  578    HB2  HIS  72           HB2      HIS  72  -0.210   4.880  -2.980
  579    HB3  HIS  72           HB3      HIS  72  -1.644   3.873  -3.163
  580    HD1  HIS  72           HD1      HIS  72  -1.123   1.206  -3.264
  581    HD2  HIS  72           HD2      HIS  72   1.959   3.639  -1.925
  582    HE1  HIS  72           HE1      HIS  72   0.622  -0.341  -2.349
  583    HE2  HIS  72           HE2      HIS  72   2.225   1.176  -1.150
  584    H    ILE  73           H        ILE  73   0.720   3.928  -7.242
  585    HA   ILE  73           HA       ILE  73   3.327   3.487  -6.269
  586    HB   ILE  73           HB       ILE  73   2.216   3.858  -8.945
  587   HG12  ILE  73          HG12      ILE  73   2.984   1.762  -7.650
  588   HG13  ILE  73          HG13      ILE  73   3.434   1.899  -9.359
  589   HG21  ILE  73          HG21      ILE  73   5.033   4.714  -8.385
  590   HG22  ILE  73          HG22      ILE  73   3.748   5.681  -9.110
  591   HG23  ILE  73          HG23      ILE  73   4.415   4.304  -9.985
  592   HD11  ILE  73          HD11      ILE  73   5.284   1.110  -7.929
  593   HD12  ILE  73          HD12      ILE  73   5.216   2.631  -7.036
  594   HD13  ILE  73          HD13      ILE  73   5.657   2.629  -8.741
  595    H    VAL  74           H        VAL  74   4.503   4.678  -5.293
  596    HA   VAL  74           HA       VAL  74   4.405   7.401  -4.852
  597    HB   VAL  74           HB       VAL  74   6.797   5.554  -4.899
  598   HG11  VAL  74          HG11      VAL  74   7.396   7.929  -4.813
  599   HG12  VAL  74          HG12      VAL  74   7.819   7.066  -3.338
  600   HG13  VAL  74          HG13      VAL  74   6.399   8.112  -3.369
  601   HG21  VAL  74          HG21      VAL  74   4.960   4.693  -3.542
  602   HG22  VAL  74          HG22      VAL  74   4.911   6.219  -2.653
  603   HG23  VAL  74          HG23      VAL  74   6.333   5.181  -2.543
  604    H    LEU  75           H        LEU  75   4.986   9.080  -6.000
  605    HA   LEU  75           HA       LEU  75   5.436   9.131  -8.668
  606    HB2  LEU  75           HB2      LEU  75   6.192  11.406  -8.402
  607    HB3  LEU  75           HB3      LEU  75   4.879  11.080  -7.293
  608    HG   LEU  75           HG       LEU  75   7.770  11.059  -6.431
  609   HD11  LEU  75          HD11      LEU  75   5.774  13.300  -6.390
  610   HD12  LEU  75          HD12      LEU  75   7.272  13.237  -7.324
  611   HD13  LEU  75          HD13      LEU  75   7.329  13.313  -5.561
  612   HD21  LEU  75          HD21      LEU  75   6.437   9.949  -4.819
  613   HD22  LEU  75          HD22      LEU  75   5.153  11.154  -4.947
  614   HD23  LEU  75          HD23      LEU  75   6.695  11.581  -4.207
  615    H    TRP  76           H        TRP  76   6.858   7.695  -9.478
  616    HA   TRP  76           HA       TRP  76   9.598   7.710  -8.496
  617    HB2  TRP  76           HB2      TRP  76   7.959   5.799 -10.126
  618    HB3  TRP  76           HB3      TRP  76   9.722   5.715 -10.200
  619    HD1  TRP  76           HD1      TRP  76   6.967   4.192  -8.442
  620    HE1  TRP  76           HE1      TRP  76   7.685   3.155  -6.196
  621    HE3  TRP  76           HE3      TRP  76  11.538   6.415  -7.976
  622    HZ2  TRP  76           HZ2      TRP  76   9.912   3.271  -4.463
  623    HZ3  TRP  76           HZ3      TRP  76  12.898   5.901  -5.992
  624    HH2  TRP  76           HH2      TRP  76  12.102   4.364  -4.274
  625    H    THR  77           H        THR  77  10.815   9.191  -9.351
  626    HA   THR  77           HA       THR  77  10.784   9.598 -12.265
  627    HB   THR  77           HB       THR  77  11.401  11.924 -11.912
  628    HG1  THR  77           HG1      THR  77  11.604  12.758  -9.799
  629   HG21  THR  77          HG21      THR  77   9.078  11.192 -10.113
  630   HG22  THR  77          HG22      THR  77   8.992  11.429 -11.861
  631   HG23  THR  77          HG23      THR  77   9.388  12.786 -10.805
  632    H    GLY  78           H        GLY  78  13.049  10.672 -12.878
  633    HA2  GLY  78           HA2      GLY  78  15.085   8.830 -12.249
  634    HA3  GLY  78           HA3      GLY  78  15.328  10.393 -13.021
  635    H    ASP  79           H        ASP  79  14.415  12.076 -11.059
  636    HA   ASP  79           HA       ASP  79  16.602  12.308  -9.302
  637    HB2  ASP  79           HB2      ASP  79  15.239  14.216 -10.029
  638    HB3  ASP  79           HB3      ASP  79  13.850  13.553  -9.181
  639    H    GLN  80           H        GLN  80  13.247  11.293  -8.759
  640    HA   GLN  80           HA       GLN  80  13.441  10.828  -5.986
  641    HB2  GLN  80           HB2      GLN  80  11.415  10.855  -7.811
  642    HB3  GLN  80           HB3      GLN  80  11.593   9.130  -7.551
  643    HG2  GLN  80           HG2      GLN  80  11.346  10.941  -5.198
  644    HG3  GLN  80           HG3      GLN  80   9.913  10.518  -6.132
  645   HE21  GLN  80          HE21      GLN  80   9.252   8.340  -6.224
  646   HE22  GLN  80          HE22      GLN  80   9.772   7.201  -5.031
  647    H    GLU  81           H        GLU  81  14.161   8.879  -8.785
  648    HA   GLU  81           HA       GLU  81  14.410   6.411  -7.343
  649    HB2  GLU  81           HB2      GLU  81  13.709   6.587  -9.721
  650    HB3  GLU  81           HB3      GLU  81  15.335   7.116 -10.126
  651    HG2  GLU  81           HG2      GLU  81  16.255   5.017  -9.606
  652    HG3  GLU  81           HG3      GLU  81  14.788   4.494  -8.776
  653    H    LEU  82           H        LEU  82  16.660   8.817  -8.692
  654    HA   LEU  82           HA       LEU  82  19.040   7.521  -7.940
  655    HB2  LEU  82           HB2      LEU  82  19.038   9.489  -9.396
  656    HB3  LEU  82           HB3      LEU  82  18.460  10.481  -8.070
  657    HG   LEU  82           HG       LEU  82  20.600   9.766  -6.845
  658   HD11  LEU  82          HD11      LEU  82  21.383   9.065  -9.669
  659   HD12  LEU  82          HD12      LEU  82  21.258   7.955  -8.303
  660   HD13  LEU  82          HD13      LEU  82  22.492   9.216  -8.305
  661   HD21  LEU  82          HD21      LEU  82  20.216  12.013  -7.626
  662   HD22  LEU  82          HD22      LEU  82  20.749  11.569  -9.249
  663   HD23  LEU  82          HD23      LEU  82  21.892  11.544  -7.905
  664    H    GLU  83           H        GLU  83  16.902   9.743  -6.220
  665    HA   GLU  83           HA       GLU  83  18.290   9.954  -3.832
  666    HB2  GLU  83           HB2      GLU  83  15.340   9.967  -4.432
  667    HB3  GLU  83           HB3      GLU  83  15.954  10.184  -2.798
  668    HG2  GLU  83           HG2      GLU  83  16.685  11.915  -5.144
  669    HG3  GLU  83           HG3      GLU  83  15.440  12.299  -3.957
  670    H    LEU  84           H        LEU  84  15.954   7.485  -4.865
  671    HA   LEU  84           HA       LEU  84  16.043   5.896  -2.548
  672    HB2  LEU  84           HB2      LEU  84  14.347   5.473  -4.174
  673    HB3  LEU  84           HB3      LEU  84  15.536   5.198  -5.435
  674    HG   LEU  84           HG       LEU  84  16.300   3.173  -4.126
  675   HD11  LEU  84          HD11      LEU  84  15.361   3.759  -1.966
  676   HD12  LEU  84          HD12      LEU  84  14.724   2.211  -2.526
  677   HD13  LEU  84          HD13      LEU  84  13.730   3.665  -2.632
  678   HD21  LEU  84          HD21      LEU  84  14.947   2.946  -6.118
  679   HD22  LEU  84          HD22      LEU  84  13.476   3.212  -5.183
  680   HD23  LEU  84          HD23      LEU  84  14.445   1.767  -4.907
  681    H    GLN  85           H        GLN  85  17.957   5.745  -5.531
  682    HA   GLN  85           HA       GLN  85  19.408   3.449  -4.986
  683    HB2  GLN  85           HB2      GLN  85  19.334   4.694  -7.159
  684    HB3  GLN  85           HB3      GLN  85  20.428   5.879  -6.467
  685    HG2  GLN  85           HG2      GLN  85  21.285   3.048  -6.382
  686    HG3  GLN  85           HG3      GLN  85  21.255   3.835  -7.956
  687   HE21  GLN  85          HE21      GLN  85  22.619   5.580  -8.345
  688   HE22  GLN  85          HE22      GLN  85  24.009   5.884  -7.363
  689    H    ARG  86           H        ARG  86  20.471   6.829  -4.394
  690    HA   ARG  86           HA       ARG  86  22.803   6.129  -2.994
  691    HB2  ARG  86           HB2      ARG  86  21.070   8.585  -2.713
  692    HB3  ARG  86           HB3      ARG  86  22.670   8.411  -2.006
  693    HG2  ARG  86           HG2      ARG  86  23.384   7.919  -4.465
  694    HG3  ARG  86           HG3      ARG  86  21.882   8.759  -4.855
  695    HD2  ARG  86           HD2      ARG  86  23.790  10.291  -4.812
  696    HD3  ARG  86           HD3      ARG  86  22.615  10.687  -3.556
  697    HE   ARG  86           HE       ARG  86  24.181   9.319  -2.063
  698   HH11  ARG  86          HH11      ARG  86  25.245  11.320  -4.731
  699   HH12  ARG  86          HH12      ARG  86  26.839  11.538  -4.087
  700   HH21  ARG  86          HH21      ARG  86  26.253   9.600  -1.218
  701   HH22  ARG  86          HH22      ARG  86  27.418  10.554  -2.093
  702    H    LEU  87           H        LEU  87  19.598   6.970  -1.780
  703    HA   LEU  87           HA       LEU  87  20.052   6.904   0.945
  704    HB2  LEU  87           HB2      LEU  87  17.996   7.585  -0.406
  705    HB3  LEU  87           HB3      LEU  87  17.562   5.893  -0.404
  706    HG   LEU  87           HG       LEU  87  17.641   6.070   2.160
  707   HD11  LEU  87          HD11      LEU  87  17.321   8.990   1.471
  708   HD12  LEU  87          HD12      LEU  87  18.771   8.285   2.192
  709   HD13  LEU  87          HD13      LEU  87  17.245   8.264   3.077
  710   HD21  LEU  87          HD21      LEU  87  15.346   6.832   2.185
  711   HD22  LEU  87          HD22      LEU  87  15.641   5.813   0.777
  712   HD23  LEU  87          HD23      LEU  87  15.557   7.559   0.593
  713    H    PHE  88           H        PHE  88  19.046   4.262  -1.190
  714    HA   PHE  88           HA       PHE  88  18.816   2.273   0.781
  715    HB2  PHE  88           HB2      PHE  88  17.761   1.912  -1.308
  716    HB3  PHE  88           HB3      PHE  88  19.248   2.197  -2.199
  717    HD1  PHE  88           HD1      PHE  88  20.398   0.405  -3.011
  718    HD2  PHE  88           HD2      PHE  88  17.838  -0.163   0.334
  719    HE1  PHE  88           HE1      PHE  88  20.817  -2.012  -3.099
  720    HE2  PHE  88           HE2      PHE  88  18.259  -2.582   0.252
  721    HZ   PHE  88           HZ       PHE  88  19.758  -3.504  -1.465
  722    H    GLU  89           H        GLU  89  21.438   2.775  -1.585
  723    HA   GLU  89           HA       GLU  89  23.147   0.765  -0.714
  724    HB2  GLU  89           HB2      GLU  89  23.805   3.438  -1.955
  725    HB3  GLU  89           HB3      GLU  89  24.922   2.082  -1.840
  726    HG2  GLU  89           HG2      GLU  89  22.270   1.728  -3.121
  727    HG3  GLU  89           HG3      GLU  89  23.581   2.487  -4.022
  728    H    GLU  90           H        GLU  90  22.860   4.081   0.331
  729    HA   GLU  90           HA       GLU  90  25.202   4.086   1.918
  730    HB2  GLU  90           HB2      GLU  90  22.882   5.888   1.466
  731    HB3  GLU  90           HB3      GLU  90  23.958   6.220   2.828
  732    HG2  GLU  90           HG2      GLU  90  25.852   6.369   1.314
  733    HG3  GLU  90           HG3      GLU  90  24.823   5.941  -0.050
  734    H    PHE  91           H        PHE  91  21.981   2.948   2.529
  735    HA   PHE  91           HA       PHE  91  22.673   2.781   5.393
  736    HB2  PHE  91           HB2      PHE  91  19.969   3.094   4.103
  737    HB3  PHE  91           HB3      PHE  91  20.185   2.650   5.795
  738    HD1  PHE  91           HD1      PHE  91  19.583   5.319   3.673
  739    HD2  PHE  91           HD2      PHE  91  21.920   4.255   7.065
  740    HE1  PHE  91           HE1      PHE  91  19.776   7.696   4.280
  741    HE2  PHE  91           HE2      PHE  91  22.117   6.628   7.680
  742    HZ   PHE  91           HZ       PHE  91  21.043   8.351   6.288
  743    H    ARG  92           H        ARG  92  22.933   0.818   2.948
  744    HA   ARG  92           HA       ARG  92  21.252  -1.398   3.425
  745    HB2  ARG  92           HB2      ARG  92  24.073  -1.409   2.352
  746    HB3  ARG  92           HB3      ARG  92  22.935  -2.744   2.254
  747    HG2  ARG  92           HG2      ARG  92  21.452  -1.375   0.896
  748    HG3  ARG  92           HG3      ARG  92  22.619  -0.050   1.003
  749    HD2  ARG  92           HD2      ARG  92  22.858  -1.220  -1.080
  750    HD3  ARG  92           HD3      ARG  92  24.294  -1.446  -0.099
  751    HE   ARG  92           HE       ARG  92  23.168  -3.669   0.502
  752   HH11  ARG  92          HH11      ARG  92  22.929  -2.099  -2.633
  753   HH12  ARG  92          HH12      ARG  92  22.651  -3.593  -3.485
  754   HH21  ARG  92          HH21      ARG  92  22.839  -5.618  -0.625
  755   HH22  ARG  92          HH22      ARG  92  22.620  -5.588  -2.346
  756    H    ASP  93           H        ASP  93  24.105  -0.281   4.953
  757    HA   ASP  93           HA       ASP  93  24.923  -2.662   6.212
  758    HB2  ASP  93           HB2      ASP  93  26.272  -0.569   5.892
  759    HB3  ASP  93           HB3      ASP  93  25.380   0.134   7.238
  760    H    SER  94           H        SER  94  22.045  -1.246   6.656
  761    HA   SER  94           HA       SER  94  21.877  -2.011   9.492
  762    HB2  SER  94           HB2      SER  94  19.836  -0.566   7.779
  763    HB3  SER  94           HB3      SER  94  19.747  -0.823   9.521
  764    HG   SER  94           HG       SER  94  22.013   0.447   8.510
  765    H    ASP  95           H        ASP  95  20.453  -3.669  10.132
  766    HA   ASP  95           HA       ASP  95  20.067  -5.730   8.221
  767    HB2  ASP  95           HB2      ASP  95  19.078  -7.026   9.993
  768    HB3  ASP  95           HB3      ASP  95  20.456  -6.151  10.644
  769    H    ASP  96           H        ASP  96  18.181  -3.046   9.086
  770    HA   ASP  96           HA       ASP  96  16.226  -3.920   7.092
  771    HB2  ASP  96           HB2      ASP  96  15.103  -4.161   9.262
  772    HB3  ASP  96           HB3      ASP  96  15.519  -2.502   9.675
  773    H    VAL  97           H        VAL  97  17.357  -2.693   5.584
  774    HA   VAL  97           HA       VAL  97  18.107   0.005   6.069
  775    HB   VAL  97           HB       VAL  97  19.357  -1.270   4.442
  776   HG11  VAL  97          HG11      VAL  97  17.602  -2.736   3.613
  777   HG12  VAL  97          HG12      VAL  97  18.424  -1.915   2.282
  778   HG13  VAL  97          HG13      VAL  97  16.831  -1.368   2.809
  779   HG21  VAL  97          HG21      VAL  97  19.237   1.143   4.126
  780   HG22  VAL  97          HG22      VAL  97  17.826   0.941   3.090
  781   HG23  VAL  97          HG23      VAL  97  19.390   0.302   2.585
  782    H    LEU  98           H        LEU  98  15.240  -1.527   4.816
  783    HA   LEU  98           HA       LEU  98  14.228   0.701   3.413
  784    HB2  LEU  98           HB2      LEU  98  12.889  -1.728   4.547
  785    HB3  LEU  98           HB3      LEU  98  11.989  -0.464   3.727
  786    HG   LEU  98           HG       LEU  98  13.814  -0.905   1.853
  787   HD11  LEU  98          HD11      LEU  98  13.613  -3.533   3.303
  788   HD12  LEU  98          HD12      LEU  98  15.066  -2.564   3.062
  789   HD13  LEU  98          HD13      LEU  98  14.270  -3.315   1.681
  790   HD21  LEU  98          HD21      LEU  98  11.379  -1.035   1.620
  791   HD22  LEU  98          HD22      LEU  98  11.416  -2.672   2.280
  792   HD23  LEU  98          HD23      LEU  98  12.206  -2.320   0.741
  793    H    GLY  99           H        GLY  99  13.980  -0.300   6.768
  794    HA2  GLY  99           HA2      GLY  99  12.059   1.536   7.644
  795    HA3  GLY  99           HA3      GLY  99  13.396   0.934   8.624
  796    H    HIS 100           H        HIS 100  15.554   1.908   7.253
  797    HA   HIS 100           HA       HIS 100  15.609   4.624   8.121
  798    HB2  HIS 100           HB2      HIS 100  17.590   3.043   6.463
  799    HB3  HIS 100           HB3      HIS 100  17.890   4.655   7.101
  800    HD1  HIS 100           HD1      HIS 100  19.316   4.562   9.117
  801    HD2  HIS 100           HD2      HIS 100  16.808   1.256   8.854
  802    HE1  HIS 100           HE1      HIS 100  19.875   3.125  11.103
  803    HE2  HIS 100           HE2      HIS 100  18.332   1.143  10.940
  804    H    ILE 101           H        ILE 101  15.211   2.979   5.065
  805    HA   ILE 101           HA       ILE 101  15.587   5.113   3.313
  806    HB   ILE 101           HB       ILE 101  13.965   2.596   3.111
  807   HG12  ILE 101          HG12      ILE 101  16.491   3.575   1.766
  808   HG13  ILE 101          HG13      ILE 101  16.389   2.370   3.047
  809   HG21  ILE 101          HG21      ILE 101  12.782   4.218   1.753
  810   HG22  ILE 101          HG22      ILE 101  13.623   3.059   0.725
  811   HG23  ILE 101          HG23      ILE 101  14.279   4.674   0.950
  812   HD11  ILE 101          HD11      ILE 101  15.193   2.071   0.305
  813   HD12  ILE 101          HD12      ILE 101  15.241   0.850   1.577
  814   HD13  ILE 101          HD13      ILE 101  16.735   1.396   0.821
  815    H    MET 102           H        MET 102  12.415   3.828   4.411
  816    HA   MET 102           HA       MET 102  11.037   5.918   3.080
  817    HB2  MET 102           HB2      MET 102   9.055   5.091   4.512
  818    HB3  MET 102           HB3      MET 102   9.739   4.018   3.301
  819    HG2  MET 102           HG2      MET 102  10.838   2.722   4.926
  820    HG3  MET 102           HG3      MET 102  10.565   3.923   6.167
  821    HE1  MET 102           HE1      MET 102   8.938   1.241   3.875
  822    HE2  MET 102           HE2      MET 102   7.989   2.683   3.505
  823    HE3  MET 102           HE3      MET 102   7.244   1.326   4.355
  824    H    LYS 103           H        LYS 103  12.504   5.768   6.188
  825    HA   LYS 103           HA       LYS 103  10.938   7.984   7.203
  826    HB2  LYS 103           HB2      LYS 103  13.145   6.295   8.295
  827    HB3  LYS 103           HB3      LYS 103  12.833   7.861   9.026
  828    HG2  LYS 103           HG2      LYS 103  11.684   6.098  10.230
  829    HG3  LYS 103           HG3      LYS 103  10.527   7.199   9.485
  830    HD2  LYS 103           HD2      LYS 103  10.152   5.613   7.677
  831    HD3  LYS 103           HD3      LYS 103  11.363   4.524   8.361
  832    HE2  LYS 103           HE2      LYS 103   9.128   3.773   8.931
  833    HE3  LYS 103           HE3      LYS 103   9.990   4.285  10.379
  834    HZ1  LYS 103           HZ1      LYS 103   7.729   5.107  10.384
  835    HZ2  LYS 103           HZ2      LYS 103   7.969   5.881   8.904
  836    HZ3  LYS 103           HZ3      LYS 103   8.811   6.400  10.271
  837    H    ASN 104           H        ASN 104  14.114   7.493   5.757
  838    HA   ASN 104           HA       ASN 104  14.847  10.258   6.355
  839    HB2  ASN 104           HB2      ASN 104  16.405   7.907   5.315
  840    HB3  ASN 104           HB3      ASN 104  17.049   9.542   5.230
  841   HD21  ASN 104          HD21      ASN 104  15.022   8.421   7.851
  842   HD22  ASN 104          HD22      ASN 104  16.252   8.437   9.063
  843    H    ILE 105           H        ILE 105  13.251   8.699   3.896
  844    HA   ILE 105           HA       ILE 105  14.415  10.331   1.783
  845    HB   ILE 105           HB       ILE 105  13.869   8.023   1.250
  846   HG12  ILE 105          HG12      ILE 105  12.390   8.488  -0.787
  847   HG13  ILE 105          HG13      ILE 105  12.350  10.152  -0.214
  848   HG21  ILE 105          HG21      ILE 105  11.002   8.780   1.712
  849   HG22  ILE 105          HG22      ILE 105  11.962   7.683   2.702
  850   HG23  ILE 105          HG23      ILE 105  11.567   7.251   1.038
  851   HD11  ILE 105          HD11      ILE 105  14.048   9.980  -1.863
  852   HD12  ILE 105          HD12      ILE 105  14.752   8.572  -1.068
  853   HD13  ILE 105          HD13      ILE 105  14.840  10.153  -0.296
  854    H    THR 106           H        THR 106  13.284  11.804   0.576
  855    HA   THR 106           HA       THR 106  11.656  13.563   2.014
  856    HB   THR 106           HB       THR 106  13.210  14.071   0.097
  857    HG1  THR 106           HG1      THR 106  11.513  15.523   0.976
  858   HG21  THR 106          HG21      THR 106  10.836  13.200  -1.551
  859   HG22  THR 106          HG22      THR 106  12.412  12.411  -1.498
  860   HG23  THR 106          HG23      THR 106  12.261  14.036  -2.167
  861    H    ALA 107           H        ALA 107  10.854  10.793   0.141
  862    HA   ALA 107           HA       ALA 107   8.029  11.641   0.023
  863    HB1  ALA 107           HB1      ALA 107   7.742  10.051  -1.803
  864    HB2  ALA 107           HB2      ALA 107   9.437   9.580  -1.675
  865    HB3  ALA 107           HB3      ALA 107   9.011  11.216  -2.183
  866    H    LYS 108           H        LYS 108   6.580  10.505   1.208
  867    HA   LYS 108           HA       LYS 108   7.599   8.390   2.876
  868    HB2  LYS 108           HB2      LYS 108   4.783   9.458   2.637
  869    HB3  LYS 108           HB3      LYS 108   5.361   8.372   3.888
  870    HG2  LYS 108           HG2      LYS 108   6.537  11.102   3.481
  871    HG3  LYS 108           HG3      LYS 108   5.116  10.833   4.482
  872    HD2  LYS 108           HD2      LYS 108   6.778  10.744   6.065
  873    HD3  LYS 108           HD3      LYS 108   6.644   9.041   5.641
  874    HE2  LYS 108           HE2      LYS 108   8.976   9.819   5.825
  875    HE3  LYS 108           HE3      LYS 108   8.603   9.201   4.226
  876    HZ1  LYS 108           HZ1      LYS 108   8.276  11.537   3.520
  877    HZ2  LYS 108           HZ2      LYS 108   9.858  11.200   4.009
  878    HZ3  LYS 108           HZ3      LYS 108   8.818  12.044   5.039
  879    H    ARG 109           H        ARG 109   8.002   6.556   1.887
  880    HA   ARG 109           HA       ARG 109   6.009   5.512   0.003
  881    HB2  ARG 109           HB2      ARG 109   8.794   4.446   0.407
  882    HB3  ARG 109           HB3      ARG 109   7.712   4.150  -0.940
  883    HG2  ARG 109           HG2      ARG 109   7.942   6.619  -1.474
  884    HG3  ARG 109           HG3      ARG 109   9.276   6.629  -0.317
  885    HD2  ARG 109           HD2      ARG 109  10.051   4.531  -1.692
  886    HD3  ARG 109           HD3      ARG 109   9.053   5.248  -2.950
  887    HE   ARG 109           HE       ARG 109  10.485   7.181  -2.913
  888   HH11  ARG 109          HH11      ARG 109  11.652   4.485  -1.015
  889   HH12  ARG 109          HH12      ARG 109  13.320   4.913  -1.189
  890   HH21  ARG 109          HH21      ARG 109  12.688   7.741  -3.177
  891   HH22  ARG 109          HH22      ARG 109  13.911   6.769  -2.414
  892    H    SER 110           H        SER 110   5.523   3.260   0.107
  893    HA   SER 110           HA       SER 110   5.744   2.111   2.788
  894    HB2  SER 110           HB2      SER 110   3.492   2.135   1.816
  895    HB3  SER 110           HB3      SER 110   4.076   1.282   0.386
  896    HG   SER 110           HG       SER 110   3.162   0.235   2.625
  897    H    ARG 111           H        ARG 111   6.144  -0.309   2.826
  898    HA   ARG 111           HA       ARG 111   8.743  -0.783   1.909
  899    HB2  ARG 111           HB2      ARG 111   6.635  -2.704   2.899
  900    HB3  ARG 111           HB3      ARG 111   8.308  -3.162   2.602
  901    HG2  ARG 111           HG2      ARG 111   7.455  -1.008   4.527
  902    HG3  ARG 111           HG3      ARG 111   7.789  -2.678   4.983
  903    HD2  ARG 111           HD2      ARG 111  10.072  -2.459   4.202
  904    HD3  ARG 111           HD3      ARG 111   9.747  -0.820   3.647
  905    HE   ARG 111           HE       ARG 111   9.447  -0.192   5.984
  906   HH11  ARG 111          HH11      ARG 111  10.945  -3.293   5.395
  907   HH12  ARG 111          HH12      ARG 111  11.900  -3.251   6.842
  908   HH21  ARG 111          HH21      ARG 111  10.651  -0.181   7.948
  909   HH22  ARG 111          HH22      ARG 111  11.720  -1.513   8.294
  910    H    ALA 112           H        ALA 112   5.641  -1.911   0.646
  911    HA   ALA 112           HA       ALA 112   6.640  -3.669  -1.294
  912    HB1  ALA 112           HB1      ALA 112   4.071  -2.094  -1.347
  913    HB2  ALA 112           HB2      ALA 112   4.309  -3.663  -0.579
  914    HB3  ALA 112           HB3      ALA 112   4.440  -3.510  -2.331
  915    H    ARG 113           H        ARG 113   6.460  -0.215  -1.256
  916    HA   ARG 113           HA       ARG 113   6.666   0.064  -4.126
  917    HB2  ARG 113           HB2      ARG 113   6.842   2.074  -1.879
  918    HB3  ARG 113           HB3      ARG 113   6.978   2.498  -3.581
  919    HG2  ARG 113           HG2      ARG 113   4.597   1.272  -2.216
  920    HG3  ARG 113           HG3      ARG 113   4.746   2.925  -2.817
  921    HD2  ARG 113           HD2      ARG 113   3.543   1.788  -4.490
  922    HD3  ARG 113           HD3      ARG 113   5.213   1.885  -5.081
  923    HE   ARG 113           HE       ARG 113   5.144  -0.509  -3.813
  924   HH11  ARG 113          HH11      ARG 113   3.066   0.864  -6.265
  925   HH12  ARG 113          HH12      ARG 113   2.762  -0.662  -7.034
  926   HH21  ARG 113          HH21      ARG 113   4.736  -2.508  -4.808
  927   HH22  ARG 113          HH22      ARG 113   3.694  -2.577  -6.195
  928    H    ILE 114           H        ILE 114   8.753  -0.031  -1.389
  929    HA   ILE 114           HA       ILE 114  10.960   1.116  -2.826
  930    HB   ILE 114           HB       ILE 114  10.891  -0.142  -0.079
  931   HG12  ILE 114          HG12      ILE 114  10.688   2.761  -0.893
  932   HG13  ILE 114          HG13      ILE 114   9.330   1.767  -0.388
  933   HG21  ILE 114          HG21      ILE 114  13.147   0.019  -1.071
  934   HG22  ILE 114          HG22      ILE 114  12.948   1.067   0.335
  935   HG23  ILE 114          HG23      ILE 114  12.901   1.753  -1.290
  936   HD11  ILE 114          HD11      ILE 114  10.149   3.227   1.418
  937   HD12  ILE 114          HD12      ILE 114  11.713   2.418   1.339
  938   HD13  ILE 114          HD13      ILE 114  10.279   1.517   1.827
  939    H    VAL 115           H        VAL 115   9.999  -2.057  -1.559
  940    HA   VAL 115           HA       VAL 115  12.339  -3.438  -2.309
  941    HB   VAL 115           HB       VAL 115  11.035  -5.509  -2.123
  942   HG11  VAL 115          HG11      VAL 115  10.381  -3.545   0.065
  943   HG12  VAL 115          HG12      VAL 115  11.887  -4.445  -0.100
  944   HG13  VAL 115          HG13      VAL 115  10.379  -5.303   0.205
  945   HG21  VAL 115          HG21      VAL 115   8.666  -5.475  -1.562
  946   HG22  VAL 115          HG22      VAL 115   8.947  -4.749  -3.144
  947   HG23  VAL 115          HG23      VAL 115   8.637  -3.721  -1.745
  948    H    ASP 116           H        ASP 116   9.360  -2.705  -4.034
  949    HA   ASP 116           HA       ASP 116   9.771  -4.347  -6.266
  950    HB2  ASP 116           HB2      ASP 116   7.615  -3.343  -5.847
  951    HB3  ASP 116           HB3      ASP 116   8.290  -1.725  -6.005
  952    H    LYS 117           H        LYS 117  10.698  -0.948  -5.691
  953    HA   LYS 117           HA       LYS 117  11.650  -0.638  -8.349
  954    HB2  LYS 117           HB2      LYS 117  11.012   1.112  -6.344
  955    HB3  LYS 117           HB3      LYS 117  12.770   1.217  -6.376
  956    HG2  LYS 117           HG2      LYS 117  11.936   2.883  -7.851
  957    HG3  LYS 117           HG3      LYS 117  12.615   1.593  -8.850
  958    HD2  LYS 117           HD2      LYS 117  10.168   0.669  -8.806
  959    HD3  LYS 117           HD3      LYS 117   9.754   2.332  -8.387
  960    HE2  LYS 117           HE2      LYS 117  11.290   1.457 -10.834
  961    HE3  LYS 117           HE3      LYS 117   9.593   1.926 -10.799
  962    HZ1  LYS 117           HZ1      LYS 117  10.697   3.821 -11.500
  963    HZ2  LYS 117           HZ2      LYS 117  11.987   3.622 -10.423
  964    HZ3  LYS 117           HZ3      LYS 117  10.467   4.112  -9.850
  965    H    LEU 118           H        LEU 118  13.174  -1.679  -5.365
  966    HA   LEU 118           HA       LEU 118  15.855  -1.335  -6.089
  967    HB2  LEU 118           HB2      LEU 118  14.604  -3.543  -4.468
  968    HB3  LEU 118           HB3      LEU 118  16.327  -3.289  -4.626
  969    HG   LEU 118           HG       LEU 118  14.320  -1.661  -3.126
  970   HD11  LEU 118          HD11      LEU 118  16.026  -1.949  -1.370
  971   HD12  LEU 118          HD12      LEU 118  17.010  -2.876  -2.510
  972   HD13  LEU 118          HD13      LEU 118  15.433  -3.486  -2.000
  973   HD21  LEU 118          HD21      LEU 118  16.024   0.063  -2.797
  974   HD22  LEU 118          HD22      LEU 118  15.551  -0.051  -4.491
  975   HD23  LEU 118          HD23      LEU 118  17.079  -0.750  -3.953
  976    H    LEU 119           H        LEU 119  13.662  -4.047  -6.659
  977    HA   LEU 119           HA       LEU 119  15.504  -5.717  -7.989
  978    HB2  LEU 119           HB2      LEU 119  12.516  -5.522  -7.949
  979    HB3  LEU 119           HB3      LEU 119  13.311  -6.638  -9.038
  980    HG   LEU 119           HG       LEU 119  12.548  -7.739  -6.972
  981   HD11  LEU 119          HD11      LEU 119  14.475  -8.600  -8.220
  982   HD12  LEU 119          HD12      LEU 119  14.598  -8.926  -6.493
  983   HD13  LEU 119          HD13      LEU 119  15.548  -7.629  -7.213
  984   HD21  LEU 119          HD21      LEU 119  14.555  -5.953  -5.589
  985   HD22  LEU 119          HD22      LEU 119  13.718  -7.321  -4.853
  986   HD23  LEU 119          HD23      LEU 119  12.802  -5.909  -5.384
  987    H    ALA 120           H        ALA 120  13.543  -3.057  -9.033
  988    HA   ALA 120           HA       ALA 120  13.723  -3.602 -11.834
  989    HB1  ALA 120           HB1      ALA 120  13.047  -1.002 -10.474
  990    HB2  ALA 120           HB2      ALA 120  11.900  -2.308 -10.768
  991    HB3  ALA 120           HB3      ALA 120  12.655  -1.473 -12.129
  992    H    LEU 121           H        LEU 121  15.418  -1.456  -9.587
  993    HA   LEU 121           HA       LEU 121  17.242  -0.441 -11.539
  994    HB2  LEU 121           HB2      LEU 121  17.176  -0.485  -8.540
  995    HB3  LEU 121           HB3      LEU 121  18.610   0.049  -9.387
  996    HG   LEU 121           HG       LEU 121  17.371   1.870 -10.406
  997   HD11  LEU 121          HD11      LEU 121  15.004   0.865  -8.842
  998   HD12  LEU 121          HD12      LEU 121  15.185   0.815 -10.596
  999   HD13  LEU 121          HD13      LEU 121  15.075   2.368  -9.764
 1000   HD21  LEU 121          HD21      LEU 121  16.915   3.148  -8.341
 1001   HD22  LEU 121          HD22      LEU 121  18.439   2.261  -8.283
 1002   HD23  LEU 121          HD23      LEU 121  17.031   1.642  -7.423
 1003    H    GLY 122           H        GLY 122  16.990  -3.312  -9.689
 1004    HA2  GLY 122           HA2      GLY 122  18.286  -5.213  -9.667
 1005    HA3  GLY 122           HA3      GLY 122  19.384  -4.442 -10.805
 1006    H    LEU 123           H        LEU 123  18.422  -3.006  -7.780
 1007    HA   LEU 123           HA       LEU 123  21.151  -2.724  -6.934
 1008    HB2  LEU 123           HB2      LEU 123  18.498  -2.039  -5.689
 1009    HB3  LEU 123           HB3      LEU 123  20.019  -1.781  -4.852
 1010    HG   LEU 123           HG       LEU 123  19.205  -0.503  -7.464
 1011   HD11  LEU 123          HD11      LEU 123  19.457   0.644  -4.692
 1012   HD12  LEU 123          HD12      LEU 123  17.963   0.401  -5.593
 1013   HD13  LEU 123          HD13      LEU 123  19.157   1.571  -6.159
 1014   HD21  LEU 123          HD21      LEU 123  21.233   0.873  -7.143
 1015   HD22  LEU 123          HD22      LEU 123  21.594  -0.831  -7.412
 1016   HD23  LEU 123          HD23      LEU 123  21.686  -0.156  -5.784
 1017    H    VAL 124           H        VAL 124  18.641  -4.936  -6.569
 1018    HA   VAL 124           HA       VAL 124  20.310  -6.644  -4.868
 1019    HB   VAL 124           HB       VAL 124  18.317  -7.378  -3.605
 1020   HG11  VAL 124          HG11      VAL 124  18.247  -5.520  -2.085
 1021   HG12  VAL 124          HG12      VAL 124  18.794  -4.414  -3.341
 1022   HG13  VAL 124          HG13      VAL 124  19.883  -5.656  -2.726
 1023   HG21  VAL 124          HG21      VAL 124  16.328  -5.831  -3.656
 1024   HG22  VAL 124          HG22      VAL 124  16.550  -6.831  -5.090
 1025   HG23  VAL 124          HG23      VAL 124  17.013  -5.131  -5.121
 1026    H    ALA 125           H        ALA 125  19.387  -8.892  -4.845
 1027    HA   ALA 125           HA       ALA 125  18.504  -9.589  -7.551
 1028    HB1  ALA 125           HB1      ALA 125  19.273 -11.841  -7.047
 1029    HB2  ALA 125           HB2      ALA 125  19.625 -11.370  -5.386
 1030    HB3  ALA 125           HB3      ALA 125  20.549 -10.672  -6.716
 1031    H    GLU 126           H        GLU 126  17.504  -9.462  -4.290
 1032    HA   GLU 126           HA       GLU 126  14.799 -10.104  -4.873
 1033    HB2  GLU 126           HB2      GLU 126  14.546 -12.115  -3.635
 1034    HB3  GLU 126           HB3      GLU 126  15.906 -12.393  -4.721
 1035    HG2  GLU 126           HG2      GLU 126  17.463 -12.212  -3.016
 1036    HG3  GLU 126           HG3      GLU 126  16.350 -11.378  -1.950
 1037    H    ARG 127           H        ARG 127  13.694 -10.463  -2.522
 1038    HA   ARG 127           HA       ARG 127  14.239  -8.013  -1.183
 1039    HB2  ARG 127           HB2      ARG 127  12.232 -10.191  -0.795
 1040    HB3  ARG 127           HB3      ARG 127  12.395  -8.893   0.383
 1041    HG2  ARG 127           HG2      ARG 127  11.744  -7.261  -1.123
 1042    HG3  ARG 127           HG3      ARG 127  12.084  -8.276  -2.526
 1043    HD2  ARG 127           HD2      ARG 127   9.695  -8.017  -2.172
 1044    HD3  ARG 127           HD3      ARG 127  10.191  -9.693  -1.966
 1045    HE   ARG 127           HE       ARG 127  10.236  -8.596   0.552
 1046   HH11  ARG 127          HH11      ARG 127   7.855  -9.017  -1.966
 1047   HH12  ARG 127          HH12      ARG 127   6.527  -9.190  -0.864
 1048   HH21  ARG 127          HH21      ARG 127   8.487  -8.797   2.019
 1049   HH22  ARG 127          HH22      ARG 127   6.885  -9.057   1.410
 1050    H    ARG 128           H        ARG 128  15.222 -11.284  -0.594
 1051    HA   ARG 128           HA       ARG 128  15.892 -11.179   2.101
 1052    HB2  ARG 128           HB2      ARG 128  16.106 -13.176   0.649
 1053    HB3  ARG 128           HB3      ARG 128  17.507 -12.447  -0.115
 1054    HG2  ARG 128           HG2      ARG 128  18.550 -12.395   2.194
 1055    HG3  ARG 128           HG3      ARG 128  17.239 -13.469   2.688
 1056    HD2  ARG 128           HD2      ARG 128  19.507 -13.970   0.812
 1057    HD3  ARG 128           HD3      ARG 128  18.883 -14.983   2.113
 1058    HE   ARG 128           HE       ARG 128  17.241 -14.573  -0.284
 1059   HH11  ARG 128          HH11      ARG 128  19.184 -16.729   1.676
 1060   HH12  ARG 128          HH12      ARG 128  18.647 -18.155   0.856
 1061   HH21  ARG 128          HH21      ARG 128  16.565 -16.416  -1.379
 1062   HH22  ARG 128          HH22      ARG 128  17.152 -17.980  -0.901
 1063    H    GLU 129           H        GLU 129  17.553  -9.813  -0.673
 1064    HA   GLU 129           HA       GLU 129  20.055  -9.419   0.608
 1065    HB2  GLU 129           HB2      GLU 129  18.896  -8.234  -1.908
 1066    HB3  GLU 129           HB3      GLU 129  20.566  -8.055  -1.401
 1067    HG2  GLU 129           HG2      GLU 129  19.238 -10.699  -1.917
 1068    HG3  GLU 129           HG3      GLU 129  20.186  -9.816  -3.115
 1069    H    LEU 130           H        LEU 130  17.145  -7.657   0.750
 1070    HA   LEU 130           HA       LEU 130  18.527  -5.156   1.313
 1071    HB2  LEU 130           HB2      LEU 130  15.869  -4.598   1.666
 1072    HB3  LEU 130           HB3      LEU 130  16.789  -4.320   0.204
 1073    HG   LEU 130           HG       LEU 130  15.364  -6.928   0.642
 1074   HD11  LEU 130          HD11      LEU 130  13.463  -6.003  -0.588
 1075   HD12  LEU 130          HD12      LEU 130  14.213  -4.407  -0.542
 1076   HD13  LEU 130          HD13      LEU 130  13.698  -5.185   0.956
 1077   HD21  LEU 130          HD21      LEU 130  15.251  -6.726  -1.895
 1078   HD22  LEU 130          HD22      LEU 130  16.840  -7.033  -1.193
 1079   HD23  LEU 130          HD23      LEU 130  16.403  -5.402  -1.728
 1080    H    TYR 131           H        TYR 131  17.769  -7.808   2.959
 1081    HA   TYR 131           HA       TYR 131  17.684  -6.315   5.495
 1082    HB2  TYR 131           HB2      TYR 131  16.475  -9.058   5.037
 1083    HB3  TYR 131           HB3      TYR 131  16.399  -8.105   6.514
 1084    HD1  TYR 131           HD1      TYR 131  14.792  -8.894   3.445
 1085    HD2  TYR 131           HD2      TYR 131  15.150  -5.837   6.382
 1086    HE1  TYR 131           HE1      TYR 131  12.690  -7.897   2.646
 1087    HE2  TYR 131           HE2      TYR 131  13.045  -4.832   5.595
 1088    HH   TYR 131           HH       TYR 131  11.698  -4.796   3.500
 1089    H    LYS 132           H        LYS 132  19.883  -6.367   5.860
 1090    HA   LYS 132           HA       LYS 132  21.407  -8.552   4.820
 1091    HB2  LYS 132           HB2      LYS 132  23.374  -7.297   5.547
 1092    HB3  LYS 132           HB3      LYS 132  22.261  -6.293   4.634
 1093    HG2  LYS 132           HG2      LYS 132  21.602  -5.095   6.518
 1094    HG3  LYS 132           HG3      LYS 132  22.204  -6.326   7.626
 1095    HD2  LYS 132           HD2      LYS 132  23.968  -4.663   5.834
 1096    HD3  LYS 132           HD3      LYS 132  23.593  -4.244   7.505
 1097    HE2  LYS 132           HE2      LYS 132  24.553  -6.430   8.203
 1098    HE3  LYS 132           HE3      LYS 132  25.033  -6.710   6.530
 1099    HZ1  LYS 132           HZ1      LYS 132  26.377  -4.683   6.641
 1100    HZ2  LYS 132           HZ2      LYS 132  26.870  -5.822   7.786
 1101    HZ3  LYS 132           HZ3      LYS 132  25.955  -4.484   8.268
 1102    H    LYS 133           H        LYS 133  19.927  -9.846   6.664
 1103    HA   LYS 133           HA       LYS 133  22.299 -10.865   7.990
 1104    HB2  LYS 133           HB2      LYS 133  21.005 -11.510  10.011
 1105    HB3  LYS 133           HB3      LYS 133  21.331  -9.786   9.851
 1106    HG2  LYS 133           HG2      LYS 133  18.996  -9.606   8.842
 1107    HG3  LYS 133           HG3      LYS 133  18.733 -11.239   9.455
 1108    HD2  LYS 133           HD2      LYS 133  19.267 -10.462  11.720
 1109    HD3  LYS 133           HD3      LYS 133  19.501  -8.826  11.098
 1110    HE2  LYS 133           HE2      LYS 133  17.129  -8.940  10.248
 1111    HE3  LYS 133           HE3      LYS 133  16.955 -10.431  11.173
 1112    HZ1  LYS 133           HZ1      LYS 133  16.139  -8.681  12.504
 1113    HZ2  LYS 133           HZ2      LYS 133  17.490  -7.705  12.211
 1114    HZ3  LYS 133           HZ3      LYS 133  17.637  -9.102  13.160
 1115    H    ARG 134           H        ARG 134  21.742 -11.936   5.837
 1116    HA   ARG 134           HA       ARG 134  21.392 -14.618   6.898
 1117    HB2  ARG 134           HB2      ARG 134  20.212 -13.644   4.281
 1118    HB3  ARG 134           HB3      ARG 134  20.629 -15.329   4.535
 1119    HG2  ARG 134           HG2      ARG 134  18.369 -15.287   4.979
 1120    HG3  ARG 134           HG3      ARG 134  19.072 -15.161   6.592
 1121    HD2  ARG 134           HD2      ARG 134  18.760 -12.752   6.552
 1122    HD3  ARG 134           HD3      ARG 134  18.087 -12.854   4.923
 1123    HE   ARG 134           HE       ARG 134  16.806 -14.191   7.222
 1124   HH11  ARG 134          HH11      ARG 134  16.646 -12.032   4.471
 1125   HH12  ARG 134          HH12      ARG 134  14.919 -11.900   4.512
 1126   HH21  ARG 134          HH21      ARG 134  14.536 -14.003   7.298
 1127   HH22  ARG 134          HH22      ARG 134  13.717 -13.017   6.128
 1128    H    GLN 135           H        GLN 135  23.614 -13.952   7.141
 1129    HA   GLN 135           HA       GLN 135  25.074 -14.105   4.575
 1130    HB2  GLN 135           HB2      GLN 135  25.833 -12.705   7.137
 1131    HB3  GLN 135           HB3      GLN 135  26.922 -12.910   5.774
 1132    HG2  GLN 135           HG2      GLN 135  24.298 -11.429   5.724
 1133    HG3  GLN 135           HG3      GLN 135  25.900 -10.697   5.786
 1134   HE21  GLN 135          HE21      GLN 135  23.759 -10.448   3.781
 1135   HE22  GLN 135          HE22      GLN 135  24.466 -10.906   2.273
 1136    H    LYS 136           H        LYS 136  25.167 -16.307   4.549
 1137    HA   LYS 136           HA       LYS 136  27.195 -17.449   6.323
 1138    HB2  LYS 136           HB2      LYS 136  24.598 -18.805   5.549
 1139    HB3  LYS 136           HB3      LYS 136  25.901 -19.545   6.474
 1140    HG2  LYS 136           HG2      LYS 136  25.562 -18.068   8.300
 1141    HG3  LYS 136           HG3      LYS 136  24.467 -17.061   7.360
 1142    HD2  LYS 136           HD2      LYS 136  22.911 -19.018   7.236
 1143    HD3  LYS 136           HD3      LYS 136  23.975 -19.851   8.375
 1144    HE2  LYS 136           HE2      LYS 136  23.674 -18.035   9.984
 1145    HE3  LYS 136           HE3      LYS 136  22.618 -17.202   8.847
 1146    HZ1  LYS 136           HZ1      LYS 136  22.087 -19.849  10.082
 1147    HZ2  LYS 136           HZ2      LYS 136  21.072 -19.051   8.991
 1148    HZ3  LYS 136           HZ3      LYS 136  21.358 -18.389  10.519
 1149    H    LYS 137           H        LYS 137  27.557 -19.858   5.239
 1150    HA   LYS 137           HA       LYS 137  28.767 -19.270   2.747
 1151    HB2  LYS 137           HB2      LYS 137  29.666 -21.460   2.812
 1152    HB3  LYS 137           HB3      LYS 137  29.591 -20.927   4.480
 1153    HG2  LYS 137           HG2      LYS 137  27.579 -22.746   3.168
 1154    HG3  LYS 137           HG3      LYS 137  28.937 -23.293   4.149
 1155    HD2  LYS 137           HD2      LYS 137  27.858 -22.837   6.064
 1156    HD3  LYS 137           HD3      LYS 137  27.233 -21.307   5.459
 1157    HE2  LYS 137           HE2      LYS 137  25.410 -22.844   5.923
 1158    HE3  LYS 137           HE3      LYS 137  25.511 -22.499   4.191
 1159    HZ1  LYS 137           HZ1      LYS 137  26.592 -24.928   5.530
 1160    HZ2  LYS 137           HZ2      LYS 137  26.631 -24.606   3.870
 1161    HZ3  LYS 137           HZ3      LYS 137  25.152 -24.855   4.647
 1162    H    LEU 138           H        LEU 138  26.944 -18.553   1.493
 1163    HA   LEU 138           HA       LEU 138  25.878 -20.792  -0.008
 1164    HB2  LEU 138           HB2      LEU 138  23.631 -19.663  -0.149
 1165    HB3  LEU 138           HB3      LEU 138  24.033 -20.491   1.348
 1166    HG   LEU 138           HG       LEU 138  24.721 -17.645   1.380
 1167   HD11  LEU 138          HD11      LEU 138  22.405 -16.890   1.568
 1168   HD12  LEU 138          HD12      LEU 138  21.845 -18.508   1.139
 1169   HD13  LEU 138          HD13      LEU 138  22.740 -17.547  -0.036
 1170   HD21  LEU 138          HD21      LEU 138  22.973 -19.331   3.170
 1171   HD22  LEU 138          HD22      LEU 138  23.757 -17.804   3.573
 1172   HD23  LEU 138          HD23      LEU 138  24.732 -19.254   3.302
 1173    H    ALA 139           H        ALA 139  24.809 -20.031  -2.067
 1174    HA   ALA 139           HA       ALA 139  26.579 -18.194  -3.395
 1175    HB1  ALA 139           HB1      ALA 139  25.789 -20.206  -4.534
 1176    HB2  ALA 139           HB2      ALA 139  25.284 -18.757  -5.404
 1177    HB3  ALA 139           HB3      ALA 139  24.125 -19.635  -4.407
 1178    H    SER 140           H        SER 140  25.165 -16.750  -5.126
 1179    HA   SER 140           HA       SER 140  24.124 -14.623  -3.624
 1180    HB2  SER 140           HB2      SER 140  23.296 -13.817  -5.899
 1181    HB3  SER 140           HB3      SER 140  25.028 -14.122  -5.763
 1182    HG   SER 140           HG       SER 140  23.085 -15.877  -6.874
 1183    H    SER 141           H        SER 141  22.079 -13.981  -3.149
 1184    HA   SER 141           HA       SER 141  20.165 -15.938  -2.656
 1185    HB2  SER 141           HB2      SER 141  19.807 -12.940  -2.795
 1186    HB3  SER 141           HB3      SER 141  18.732 -14.074  -1.977
 1187    HG   SER 141           HG       SER 141  20.781 -12.872  -0.915
  Start of MODEL    8
    1    H1   ASP   1           HT1      ASP   1 -29.985   8.063  -9.711
    2    H2   ASP   1           HT2      ASP   1 -31.510   8.731  -9.972
    3    H3   ASP   1           HT3      ASP   1 -31.346   7.379  -8.977
    4    HA   ASP   1           HA       ASP   1 -30.351  10.107  -8.474
    5    HB2  ASP   1           HB2      ASP   1 -32.772   9.769  -8.088
    6    HB3  ASP   1           HB3      ASP   1 -32.389   8.490  -6.939
    7    HA   PRO   2           HA       PRO   2 -28.848   7.303  -4.780
    8    HB2  PRO   2           HB2      PRO   2 -28.657   4.622  -5.986
    9    HB3  PRO   2           HB3      PRO   2 -29.317   5.109  -4.424
   10    HG2  PRO   2           HG2      PRO   2 -30.914   4.320  -6.414
   11    HG3  PRO   2           HG3      PRO   2 -31.392   5.627  -5.313
   12    HD2  PRO   2           HD2      PRO   2 -30.278   5.806  -8.093
   13    HD3  PRO   2           HD3      PRO   2 -31.625   6.702  -7.360
   14    H    SER   3           H        SER   3 -27.536   8.285  -7.338
   15    HA   SER   3           HA       SER   3 -24.886   7.361  -6.574
   16    HB2  SER   3           HB2      SER   3 -25.726   5.943  -8.525
   17    HB3  SER   3           HB3      SER   3 -25.669   7.413  -9.490
   18    HG   SER   3           HG       SER   3 -23.522   6.082  -8.210
   19    H    ARG   4           H        ARG   4 -26.599   9.779  -6.381
   20    HA   ARG   4           HA       ARG   4 -25.178  11.756  -7.972
   21    HB2  ARG   4           HB2      ARG   4 -27.399  11.982  -5.937
   22    HB3  ARG   4           HB3      ARG   4 -26.664  13.369  -6.721
   23    HG2  ARG   4           HG2      ARG   4 -28.114  11.137  -8.125
   24    HG3  ARG   4           HG3      ARG   4 -28.782  12.726  -7.758
   25    HD2  ARG   4           HD2      ARG   4 -28.114  12.883  -9.995
   26    HD3  ARG   4           HD3      ARG   4 -26.816  13.665  -9.099
   27    HE   ARG   4           HE       ARG   4 -26.200  10.942  -9.454
   28   HH11  ARG   4          HH11      ARG   4 -26.428  13.921 -11.265
   29   HH12  ARG   4          HH12      ARG   4 -25.299  13.424 -12.482
   30   HH21  ARG   4          HH21      ARG   4 -24.695  10.274 -11.059
   31   HH22  ARG   4          HH22      ARG   4 -24.304  11.357 -12.357
   32    H    ARG   5           H        ARG   5 -25.060  13.870  -6.166
   33    HA   ARG   5           HA       ARG   5 -22.621  13.752  -4.987
   34    HB2  ARG   5           HB2      ARG   5 -23.809  15.840  -5.173
   35    HB3  ARG   5           HB3      ARG   5 -25.062  15.281  -4.077
   36    HG2  ARG   5           HG2      ARG   5 -23.560  16.867  -2.997
   37    HG3  ARG   5           HG3      ARG   5 -23.483  15.280  -2.232
   38    HD2  ARG   5           HD2      ARG   5 -21.264  16.288  -2.493
   39    HD3  ARG   5           HD3      ARG   5 -21.419  14.787  -3.406
   40    HE   ARG   5           HE       ARG   5 -21.908  17.278  -4.837
   41   HH11  ARG   5          HH11      ARG   5 -19.689  14.681  -4.086
   42   HH12  ARG   5          HH12      ARG   5 -18.702  14.952  -5.484
   43   HH21  ARG   5          HH21      ARG   5 -20.606  17.637  -6.674
   44   HH22  ARG   5          HH22      ARG   5 -19.218  16.640  -6.951
   45    H    ALA   6           H        ALA   6 -21.809  12.374  -3.601
   46    HA   ALA   6           HA       ALA   6 -23.418  10.727  -1.948
   47    HB1  ALA   6           HB1      ALA   6 -21.317   9.808  -1.139
   48    HB2  ALA   6           HB2      ALA   6 -20.433  11.085  -1.975
   49    HB3  ALA   6           HB3      ALA   6 -21.354   9.899  -2.900
   50    HA   PRO   7           HA       PRO   7 -23.091  13.093   1.816
   51    HB2  PRO   7           HB2      PRO   7 -24.419  11.469   3.402
   52    HB3  PRO   7           HB3      PRO   7 -25.232  12.174   1.997
   53    HG2  PRO   7           HG2      PRO   7 -24.075   9.432   2.313
   54    HG3  PRO   7           HG3      PRO   7 -25.635   9.910   1.616
   55    HD2  PRO   7           HD2      PRO   7 -23.316   9.411   0.163
   56    HD3  PRO   7           HD3      PRO   7 -24.705  10.348  -0.420
   57    H    THR   8           H        THR   8 -22.540  12.429   4.207
   58    HA   THR   8           HA       THR   8 -20.026  10.961   4.105
   59    HB   THR   8           HB       THR   8 -19.873  11.860   6.532
   60    HG1  THR   8           HG1      THR   8 -21.767  13.715   5.486
   61   HG21  THR   8          HG21      THR   8 -19.813  13.729   4.166
   62   HG22  THR   8          HG22      THR   8 -18.504  12.668   4.688
   63   HG23  THR   8          HG23      THR   8 -19.019  14.006   5.714
   64    H    TRP   9           H        TRP   9 -19.608   9.157   5.283
   65    HA   TRP   9           HA       TRP   9 -21.863   7.557   6.018
   66    HB2  TRP   9           HB2      TRP   9 -18.887   7.074   6.236
   67    HB3  TRP   9           HB3      TRP   9 -20.106   5.883   6.663
   68    HD1  TRP   9           HD1      TRP   9 -19.325   8.017   3.491
   69    HE1  TRP   9           HE1      TRP   9 -19.599   6.493   1.433
   70    HE3  TRP   9           HE3      TRP   9 -20.765   3.721   5.858
   71    HZ2  TRP   9           HZ2      TRP   9 -20.321   3.819   0.894
   72    HZ3  TRP   9           HZ3      TRP   9 -21.230   1.725   4.494
   73    HH2  TRP   9           HH2      TRP   9 -21.014   1.777   2.062
   74    H    SER  10           H        SER  10 -21.883   6.378   8.120
   75    HA   SER  10           HA       SER  10 -20.861   7.963  10.359
   76    HB2  SER  10           HB2      SER  10 -23.709   6.945  10.113
   77    HB3  SER  10           HB3      SER  10 -23.027   7.774  11.516
   78    HG   SER  10           HG       SER  10 -22.530   9.277   9.399
   79    HA   PRO  11           HA       PRO  11 -19.243   4.382  12.227
   80    HB2  PRO  11           HB2      PRO  11 -21.229   4.816  14.431
   81    HB3  PRO  11           HB3      PRO  11 -19.503   4.442  14.535
   82    HG2  PRO  11           HG2      PRO  11 -20.364   6.937  14.875
   83    HG3  PRO  11           HG3      PRO  11 -18.867   6.607  13.984
   84    HD2  PRO  11           HD2      PRO  11 -21.514   7.482  12.973
   85    HD3  PRO  11           HD3      PRO  11 -19.897   7.752  12.297
   86    H    GLU  12           H        GLU  12 -22.783   4.492  12.659
   87    HA   GLU  12           HA       GLU  12 -23.222   1.751  12.933
   88    HB2  GLU  12           HB2      GLU  12 -25.129   3.607  11.513
   89    HB3  GLU  12           HB3      GLU  12 -25.516   2.160  12.430
   90    HG2  GLU  12           HG2      GLU  12 -26.148   3.848  13.858
   91    HG3  GLU  12           HG3      GLU  12 -24.528   3.460  14.436
   92    H    GLU  13           H        GLU  13 -23.269   3.742  10.004
   93    HA   GLU  13           HA       GLU  13 -23.941   1.528   8.313
   94    HB2  GLU  13           HB2      GLU  13 -24.479   4.034   7.969
   95    HB3  GLU  13           HB3      GLU  13 -22.839   4.154   7.344
   96    HG2  GLU  13           HG2      GLU  13 -24.374   3.878   5.520
   97    HG3  GLU  13           HG3      GLU  13 -23.382   2.427   5.671
   98    H    GLU  14           H        GLU  14 -21.004   3.190   9.263
   99    HA   GLU  14           HA       GLU  14 -19.305   1.958   7.331
  100    HB2  GLU  14           HB2      GLU  14 -18.612   3.117  10.045
  101    HB3  GLU  14           HB3      GLU  14 -17.468   2.750   8.760
  102    HG2  GLU  14           HG2      GLU  14 -18.517   4.411   7.329
  103    HG3  GLU  14           HG3      GLU  14 -19.702   4.759   8.586
  104    H    ALA  15           H        ALA  15 -20.378   1.133  10.588
  105    HA   ALA  15           HA       ALA  15 -18.814  -1.204  10.911
  106    HB1  ALA  15           HB1      ALA  15 -20.480  -1.821  12.618
  107    HB2  ALA  15           HB2      ALA  15 -21.517  -0.505  12.067
  108    HB3  ALA  15           HB3      ALA  15 -19.947  -0.150  12.790
  109    H    HIS  16           H        HIS  16 -21.858  -0.534   9.375
  110    HA   HIS  16           HA       HIS  16 -22.533  -3.206   8.711
  111    HB2  HIS  16           HB2      HIS  16 -24.213  -1.412   8.870
  112    HB3  HIS  16           HB3      HIS  16 -23.466  -0.592   7.506
  113    HD1  HIS  16           HD1      HIS  16 -25.487  -0.727   5.993
  114    HD2  HIS  16           HD2      HIS  16 -24.213  -4.434   7.379
  115    HE1  HIS  16           HE1      HIS  16 -26.727  -2.452   4.621
  116    HE2  HIS  16           HE2      HIS  16 -25.883  -4.676   5.430
  117    H    LEU  17           H        LEU  17 -20.586  -0.701   7.274
  118    HA   LEU  17           HA       LEU  17 -20.364  -1.815   4.687
  119    HB2  LEU  17           HB2      LEU  17 -19.732   0.510   5.322
  120    HB3  LEU  17           HB3      LEU  17 -18.342  -0.137   6.170
  121    HG   LEU  17           HG       LEU  17 -17.454  -1.008   4.052
  122   HD11  LEU  17          HD11      LEU  17 -19.885   0.303   2.858
  123   HD12  LEU  17          HD12      LEU  17 -19.473  -1.411   2.825
  124   HD13  LEU  17          HD13      LEU  17 -18.492  -0.249   1.935
  125   HD21  LEU  17          HD21      LEU  17 -16.929   1.163   3.022
  126   HD22  LEU  17          HD22      LEU  17 -16.743   1.176   4.776
  127   HD23  LEU  17          HD23      LEU  17 -18.161   1.919   4.033
  128    H    ARG  18           H        ARG  18 -18.334  -2.103   7.596
  129    HA   ARG  18           HA       ARG  18 -16.611  -4.062   6.432
  130    HB2  ARG  18           HB2      ARG  18 -15.682  -4.343   8.634
  131    HB3  ARG  18           HB3      ARG  18 -15.969  -2.625   8.395
  132    HG2  ARG  18           HG2      ARG  18 -17.979  -2.745   9.733
  133    HG3  ARG  18           HG3      ARG  18 -17.782  -4.487   9.909
  134    HD2  ARG  18           HD2      ARG  18 -15.615  -4.060  11.056
  135    HD3  ARG  18           HD3      ARG  18 -15.969  -2.332  10.985
  136    HE   ARG  18           HE       ARG  18 -18.160  -3.612  12.152
  137   HH11  ARG  18          HH11      ARG  18 -14.800  -2.966  12.900
  138   HH12  ARG  18          HH12      ARG  18 -15.050  -3.002  14.616
  139   HH21  ARG  18          HH21      ARG  18 -18.484  -3.674  14.402
  140   HH22  ARG  18          HH22      ARG  18 -17.143  -3.410  15.474
  141    H    GLU  19           H        GLU  19 -19.635  -3.996   8.084
  142    HA   GLU  19           HA       GLU  19 -19.919  -6.552   9.032
  143    HB2  GLU  19           HB2      GLU  19 -21.538  -4.736   9.377
  144    HB3  GLU  19           HB3      GLU  19 -22.025  -4.863   7.694
  145    HG2  GLU  19           HG2      GLU  19 -23.667  -5.970   8.935
  146    HG3  GLU  19           HG3      GLU  19 -22.687  -7.226   8.188
  147    H    LEU  20           H        LEU  20 -20.745  -5.302   5.833
  148    HA   LEU  20           HA       LEU  20 -21.470  -7.857   4.778
  149    HB2  LEU  20           HB2      LEU  20 -21.749  -5.146   4.051
  150    HB3  LEU  20           HB3      LEU  20 -20.881  -5.928   2.743
  151    HG   LEU  20           HG       LEU  20 -23.443  -7.064   3.829
  152   HD11  LEU  20          HD11      LEU  20 -23.821  -4.736   3.113
  153   HD12  LEU  20          HD12      LEU  20 -24.636  -5.911   2.084
  154   HD13  LEU  20          HD13      LEU  20 -23.150  -5.138   1.534
  155   HD21  LEU  20          HD21      LEU  20 -22.012  -7.335   1.190
  156   HD22  LEU  20          HD22      LEU  20 -23.534  -8.112   1.623
  157   HD23  LEU  20          HD23      LEU  20 -22.050  -8.541   2.475
  158    H    TYR  21           H        TYR  21 -18.544  -5.996   4.953
  159    HA   TYR  21           HA       TYR  21 -17.169  -7.327   2.842
  160    HB2  TYR  21           HB2      TYR  21 -16.340  -5.177   3.499
  161    HB3  TYR  21           HB3      TYR  21 -16.204  -5.677   5.181
  162    HD1  TYR  21           HD1      TYR  21 -14.932  -6.855   1.856
  163    HD2  TYR  21           HD2      TYR  21 -14.069  -6.033   5.937
  164    HE1  TYR  21           HE1      TYR  21 -12.596  -7.532   1.491
  165    HE2  TYR  21           HE2      TYR  21 -11.730  -6.705   5.584
  166    HH   TYR  21           HH       TYR  21 -10.479  -7.447   2.375
  167    H    LEU  22           H        LEU  22 -17.145  -7.624   6.367
  168    HA   LEU  22           HA       LEU  22 -15.280  -9.731   6.491
  169    HB2  LEU  22           HB2      LEU  22 -17.499  -9.143   8.452
  170    HB3  LEU  22           HB3      LEU  22 -16.013 -10.008   8.776
  171    HG   LEU  22           HG       LEU  22 -16.270  -7.071   8.152
  172   HD11  LEU  22          HD11      LEU  22 -16.980  -7.660  10.400
  173   HD12  LEU  22          HD12      LEU  22 -15.469  -6.751  10.428
  174   HD13  LEU  22          HD13      LEU  22 -15.453  -8.497  10.674
  175   HD21  LEU  22          HD21      LEU  22 -13.776  -8.661   8.741
  176   HD22  LEU  22          HD22      LEU  22 -13.883  -6.913   8.517
  177   HD23  LEU  22          HD23      LEU  22 -14.227  -7.995   7.170
  178    H    ALA  23           H        ALA  23 -18.655  -9.623   5.807
  179    HA   ALA  23           HA       ALA  23 -19.270 -12.342   6.318
  180    HB1  ALA  23           HB1      ALA  23 -20.633 -10.365   4.492
  181    HB2  ALA  23           HB2      ALA  23 -20.999 -10.623   6.197
  182    HB3  ALA  23           HB3      ALA  23 -21.304 -11.905   5.025
  183    H    ASN  24           H        ASN  24 -18.564 -10.591   3.266
  184    HA   ASN  24           HA       ASN  24 -18.621 -13.153   1.879
  185    HB2  ASN  24           HB2      ASN  24 -18.686 -10.307   0.893
  186    HB3  ASN  24           HB3      ASN  24 -18.554 -11.692  -0.186
  187   HD21  ASN  24          HD21      ASN  24 -20.602  -9.937   1.994
  188   HD22  ASN  24          HD22      ASN  24 -22.083 -10.714   1.548
  189    H    LYS  25           H        LYS  25 -16.238 -11.460   3.375
  190    HA   LYS  25           HA       LYS  25 -14.241 -11.612   1.311
  191    HB2  LYS  25           HB2      LYS  25 -12.633 -10.964   2.989
  192    HB3  LYS  25           HB3      LYS  25 -14.062  -9.957   3.138
  193    HG2  LYS  25           HG2      LYS  25 -14.805 -11.285   5.048
  194    HG3  LYS  25           HG3      LYS  25 -13.372 -12.303   4.897
  195    HD2  LYS  25           HD2      LYS  25 -13.379  -9.331   5.465
  196    HD3  LYS  25           HD3      LYS  25 -13.096 -10.605   6.653
  197    HE2  LYS  25           HE2      LYS  25 -11.118 -11.328   5.353
  198    HE3  LYS  25           HE3      LYS  25 -11.390  -9.993   4.239
  199    HZ1  LYS  25           HZ1      LYS  25  -9.691  -9.482   5.883
  200    HZ2  LYS  25           HZ2      LYS  25 -10.802  -9.703   7.135
  201    HZ3  LYS  25           HZ3      LYS  25 -11.012  -8.441   6.031
  202    H    ASP  26           H        ASP  26 -15.694 -13.844   3.336
  203    HA   ASP  26           HA       ASP  26 -13.434 -15.695   3.364
  204    HB2  ASP  26           HB2      ASP  26 -14.815 -15.424   5.398
  205    HB3  ASP  26           HB3      ASP  26 -16.231 -15.967   4.506
  206    H    VAL  27           H        VAL  27 -15.317 -14.767   1.037
  207    HA   VAL  27           HA       VAL  27 -16.146 -17.437   0.134
  208    HB   VAL  27           HB       VAL  27 -17.122 -14.775  -0.910
  209   HG11  VAL  27          HG11      VAL  27 -18.872 -16.095  -1.979
  210   HG12  VAL  27          HG12      VAL  27 -18.167 -17.576  -1.330
  211   HG13  VAL  27          HG13      VAL  27 -17.274 -16.619  -2.512
  212   HG21  VAL  27          HG21      VAL  27 -18.442 -16.655   1.041
  213   HG22  VAL  27          HG22      VAL  27 -19.192 -15.231   0.323
  214   HG23  VAL  27          HG23      VAL  27 -17.809 -15.051   1.403
  215    H    GLU  28           H        GLU  28 -14.574 -18.271  -1.052
  216    HA   GLU  28           HA       GLU  28 -12.890 -16.683  -2.755
  217    HB2  GLU  28           HB2      GLU  28 -13.169 -19.690  -2.593
  218    HB3  GLU  28           HB3      GLU  28 -11.859 -18.806  -3.364
  219    HG2  GLU  28           HG2      GLU  28 -11.145 -17.935  -1.228
  220    HG3  GLU  28           HG3      GLU  28 -12.501 -18.727  -0.422
  221    H    GLY  29           H        GLY  29 -12.834 -16.746  -5.035
  222    HA2  GLY  29           HA2      GLY  29 -13.639 -17.155  -7.176
  223    HA3  GLY  29           HA3      GLY  29 -14.869 -18.204  -6.489
  224    H    GLN  30           H        GLN  30 -14.799 -15.292  -4.861
  225    HA   GLN  30           HA       GLN  30 -16.851 -14.116  -6.598
  226    HB2  GLN  30           HB2      GLN  30 -18.104 -15.190  -4.871
  227    HB3  GLN  30           HB3      GLN  30 -17.023 -14.588  -3.620
  228    HG2  GLN  30           HG2      GLN  30 -17.747 -12.279  -4.233
  229    HG3  GLN  30           HG3      GLN  30 -18.960 -13.004  -5.281
  230   HE21  GLN  30          HE21      GLN  30 -19.019 -11.336  -2.803
  231   HE22  GLN  30          HE22      GLN  30 -20.123 -12.156  -1.776
  232    H    ASP  31           H        ASP  31 -17.058 -11.872  -6.488
  233    HA   ASP  31           HA       ASP  31 -14.787 -10.391  -5.452
  234    HB2  ASP  31           HB2      ASP  31 -17.289  -9.514  -6.898
  235    HB3  ASP  31           HB3      ASP  31 -15.956  -8.441  -6.466
  236    H    VAL  32           H        VAL  32 -14.793  -9.818  -3.357
  237    HA   VAL  32           HA       VAL  32 -17.126  -9.774  -1.768
  238    HB   VAL  32           HB       VAL  32 -14.785 -10.072  -0.898
  239   HG11  VAL  32          HG11      VAL  32 -13.677  -8.273  -2.074
  240   HG12  VAL  32          HG12      VAL  32 -13.509  -8.053  -0.332
  241   HG13  VAL  32          HG13      VAL  32 -14.674  -7.080  -1.237
  242   HG21  VAL  32          HG21      VAL  32 -16.517  -7.977   0.399
  243   HG22  VAL  32          HG22      VAL  32 -15.205  -8.839   1.200
  244   HG23  VAL  32          HG23      VAL  32 -16.617  -9.722   0.623
  245    H    VAL  33           H        VAL  33 -15.437  -7.320  -3.612
  246    HA   VAL  33           HA       VAL  33 -16.558  -5.039  -2.481
  247    HB   VAL  33           HB       VAL  33 -14.745  -4.611  -3.865
  248   HG11  VAL  33          HG11      VAL  33 -14.571  -5.269  -6.209
  249   HG12  VAL  33          HG12      VAL  33 -16.093  -6.147  -6.057
  250   HG13  VAL  33          HG13      VAL  33 -14.685  -6.646  -5.116
  251   HG21  VAL  33          HG21      VAL  33 -15.524  -3.150  -5.662
  252   HG22  VAL  33          HG22      VAL  33 -16.421  -2.906  -4.163
  253   HG23  VAL  33          HG23      VAL  33 -17.145  -3.821  -5.486
  254    H    GLU  34           H        GLU  34 -17.732  -6.891  -5.324
  255    HA   GLU  34           HA       GLU  34 -19.953  -5.197  -5.749
  256    HB2  GLU  34           HB2      GLU  34 -19.142  -7.873  -6.752
  257    HB3  GLU  34           HB3      GLU  34 -20.834  -7.418  -6.920
  258    HG2  GLU  34           HG2      GLU  34 -20.094  -5.333  -8.043
  259    HG3  GLU  34           HG3      GLU  34 -18.444  -5.960  -8.014
  260    H    ALA  35           H        ALA  35 -19.460  -7.951  -3.677
  261    HA   ALA  35           HA       ALA  35 -22.159  -8.482  -3.062
  262    HB1  ALA  35           HB1      ALA  35 -19.706  -8.823  -1.334
  263    HB2  ALA  35           HB2      ALA  35 -20.369 -10.017  -2.454
  264    HB3  ALA  35           HB3      ALA  35 -21.290  -9.538  -1.028
  265    H    ILE  36           H        ILE  36 -19.760  -6.337  -1.620
  266    HA   ILE  36           HA       ILE  36 -21.433  -5.468   0.507
  267    HB   ILE  36           HB       ILE  36 -19.029  -4.050  -0.635
  268   HG12  ILE  36          HG12      ILE  36 -19.015  -5.974   1.678
  269   HG13  ILE  36          HG13      ILE  36 -18.730  -6.518   0.027
  270   HG21  ILE  36          HG21      ILE  36 -18.830  -3.164   1.658
  271   HG22  ILE  36          HG22      ILE  36 -20.342  -3.967   2.079
  272   HG23  ILE  36          HG23      ILE  36 -20.333  -2.684   0.871
  273   HD11  ILE  36          HD11      ILE  36 -17.115  -4.463   1.505
  274   HD12  ILE  36          HD12      ILE  36 -16.817  -5.029  -0.135
  275   HD13  ILE  36          HD13      ILE  36 -16.652  -6.137   1.227
  276    H    LEU  37           H        LEU  37 -20.233  -3.742  -2.381
  277    HA   LEU  37           HA       LEU  37 -21.632  -1.391  -1.830
  278    HB2  LEU  37           HB2      LEU  37 -21.223  -0.821  -4.245
  279    HB3  LEU  37           HB3      LEU  37 -19.819  -1.191  -3.273
  280    HG   LEU  37           HG       LEU  37 -19.895  -3.527  -4.302
  281   HD11  LEU  37          HD11      LEU  37 -21.736  -2.087  -6.219
  282   HD12  LEU  37          HD12      LEU  37 -22.142  -3.483  -5.221
  283   HD13  LEU  37          HD13      LEU  37 -20.966  -3.643  -6.527
  284   HD21  LEU  37          HD21      LEU  37 -19.330  -1.106  -5.992
  285   HD22  LEU  37          HD22      LEU  37 -18.758  -2.735  -6.334
  286   HD23  LEU  37          HD23      LEU  37 -18.226  -1.901  -4.875
  287    H    ALA  38           H        ALA  38 -22.757  -4.261  -3.336
  288    HA   ALA  38           HA       ALA  38 -25.025  -2.947  -4.572
  289    HB1  ALA  38           HB1      ALA  38 -23.848  -4.772  -5.711
  290    HB2  ALA  38           HB2      ALA  38 -25.557  -5.135  -5.455
  291    HB3  ALA  38           HB3      ALA  38 -24.333  -5.868  -4.418
  292    H    HIS  39           H        HIS  39 -24.416  -5.146  -1.837
  293    HA   HIS  39           HA       HIS  39 -27.222  -5.528  -1.373
  294    HB2  HIS  39           HB2      HIS  39 -24.768  -6.348   0.149
  295    HB3  HIS  39           HB3      HIS  39 -26.369  -6.536   0.850
  296    HD1  HIS  39           HD1      HIS  39 -27.813  -8.461  -0.012
  297    HD2  HIS  39           HD2      HIS  39 -24.229  -8.024  -2.065
  298    HE1  HIS  39           HE1      HIS  39 -27.582 -10.534  -1.416
  299    HE2  HIS  39           HE2      HIS  39 -25.292 -10.347  -2.455
  300    H    LEU  40           H        LEU  40 -24.752  -3.354  -0.068
  301    HA   LEU  40           HA       LEU  40 -26.927  -2.172   1.491
  302    HB2  LEU  40           HB2      LEU  40 -25.021  -0.689   2.443
  303    HB3  LEU  40           HB3      LEU  40 -25.276  -2.307   3.043
  304    HG   LEU  40           HG       LEU  40 -23.396  -3.022   1.464
  305   HD11  LEU  40          HD11      LEU  40 -22.970  -0.044   1.423
  306   HD12  LEU  40          HD12      LEU  40 -23.245  -1.106   0.038
  307   HD13  LEU  40          HD13      LEU  40 -21.753  -1.237   0.969
  308   HD21  LEU  40          HD21      LEU  40 -22.786  -1.165   3.756
  309   HD22  LEU  40          HD22      LEU  40 -21.690  -2.370   3.076
  310   HD23  LEU  40          HD23      LEU  40 -23.172  -2.881   3.886
  311    H    ASN  41           H        ASN  41 -27.956  -1.395  -0.335
  312    HA   ASN  41           HA       ASN  41 -26.692   0.786  -1.791
  313    HB2  ASN  41           HB2      ASN  41 -28.975   0.861  -2.950
  314    HB3  ASN  41           HB3      ASN  41 -28.011  -0.592  -3.195
  315   HD21  ASN  41          HD21      ASN  41 -28.674  -2.521  -2.318
  316   HD22  ASN  41          HD22      ASN  41 -30.262  -2.755  -1.671
  317    H    THR  42           H        THR  42 -26.870   1.178   0.885
  318    HA   THR  42           HA       THR  42 -29.182   2.809   1.511
  319    HB   THR  42           HB       THR  42 -28.489   1.353   3.267
  320    HG1  THR  42           HG1      THR  42 -27.580   3.030   4.847
  321   HG21  THR  42          HG21      THR  42 -25.719   2.528   2.992
  322   HG22  THR  42          HG22      THR  42 -26.213   0.900   2.519
  323   HG23  THR  42          HG23      THR  42 -26.221   1.362   4.219
  324    H    VAL  43           H        VAL  43 -25.835   3.171   0.615
  325    HA   VAL  43           HA       VAL  43 -26.038   6.085   1.028
  326    HB   VAL  43           HB       VAL  43 -23.387   4.982   0.404
  327   HG11  VAL  43          HG11      VAL  43 -24.340   6.852   2.546
  328   HG12  VAL  43          HG12      VAL  43 -23.747   7.315   0.949
  329   HG13  VAL  43          HG13      VAL  43 -22.660   6.541   2.103
  330   HG21  VAL  43          HG21      VAL  43 -24.139   3.190   1.851
  331   HG22  VAL  43          HG22      VAL  43 -24.590   4.365   3.089
  332   HG23  VAL  43          HG23      VAL  43 -22.895   4.165   2.632
  333    HA   PRO  44           HA       PRO  44 -25.701   6.099  -3.492
  334    HB2  PRO  44           HB2      PRO  44 -25.988   8.781  -3.815
  335    HB3  PRO  44           HB3      PRO  44 -27.358   7.698  -3.559
  336    HG2  PRO  44           HG2      PRO  44 -26.020   9.541  -1.650
  337    HG3  PRO  44           HG3      PRO  44 -27.729   9.098  -1.774
  338    HD2  PRO  44           HD2      PRO  44 -25.948   8.067   0.079
  339    HD3  PRO  44           HD3      PRO  44 -27.469   7.294  -0.407
  340    H    ARG  45           H        ARG  45 -23.597   5.602  -3.873
  341    HA   ARG  45           HA       ARG  45 -21.671   7.780  -3.858
  342    HB2  ARG  45           HB2      ARG  45 -19.997   6.617  -2.585
  343    HB3  ARG  45           HB3      ARG  45 -21.464   6.679  -1.618
  344    HG2  ARG  45           HG2      ARG  45 -21.235   4.268  -3.255
  345    HG3  ARG  45           HG3      ARG  45 -19.956   4.457  -2.061
  346    HD2  ARG  45           HD2      ARG  45 -21.570   4.699  -0.306
  347    HD3  ARG  45           HD3      ARG  45 -22.885   4.610  -1.460
  348    HE   ARG  45           HE       ARG  45 -21.247   2.419  -0.490
  349   HH11  ARG  45          HH11      ARG  45 -23.773   3.454  -2.695
  350   HH12  ARG  45          HH12      ARG  45 -24.319   1.840  -3.018
  351   HH21  ARG  45          HH21      ARG  45 -21.987   0.303  -0.926
  352   HH22  ARG  45          HH22      ARG  45 -23.306   0.060  -2.029
  353    H    THR  46           H        THR  46 -19.528   6.965  -4.783
  354    HA   THR  46           HA       THR  46 -20.038   5.309  -7.096
  355    HB   THR  46           HB       THR  46 -18.552   7.321  -7.221
  356    HG1  THR  46           HG1      THR  46 -17.966   6.139  -8.877
  357   HG21  THR  46          HG21      THR  46 -16.669   5.622  -5.581
  358   HG22  THR  46          HG22      THR  46 -17.441   7.114  -5.051
  359   HG23  THR  46          HG23      THR  46 -16.256   7.151  -6.356
  360    H    ARG  47           H        ARG  47 -18.523   3.462  -7.567
  361    HA   ARG  47           HA       ARG  47 -18.798   1.588  -5.447
  362    HB2  ARG  47           HB2      ARG  47 -17.180   1.197  -7.964
  363    HB3  ARG  47           HB3      ARG  47 -17.955  -0.035  -6.982
  364    HG2  ARG  47           HG2      ARG  47 -19.283   1.998  -8.757
  365    HG3  ARG  47           HG3      ARG  47 -19.247   0.247  -8.955
  366    HD2  ARG  47           HD2      ARG  47 -20.594  -0.023  -6.941
  367    HD3  ARG  47           HD3      ARG  47 -20.587   1.719  -6.688
  368    HE   ARG  47           HE       ARG  47 -21.705   0.680  -9.181
  369   HH11  ARG  47          HH11      ARG  47 -22.225   2.158  -6.049
  370   HH12  ARG  47          HH12      ARG  47 -23.865   2.597  -6.379
  371   HH21  ARG  47          HH21      ARG  47 -23.866   1.261  -9.626
  372   HH22  ARG  47          HH22      ARG  47 -24.813   2.062  -8.414
  373    H    LYS  48           H        LYS  48 -16.221   3.549  -6.654
  374    HA   LYS  48           HA       LYS  48 -13.985   2.381  -5.525
  375    HB2  LYS  48           HB2      LYS  48 -13.434   4.095  -6.927
  376    HB3  LYS  48           HB3      LYS  48 -14.766   5.104  -6.402
  377    HG2  LYS  48           HG2      LYS  48 -12.429   4.658  -4.589
  378    HG3  LYS  48           HG3      LYS  48 -12.321   5.817  -5.917
  379    HD2  LYS  48           HD2      LYS  48 -14.358   6.930  -5.042
  380    HD3  LYS  48           HD3      LYS  48 -14.341   5.822  -3.674
  381    HE2  LYS  48           HE2      LYS  48 -13.361   7.869  -2.970
  382    HE3  LYS  48           HE3      LYS  48 -12.071   6.675  -3.110
  383    HZ1  LYS  48           HZ1      LYS  48 -11.400   8.785  -4.051
  384    HZ2  LYS  48           HZ2      LYS  48 -12.721   8.780  -5.105
  385    HZ3  LYS  48           HZ3      LYS  48 -11.500   7.622  -5.273
  386    H    GLN  49           H        GLN  49 -16.517   4.239  -3.955
  387    HA   GLN  49           HA       GLN  49 -15.072   4.932  -1.633
  388    HB2  GLN  49           HB2      GLN  49 -18.009   4.673  -2.178
  389    HB3  GLN  49           HB3      GLN  49 -17.413   5.056  -0.571
  390    HG2  GLN  49           HG2      GLN  49 -16.129   6.952  -1.765
  391    HG3  GLN  49           HG3      GLN  49 -17.268   6.658  -3.074
  392   HE21  GLN  49          HE21      GLN  49 -18.174   8.720  -2.801
  393   HE22  GLN  49          HE22      GLN  49 -19.224   9.073  -1.475
  394    H    ILE  50           H        ILE  50 -17.107   2.140  -2.385
  395    HA   ILE  50           HA       ILE  50 -17.135   1.085   0.226
  396    HB   ILE  50           HB       ILE  50 -17.450  -0.298  -2.439
  397   HG12  ILE  50          HG12      ILE  50 -19.867  -0.453  -1.396
  398   HG13  ILE  50          HG13      ILE  50 -19.322   0.925  -0.450
  399   HG21  ILE  50          HG21      ILE  50 -18.402  -2.179  -1.164
  400   HG22  ILE  50          HG22      ILE  50 -17.884  -1.398   0.330
  401   HG23  ILE  50          HG23      ILE  50 -16.685  -1.931  -0.849
  402   HD11  ILE  50          HD11      ILE  50 -20.572   1.587  -2.443
  403   HD12  ILE  50          HD12      ILE  50 -19.366   0.792  -3.457
  404   HD13  ILE  50          HD13      ILE  50 -18.915   2.188  -2.475
  405    H    ILE  51           H        ILE  51 -15.096   0.390  -2.577
  406    HA   ILE  51           HA       ILE  51 -13.423  -1.542  -1.432
  407    HB   ILE  51           HB       ILE  51 -12.785   0.551  -3.513
  408   HG12  ILE  51          HG12      ILE  51 -13.535  -2.364  -3.762
  409   HG13  ILE  51          HG13      ILE  51 -14.586  -1.002  -4.128
  410   HG21  ILE  51          HG21      ILE  51 -10.878  -0.877  -4.123
  411   HG22  ILE  51          HG22      ILE  51 -11.215  -1.904  -2.729
  412   HG23  ILE  51          HG23      ILE  51 -10.731  -0.222  -2.491
  413   HD11  ILE  51          HD11      ILE  51 -13.646  -2.009  -6.143
  414   HD12  ILE  51          HD12      ILE  51 -12.020  -1.658  -5.558
  415   HD13  ILE  51          HD13      ILE  51 -13.124  -0.337  -5.945
  416    H    HIS  52           H        HIS  52 -13.205   1.971  -1.543
  417    HA   HIS  52           HA       HIS  52 -10.605   2.068  -0.387
  418    HB2  HIS  52           HB2      HIS  52 -12.597   4.054  -1.339
  419    HB3  HIS  52           HB3      HIS  52 -11.350   4.610  -0.225
  420    HD1  HIS  52           HD1      HIS  52  -9.602   5.708  -1.535
  421    HD2  HIS  52           HD2      HIS  52 -11.006   2.280  -3.439
  422    HE1  HIS  52           HE1      HIS  52  -8.173   5.433  -3.562
  423    HE2  HIS  52           HE2      HIS  52  -9.172   3.486  -4.814
  424    H    HIS  53           H        HIS  53 -13.867   2.872   0.865
  425    HA   HIS  53           HA       HIS  53 -13.035   3.973   3.292
  426    HB2  HIS  53           HB2      HIS  53 -15.552   2.442   2.631
  427    HB3  HIS  53           HB3      HIS  53 -15.289   3.224   4.180
  428    HD1  HIS  53           HD1      HIS  53 -13.950   5.831   2.838
  429    HD2  HIS  53           HD2      HIS  53 -17.642   4.119   1.886
  430    HE1  HIS  53           HE1      HIS  53 -15.298   7.667   1.786
  431    HE2  HIS  53           HE2      HIS  53 -17.541   6.649   1.300
  432    H    LEU  54           H        LEU  54 -13.334   0.630   2.338
  433    HA   LEU  54           HA       LEU  54 -13.197  -0.420   4.991
  434    HB2  LEU  54           HB2      LEU  54 -12.920  -1.657   2.267
  435    HB3  LEU  54           HB3      LEU  54 -12.770  -2.590   3.745
  436    HG   LEU  54           HG       LEU  54 -15.218  -0.956   3.091
  437   HD11  LEU  54          HD11      LEU  54 -16.268  -3.036   2.404
  438   HD12  LEU  54          HD12      LEU  54 -14.738  -3.889   2.606
  439   HD13  LEU  54          HD13      LEU  54 -14.899  -2.646   1.364
  440   HD21  LEU  54          HD21      LEU  54 -14.881  -1.501   5.452
  441   HD22  LEU  54          HD22      LEU  54 -14.727  -3.208   5.037
  442   HD23  LEU  54          HD23      LEU  54 -16.259  -2.376   4.783
  443    H    VAL  55           H        VAL  55 -10.820  -0.174   2.328
  444    HA   VAL  55           HA       VAL  55  -8.721  -1.254   3.940
  445    HB   VAL  55           HB       VAL  55  -7.179  -0.533   2.168
  446   HG11  VAL  55          HG11      VAL  55  -9.703  -1.835   1.178
  447   HG12  VAL  55          HG12      VAL  55  -8.320  -2.643   1.917
  448   HG13  VAL  55          HG13      VAL  55  -8.151  -1.868   0.341
  449   HG21  VAL  55          HG21      VAL  55  -9.608   0.693   0.878
  450   HG22  VAL  55          HG22      VAL  55  -8.022   0.517   0.132
  451   HG23  VAL  55          HG23      VAL  55  -8.226   1.574   1.530
  452    H    GLN  56           H        GLN  56 -10.107   1.852   3.509
  453    HA   GLN  56           HA       GLN  56  -8.005   3.405   4.618
  454    HB2  GLN  56           HB2      GLN  56 -10.929   3.811   4.132
  455    HB3  GLN  56           HB3      GLN  56 -10.044   4.975   5.097
  456    HG2  GLN  56           HG2      GLN  56  -8.633   5.542   3.278
  457    HG3  GLN  56           HG3      GLN  56  -9.215   4.179   2.318
  458   HE21  GLN  56          HE21      GLN  56  -9.853   5.496   0.636
  459   HE22  GLN  56          HE22      GLN  56 -11.240   6.532   0.738
  460    H    MET  57           H        MET  57 -10.494   1.408   5.984
  461    HA   MET  57           HA       MET  57 -10.059   2.511   8.637
  462    HB2  MET  57           HB2      MET  57 -11.965   0.456   7.555
  463    HB3  MET  57           HB3      MET  57 -11.731   0.663   9.288
  464    HG2  MET  57           HG2      MET  57 -12.383   3.014   9.081
  465    HG3  MET  57           HG3      MET  57 -12.657   2.778   7.358
  466    HE1  MET  57           HE1      MET  57 -15.780   0.494   7.244
  467    HE2  MET  57           HE2      MET  57 -14.079   0.097   7.001
  468    HE3  MET  57           HE3      MET  57 -14.742   1.586   6.329
  469    H    GLY  58           H        GLY  58  -8.391   0.518   6.741
  470    HA2  GLY  58           HA2      GLY  58  -6.608  -0.859   7.186
  471    HA3  GLY  58           HA3      GLY  58  -6.793  -0.432   8.878
  472    H    LEU  59           H        LEU  59  -9.613  -1.705   7.479
  473    HA   LEU  59           HA       LEU  59  -9.149  -4.238   8.871
  474    HB2  LEU  59           HB2      LEU  59 -11.599  -4.578   8.624
  475    HB3  LEU  59           HB3      LEU  59 -11.154  -3.176   9.572
  476    HG   LEU  59           HG       LEU  59 -11.523  -1.847   7.389
  477   HD11  LEU  59          HD11      LEU  59 -13.203  -4.258   6.759
  478   HD12  LEU  59          HD12      LEU  59 -11.669  -3.885   5.974
  479   HD13  LEU  59          HD13      LEU  59 -13.034  -2.781   5.812
  480   HD21  LEU  59          HD21      LEU  59 -13.940  -1.699   7.873
  481   HD22  LEU  59          HD22      LEU  59 -12.931  -1.604   9.315
  482   HD23  LEU  59          HD23      LEU  59 -13.783  -3.101   8.932
  483    H    ALA  60           H        ALA  60  -9.437  -2.863   5.776
  484    HA   ALA  60           HA       ALA  60  -9.194  -5.552   4.590
  485    HB1  ALA  60           HB1      ALA  60  -9.818  -4.506   2.448
  486    HB2  ALA  60           HB2      ALA  60 -10.028  -2.965   3.280
  487    HB3  ALA  60           HB3      ALA  60 -11.078  -4.326   3.671
  488    H    ASP  61           H        ASP  61  -7.542  -5.847   3.006
  489    HA   ASP  61           HA       ASP  61  -5.087  -4.752   3.895
  490    HB2  ASP  61           HB2      ASP  61  -5.326  -7.049   3.009
  491    HB3  ASP  61           HB3      ASP  61  -5.648  -6.376   1.413
  492    H    SER  62           H        SER  62  -6.474  -4.661   0.616
  493    HA   SER  62           HA       SER  62  -5.597  -1.931   0.223
  494    HB2  SER  62           HB2      SER  62  -4.482  -4.112  -1.536
  495    HB3  SER  62           HB3      SER  62  -4.107  -2.398  -1.616
  496    HG   SER  62           HG       SER  62  -3.348  -4.279   0.372
  497    H    VAL  63           H        VAL  63  -6.011  -1.371  -2.208
  498    HA   VAL  63           HA       VAL  63  -8.680  -1.997  -2.884
  499    HB   VAL  63           HB       VAL  63  -6.436  -0.738  -4.470
  500   HG11  VAL  63          HG11      VAL  63  -7.947  -1.817  -6.050
  501   HG12  VAL  63          HG12      VAL  63  -8.113  -0.062  -6.127
  502   HG13  VAL  63          HG13      VAL  63  -9.326  -1.027  -5.288
  503   HG21  VAL  63          HG21      VAL  63  -8.917   0.383  -3.176
  504   HG22  VAL  63          HG22      VAL  63  -7.756   1.309  -4.128
  505   HG23  VAL  63          HG23      VAL  63  -7.260   0.572  -2.604
  506    H    LYS  64           H        LYS  64  -5.628  -3.427  -3.610
  507    HA   LYS  64           HA       LYS  64  -6.271  -5.000  -5.833
  508    HB2  LYS  64           HB2      LYS  64  -4.344  -5.634  -3.599
  509    HB3  LYS  64           HB3      LYS  64  -4.344  -6.365  -5.189
  510    HG2  LYS  64           HG2      LYS  64  -3.855  -4.175  -6.182
  511    HG3  LYS  64           HG3      LYS  64  -3.809  -3.471  -4.566
  512    HD2  LYS  64           HD2      LYS  64  -2.004  -5.696  -5.514
  513    HD3  LYS  64           HD3      LYS  64  -1.564  -3.989  -5.520
  514    HE2  LYS  64           HE2      LYS  64  -0.638  -4.642  -3.531
  515    HE3  LYS  64           HE3      LYS  64  -2.234  -4.144  -2.979
  516    HZ1  LYS  64           HZ1      LYS  64  -2.931  -6.454  -3.009
  517    HZ2  LYS  64           HZ2      LYS  64  -1.564  -6.273  -2.038
  518    HZ3  LYS  64           HZ3      LYS  64  -1.415  -6.935  -3.584
  519    H    ASP  65           H        ASP  65  -7.088  -5.339  -2.485
  520    HA   ASP  65           HA       ASP  65  -7.629  -8.119  -2.422
  521    HB2  ASP  65           HB2      ASP  65  -7.364  -6.649  -0.408
  522    HB3  ASP  65           HB3      ASP  65  -8.922  -5.930  -0.775
  523    H    PHE  66           H        PHE  66  -9.474  -5.300  -3.300
  524    HA   PHE  66           HA       PHE  66 -11.906  -6.834  -3.740
  525    HB2  PHE  66           HB2      PHE  66 -11.337  -3.889  -4.182
  526    HB3  PHE  66           HB3      PHE  66 -12.920  -4.656  -4.235
  527    HD1  PHE  66           HD1      PHE  66 -14.196  -4.877  -2.265
  528    HD2  PHE  66           HD2      PHE  66 -10.059  -3.921  -2.042
  529    HE1  PHE  66           HE1      PHE  66 -14.426  -4.446   0.134
  530    HE2  PHE  66           HE2      PHE  66 -10.280  -3.489   0.357
  531    HZ   PHE  66           HZ       PHE  66 -12.464  -3.741   1.454
  532    H    GLN  67           H        GLN  67  -9.539  -4.928  -5.529
  533    HA   GLN  67           HA       GLN  67 -10.310  -6.193  -8.025
  534    HB2  GLN  67           HB2      GLN  67 -10.708  -3.263  -7.424
  535    HB3  GLN  67           HB3      GLN  67 -10.520  -3.857  -9.078
  536    HG2  GLN  67           HG2      GLN  67 -12.473  -5.335  -8.715
  537    HG3  GLN  67           HG3      GLN  67 -12.677  -4.619  -7.115
  538   HE21  GLN  67          HE21      GLN  67 -14.717  -3.862  -7.640
  539   HE22  GLN  67          HE22      GLN  67 -14.968  -2.524  -8.700
  540    H    ARG  68           H        ARG  68  -8.178  -6.993  -8.161
  541    HA   ARG  68           HA       ARG  68  -5.898  -5.301  -8.126
  542    HB2  ARG  68           HB2      ARG  68  -6.342  -8.019  -9.353
  543    HB3  ARG  68           HB3      ARG  68  -4.798  -7.185  -9.420
  544    HG2  ARG  68           HG2      ARG  68  -4.846  -7.116  -6.914
  545    HG3  ARG  68           HG3      ARG  68  -6.242  -8.192  -6.990
  546    HD2  ARG  68           HD2      ARG  68  -3.494  -8.747  -8.098
  547    HD3  ARG  68           HD3      ARG  68  -4.195  -9.463  -6.648
  548    HE   ARG  68           HE       ARG  68  -5.948 -10.048  -8.697
  549   HH11  ARG  68          HH11      ARG  68  -2.584 -10.735  -7.969
  550   HH12  ARG  68          HH12      ARG  68  -2.577 -12.232  -8.838
  551   HH21  ARG  68          HH21      ARG  68  -5.919 -12.001  -9.875
  552   HH22  ARG  68          HH22      ARG  68  -4.461 -12.943  -9.946
  553    H    LYS  69           H        LYS  69  -6.727  -3.537  -9.420
  554    HA   LYS  69           HA       LYS  69  -5.926  -3.978 -12.209
  555    HB2  LYS  69           HB2      LYS  69  -7.569  -2.399 -13.026
  556    HB3  LYS  69           HB3      LYS  69  -8.368  -3.693 -12.147
  557    HG2  LYS  69           HG2      LYS  69  -8.729  -2.252 -10.254
  558    HG3  LYS  69           HG3      LYS  69  -7.784  -0.963 -11.011
  559    HD2  LYS  69           HD2      LYS  69  -9.433  -0.961 -12.886
  560    HD3  LYS  69           HD3      LYS  69 -10.406  -2.112 -11.971
  561    HE2  LYS  69           HE2      LYS  69  -9.617   0.626 -10.990
  562    HE3  LYS  69           HE3      LYS  69 -11.156   0.246 -11.756
  563    HZ1  LYS  69           HZ1      LYS  69 -11.629  -1.303  -9.965
  564    HZ2  LYS  69           HZ2      LYS  69 -11.336   0.248  -9.355
  565    HZ3  LYS  69           HZ3      LYS  69 -10.147  -0.938  -9.231
  566    H    GLY  70           H        GLY  70  -6.042  -1.806  -9.446
  567    HA2  GLY  70           HA2      GLY  70  -4.344   0.138 -10.763
  568    HA3  GLY  70           HA3      GLY  70  -4.970   0.238  -9.123
  569    H    THR  71           H        THR  71  -3.360  -2.610 -10.323
  570    HA   THR  71           HA       THR  71  -1.382  -2.586  -8.283
  571    HB   THR  71           HB       THR  71  -0.350  -4.376  -9.945
  572    HG1  THR  71           HG1      THR  71  -1.529  -4.189 -11.753
  573   HG21  THR  71          HG21      THR  71  -2.996  -4.812  -8.537
  574   HG22  THR  71          HG22      THR  71  -1.408  -4.884  -7.777
  575   HG23  THR  71          HG23      THR  71  -1.851  -6.069  -9.005
  576    H    HIS  72           H        HIS  72   0.985  -2.497  -8.688
  577    HA   HIS  72           HA       HIS  72   1.753  -0.522 -10.613
  578    HB2  HIS  72           HB2      HIS  72   3.440  -0.411  -9.090
  579    HB3  HIS  72           HB3      HIS  72   3.095  -2.024  -8.479
  580    HD1  HIS  72           HD1      HIS  72   4.469  -0.970 -11.890
  581    HD2  HIS  72           HD2      HIS  72   5.446  -3.353  -8.640
  582    HE1  HIS  72           HE1      HIS  72   6.398  -2.371 -12.643
  583    HE2  HIS  72           HE2      HIS  72   7.225  -3.446 -10.516
  584    H    ILE  73           H        ILE  73   1.597  -3.963 -10.449
  585    HA   ILE  73           HA       ILE  73   3.437  -5.185 -11.655
  586    HB   ILE  73           HB       ILE  73   0.605  -5.583 -11.822
  587   HG12  ILE  73          HG12      ILE  73   2.436  -6.637 -10.409
  588   HG13  ILE  73          HG13      ILE  73   1.208  -7.726 -11.059
  589   HG21  ILE  73          HG21      ILE  73   0.846  -7.410 -13.609
  590   HG22  ILE  73          HG22      ILE  73   2.228  -6.460 -14.165
  591   HG23  ILE  73          HG23      ILE  73   0.622  -5.740 -14.131
  592   HD11  ILE  73          HD11      ILE  73   2.773  -8.389 -12.819
  593   HD12  ILE  73          HD12      ILE  73   3.445  -8.674 -11.214
  594   HD13  ILE  73          HD13      ILE  73   3.978  -7.284 -12.160
  595    H    VAL  74           H        VAL  74   4.726  -5.248 -13.180
  596    HA   VAL  74           HA       VAL  74   4.938  -3.375 -15.200
  597    HB   VAL  74           HB       VAL  74   6.721  -4.719 -16.102
  598   HG11  VAL  74          HG11      VAL  74   8.036  -5.228 -14.076
  599   HG12  VAL  74          HG12      VAL  74   6.579  -4.984 -13.109
  600   HG13  VAL  74          HG13      VAL  74   7.265  -3.645 -14.032
  601   HG21  VAL  74          HG21      VAL  74   7.107  -7.023 -15.515
  602   HG22  VAL  74          HG22      VAL  74   5.477  -6.861 -16.158
  603   HG23  VAL  74          HG23      VAL  74   5.725  -7.016 -14.418
  604    H    LEU  75           H        LEU  75   4.574  -3.481 -17.395
  605    HA   LEU  75           HA       LEU  75   2.184  -4.418 -18.318
  606    HB2  LEU  75           HB2      LEU  75   3.348  -4.166 -20.612
  607    HB3  LEU  75           HB3      LEU  75   3.193  -2.763 -19.567
  608    HG   LEU  75           HG       LEU  75   5.633  -3.865 -18.823
  609   HD11  LEU  75          HD11      LEU  75   6.872  -4.091 -20.926
  610   HD12  LEU  75          HD12      LEU  75   5.369  -3.928 -21.833
  611   HD13  LEU  75          HD13      LEU  75   5.616  -5.322 -20.781
  612   HD21  LEU  75          HD21      LEU  75   6.577  -1.879 -19.909
  613   HD22  LEU  75          HD22      LEU  75   5.112  -1.498 -19.005
  614   HD23  LEU  75          HD23      LEU  75   5.054  -1.625 -20.760
  615    H    TRP  76           H        TRP  76   1.809  -6.593 -17.738
  616    HA   TRP  76           HA       TRP  76   3.464  -8.620 -19.015
  617    HB2  TRP  76           HB2      TRP  76   1.275  -8.694 -16.975
  618    HB3  TRP  76           HB3      TRP  76   1.640 -10.149 -17.901
  619    HD1  TRP  76           HD1      TRP  76   2.815  -8.134 -14.992
  620    HE1  TRP  76           HE1      TRP  76   4.892  -9.225 -13.952
  621    HE3  TRP  76           HE3      TRP  76   3.859 -11.494 -18.672
  622    HZ2  TRP  76           HZ2      TRP  76   6.744 -11.249 -14.616
  623    HZ3  TRP  76           HZ3      TRP  76   5.803 -12.972 -18.403
  624    HH2  TRP  76           HH2      TRP  76   7.217 -12.848 -16.417
  625    H    THR  77           H        THR  77   3.108  -8.953 -21.089
  626    HA   THR  77           HA       THR  77   0.338  -9.022 -22.060
  627    HB   THR  77           HB       THR  77   1.324  -8.823 -24.322
  628    HG1  THR  77           HG1      THR  77   3.519  -8.615 -24.576
  629   HG21  THR  77          HG21      THR  77   2.141  -6.492 -24.096
  630   HG22  THR  77          HG22      THR  77   2.233  -6.717 -22.349
  631   HG23  THR  77          HG23      THR  77   0.671  -6.782 -23.165
  632    H    GLY  78           H        GLY  78  -0.058 -10.701 -23.785
  633    HA2  GLY  78           HA2      GLY  78   0.210 -13.251 -22.729
  634    HA3  GLY  78           HA3      GLY  78  -0.192 -12.907 -24.402
  635    H    ASP  79           H        ASP  79   2.167 -11.723 -25.261
  636    HA   ASP  79           HA       ASP  79   3.764 -13.984 -25.817
  637    HB2  ASP  79           HB2      ASP  79   4.462 -11.061 -26.133
  638    HB3  ASP  79           HB3      ASP  79   5.351 -12.399 -26.847
  639    H    GLN  80           H        GLN  80   4.144 -11.308 -23.535
  640    HA   GLN  80           HA       GLN  80   6.774 -12.039 -22.741
  641    HB2  GLN  80           HB2      GLN  80   5.907  -9.764 -22.440
  642    HB3  GLN  80           HB3      GLN  80   4.731 -10.365 -21.278
  643    HG2  GLN  80           HG2      GLN  80   6.508 -11.023 -19.771
  644    HG3  GLN  80           HG3      GLN  80   7.720 -10.517 -20.951
  645   HE21  GLN  80          HE21      GLN  80   5.320  -9.459 -18.677
  646   HE22  GLN  80          HE22      GLN  80   5.801  -7.800 -18.630
  647    H    GLU  81           H        GLU  81   3.559 -12.904 -21.627
  648    HA   GLU  81           HA       GLU  81   4.328 -14.262 -19.280
  649    HB2  GLU  81           HB2      GLU  81   2.001 -14.870 -21.120
  650    HB3  GLU  81           HB3      GLU  81   2.180 -15.442 -19.466
  651    HG2  GLU  81           HG2      GLU  81   2.158 -13.076 -18.707
  652    HG3  GLU  81           HG3      GLU  81   1.829 -12.590 -20.367
  653    H    LEU  82           H        LEU  82   4.160 -15.217 -22.658
  654    HA   LEU  82           HA       LEU  82   4.911 -17.926 -22.258
  655    HB2  LEU  82           HB2      LEU  82   3.863 -17.197 -24.333
  656    HB3  LEU  82           HB3      LEU  82   5.223 -16.142 -24.673
  657    HG   LEU  82           HG       LEU  82   6.647 -18.279 -24.641
  658   HD11  LEU  82          HD11      LEU  82   3.933 -19.520 -25.044
  659   HD12  LEU  82          HD12      LEU  82   4.975 -19.742 -23.639
  660   HD13  LEU  82          HD13      LEU  82   5.488 -20.333 -25.221
  661   HD21  LEU  82          HD21      LEU  82   6.156 -18.724 -26.981
  662   HD22  LEU  82          HD22      LEU  82   6.189 -16.996 -26.639
  663   HD23  LEU  82          HD23      LEU  82   4.645 -17.825 -26.839
  664    H    GLU  83           H        GLU  83   6.709 -14.965 -22.997
  665    HA   GLU  83           HA       GLU  83   9.264 -16.040 -23.238
  666    HB2  GLU  83           HB2      GLU  83   8.378 -13.370 -22.140
  667    HB3  GLU  83           HB3      GLU  83  10.056 -13.781 -22.468
  668    HG2  GLU  83           HG2      GLU  83   7.829 -13.690 -24.492
  669    HG3  GLU  83           HG3      GLU  83   9.094 -12.479 -24.278
  670    H    LEU  84           H        LEU  84   7.518 -14.950 -20.361
  671    HA   LEU  84           HA       LEU  84   9.468 -15.492 -18.440
  672    HB2  LEU  84           HB2      LEU  84   7.442 -14.310 -17.864
  673    HB3  LEU  84           HB3      LEU  84   6.461 -15.702 -18.278
  674    HG   LEU  84           HG       LEU  84   7.523 -16.951 -16.398
  675   HD11  LEU  84          HD11      LEU  84   8.763 -15.716 -14.712
  676   HD12  LEU  84          HD12      LEU  84   8.684 -14.259 -15.702
  677   HD13  LEU  84          HD13      LEU  84   9.592 -15.659 -16.268
  678   HD21  LEU  84          HD21      LEU  84   5.352 -15.907 -16.116
  679   HD22  LEU  84          HD22      LEU  84   6.117 -14.379 -15.686
  680   HD23  LEU  84          HD23      LEU  84   6.290 -15.778 -14.628
  681    H    GLN  85           H        GLN  85   6.855 -17.558 -19.650
  682    HA   GLN  85           HA       GLN  85   7.441 -19.822 -18.134
  683    HB2  GLN  85           HB2      GLN  85   5.335 -19.447 -19.378
  684    HB3  GLN  85           HB3      GLN  85   6.193 -19.700 -20.887
  685    HG2  GLN  85           HG2      GLN  85   6.628 -21.919 -19.112
  686    HG3  GLN  85           HG3      GLN  85   4.907 -21.611 -19.304
  687   HE21  GLN  85          HE21      GLN  85   7.308 -20.930 -21.758
  688   HE22  GLN  85          HE22      GLN  85   6.779 -22.140 -22.871
  689    H    ARG  86           H        ARG  86   8.512 -18.979 -21.441
  690    HA   ARG  86           HA       ARG  86   9.878 -21.400 -21.887
  691    HB2  ARG  86           HB2      ARG  86  10.228 -18.683 -23.150
  692    HB3  ARG  86           HB3      ARG  86  11.124 -20.104 -23.674
  693    HG2  ARG  86           HG2      ARG  86   8.787 -21.193 -23.915
  694    HG3  ARG  86           HG3      ARG  86   8.195 -19.534 -23.884
  695    HD2  ARG  86           HD2      ARG  86  10.321 -20.494 -25.792
  696    HD3  ARG  86           HD3      ARG  86   8.602 -20.516 -26.169
  697    HE   ARG  86           HE       ARG  86   9.489 -17.929 -25.330
  698   HH11  ARG  86          HH11      ARG  86   9.355 -20.126 -28.061
  699   HH12  ARG  86          HH12      ARG  86   9.426 -18.857 -29.240
  700   HH21  ARG  86          HH21      ARG  86   9.552 -16.257 -26.879
  701   HH22  ARG  86          HH22      ARG  86   9.538 -16.667 -28.577
  702    H    LEU  87           H        LEU  87  11.177 -18.233 -20.847
  703    HA   LEU  87           HA       LEU  87  13.836 -19.106 -20.548
  704    HB2  LEU  87           HB2      LEU  87  12.263 -16.809 -19.508
  705    HB3  LEU  87           HB3      LEU  87  13.798 -17.163 -18.742
  706    HG   LEU  87           HG       LEU  87  14.848 -17.019 -21.039
  707   HD11  LEU  87          HD11      LEU  87  13.636 -15.732 -22.726
  708   HD12  LEU  87          HD12      LEU  87  12.185 -15.791 -21.723
  709   HD13  LEU  87          HD13      LEU  87  12.856 -17.279 -22.393
  710   HD21  LEU  87          HD21      LEU  87  15.112 -15.280 -19.413
  711   HD22  LEU  87          HD22      LEU  87  13.538 -14.601 -19.820
  712   HD23  LEU  87          HD23      LEU  87  14.851 -14.551 -20.996
  713    H    PHE  88           H        PHE  88  11.159 -19.005 -18.263
  714    HA   PHE  88           HA       PHE  88  12.392 -19.718 -15.927
  715    HB2  PHE  88           HB2      PHE  88  10.139 -19.105 -15.806
  716    HB3  PHE  88           HB3      PHE  88   9.665 -20.237 -17.064
  717    HD1  PHE  88           HD1      PHE  88   8.632 -22.173 -16.482
  718    HD2  PHE  88           HD2      PHE  88  11.069 -20.196 -13.613
  719    HE1  PHE  88           HE1      PHE  88   7.934 -23.797 -14.779
  720    HE2  PHE  88           HE2      PHE  88  10.378 -21.819 -11.904
  721    HZ   PHE  88           HZ       PHE  88   8.808 -23.616 -12.486
  722    H    GLU  89           H        GLU  89  11.262 -21.857 -18.511
  723    HA   GLU  89           HA       GLU  89  12.111 -24.227 -17.116
  724    HB2  GLU  89           HB2      GLU  89  11.376 -23.895 -20.015
  725    HB3  GLU  89           HB3      GLU  89  11.409 -25.399 -19.106
  726    HG2  GLU  89           HG2      GLU  89   9.561 -24.665 -17.752
  727    HG3  GLU  89           HG3      GLU  89   9.578 -23.088 -18.542
  728    H    GLU  90           H        GLU  90  13.366 -22.111 -19.627
  729    HA   GLU  90           HA       GLU  90  15.374 -23.863 -20.584
  730    HB2  GLU  90           HB2      GLU  90  14.896 -20.911 -20.761
  731    HB3  GLU  90           HB3      GLU  90  16.363 -21.625 -21.430
  732    HG2  GLU  90           HG2      GLU  90  14.956 -23.089 -22.833
  733    HG3  GLU  90           HG3      GLU  90  13.526 -22.276 -22.200
  734    H    PHE  91           H        PHE  91  15.376 -21.315 -18.133
  735    HA   PHE  91           HA       PHE  91  18.174 -21.943 -17.519
  736    HB2  PHE  91           HB2      PHE  91  16.393 -19.677 -16.612
  737    HB3  PHE  91           HB3      PHE  91  18.043 -19.920 -16.051
  738    HD1  PHE  91           HD1      PHE  91  19.899 -19.930 -17.801
  739    HD2  PHE  91           HD2      PHE  91  15.968 -18.477 -18.565
  740    HE1  PHE  91           HE1      PHE  91  20.751 -18.630 -19.707
  741    HE2  PHE  91           HE2      PHE  91  16.817 -17.180 -20.477
  742    HZ   PHE  91           HZ       PHE  91  19.211 -17.253 -21.046
  743    H    ARG  92           H        ARG  92  15.572 -23.469 -16.773
  744    HA   ARG  92           HA       ARG  92  15.353 -23.232 -13.957
  745    HB2  ARG  92           HB2      ARG  92  13.497 -24.077 -15.286
  746    HB3  ARG  92           HB3      ARG  92  14.452 -25.482 -15.739
  747    HG2  ARG  92           HG2      ARG  92  14.416 -26.343 -13.554
  748    HG3  ARG  92           HG3      ARG  92  13.835 -24.826 -12.880
  749    HD2  ARG  92           HD2      ARG  92  11.713 -25.118 -14.042
  750    HD3  ARG  92           HD3      ARG  92  12.285 -26.638 -14.727
  751    HE   ARG  92           HE       ARG  92  12.595 -27.134 -12.137
  752   HH11  ARG  92          HH11      ARG  92   9.915 -25.707 -13.856
  753   HH12  ARG  92          HH12      ARG  92   8.730 -26.208 -12.693
  754   HH21  ARG  92          HH21      ARG  92  11.024 -27.792 -10.581
  755   HH22  ARG  92          HH22      ARG  92   9.359 -27.373 -10.824
  756    H    ASP  93           H        ASP  93  17.422 -25.051 -16.023
  757    HA   ASP  93           HA       ASP  93  18.192 -26.869 -13.902
  758    HB2  ASP  93           HB2      ASP  93  17.985 -27.603 -16.285
  759    HB3  ASP  93           HB3      ASP  93  19.389 -26.610 -16.667
  760    H    SER  94           H        SER  94  18.779 -23.797 -14.097
  761    HA   SER  94           HA       SER  94  21.660 -24.021 -13.559
  762    HB2  SER  94           HB2      SER  94  21.839 -21.644 -13.917
  763    HB3  SER  94           HB3      SER  94  20.924 -22.316 -15.262
  764    HG   SER  94           HG       SER  94  19.008 -21.621 -14.188
  765    H    ASP  95           H        ASP  95  22.165 -22.022 -11.863
  766    HA   ASP  95           HA       ASP  95  21.322 -23.132  -9.400
  767    HB2  ASP  95           HB2      ASP  95  23.518 -22.109  -9.669
  768    HB3  ASP  95           HB3      ASP  95  22.773 -20.546  -9.984
  769    H    ASP  96           H        ASP  96  20.425 -20.210 -11.149
  770    HA   ASP  96           HA       ASP  96  18.108 -19.883  -9.391
  771    HB2  ASP  96           HB2      ASP  96  19.936 -18.389  -8.563
  772    HB3  ASP  96           HB3      ASP  96  19.969 -17.609 -10.139
  773    H    VAL  97           H        VAL  97  16.379 -19.876 -10.694
  774    HA   VAL  97           HA       VAL  97  16.621 -19.539 -13.512
  775    HB   VAL  97           HB       VAL  97  14.080 -19.543 -11.874
  776   HG11  VAL  97          HG11      VAL  97  13.755 -18.680 -14.113
  777   HG12  VAL  97          HG12      VAL  97  13.033 -20.283 -13.971
  778   HG13  VAL  97          HG13      VAL  97  14.577 -20.082 -14.798
  779   HG21  VAL  97          HG21      VAL  97  14.939 -21.604 -11.350
  780   HG22  VAL  97          HG22      VAL  97  15.822 -21.736 -12.864
  781   HG23  VAL  97          HG23      VAL  97  14.073 -21.978 -12.845
  782    H    LEU  98           H        LEU  98  15.061 -17.598 -10.983
  783    HA   LEU  98           HA       LEU  98  13.970 -15.665 -12.676
  784    HB2  LEU  98           HB2      LEU  98  14.591 -15.766  -9.773
  785    HB3  LEU  98           HB3      LEU  98  14.151 -14.230 -10.488
  786    HG   LEU  98           HG       LEU  98  12.078 -15.428 -11.363
  787   HD11  LEU  98          HD11      LEU  98  11.332 -17.334 -10.031
  788   HD12  LEU  98          HD12      LEU  98  12.909 -17.391  -9.245
  789   HD13  LEU  98          HD13      LEU  98  12.775 -17.710 -10.975
  790   HD21  LEU  98          HD21      LEU  98  10.903 -15.044  -9.269
  791   HD22  LEU  98          HD22      LEU  98  12.075 -13.763  -9.591
  792   HD23  LEU  98          HD23      LEU  98  12.442 -15.020  -8.408
  793    H    GLY  99           H        GLY  99  17.075 -15.751 -10.998
  794    HA2  GLY  99           HA2      GLY  99  17.932 -13.148 -11.541
  795    HA3  GLY  99           HA3      GLY  99  18.995 -14.544 -11.364
  796    H    HIS 100           H        HIS 100  17.991 -16.028 -13.566
  797    HA   HIS 100           HA       HIS 100  19.487 -14.678 -15.640
  798    HB2  HIS 100           HB2      HIS 100  18.260 -17.419 -15.427
  799    HB3  HIS 100           HB3      HIS 100  18.919 -16.820 -16.945
  800    HD1  HIS 100           HD1      HIS 100  21.470 -16.708 -17.172
  801    HD2  HIS 100           HD2      HIS 100  20.173 -17.963 -13.421
  802    HE1  HIS 100           HE1      HIS 100  23.517 -17.586 -16.004
  803    HE2  HIS 100           HE2      HIS 100  22.733 -18.219 -13.695
  804    H    ILE 101           H        ILE 101  16.186 -15.352 -14.840
  805    HA   ILE 101           HA       ILE 101  14.974 -14.866 -17.313
  806    HB   ILE 101           HB       ILE 101  13.940 -14.359 -14.514
  807   HG12  ILE 101          HG12      ILE 101  13.412 -16.551 -16.538
  808   HG13  ILE 101          HG13      ILE 101  14.342 -16.710 -15.051
  809   HG21  ILE 101          HG21      ILE 101  12.772 -12.888 -16.060
  810   HG22  ILE 101          HG22      ILE 101  11.705 -14.187 -15.529
  811   HG23  ILE 101          HG23      ILE 101  12.436 -14.248 -17.132
  812   HD11  ILE 101          HD11      ILE 101  12.342 -16.297 -13.738
  813   HD12  ILE 101          HD12      ILE 101  12.103 -17.654 -14.837
  814   HD13  ILE 101          HD13      ILE 101  11.404 -16.080 -15.213
  815    H    MET 102           H        MET 102  15.398 -12.586 -14.593
  816    HA   MET 102           HA       MET 102  14.444 -10.382 -16.078
  817    HB2  MET 102           HB2      MET 102  15.587  -9.024 -14.206
  818    HB3  MET 102           HB3      MET 102  14.230 -10.063 -13.801
  819    HG2  MET 102           HG2      MET 102  15.513 -11.517 -12.617
  820    HG3  MET 102           HG3      MET 102  16.950 -11.196 -13.567
  821    HE1  MET 102           HE1      MET 102  15.345  -8.280 -10.378
  822    HE2  MET 102           HE2      MET 102  14.541  -9.790 -10.811
  823    HE3  MET 102           HE3      MET 102  14.630  -8.468 -11.979
  824    H    LYS 103           H        LYS 103  17.636 -11.762 -15.777
  825    HA   LYS 103           HA       LYS 103  19.030  -9.472 -16.761
  826    HB2  LYS 103           HB2      LYS 103  19.801 -12.385 -16.628
  827    HB3  LYS 103           HB3      LYS 103  20.877 -11.135 -17.230
  828    HG2  LYS 103           HG2      LYS 103  19.680 -11.103 -14.473
  829    HG3  LYS 103           HG3      LYS 103  21.238 -11.832 -14.855
  830    HD2  LYS 103           HD2      LYS 103  22.007  -9.634 -15.709
  831    HD3  LYS 103           HD3      LYS 103  20.468  -8.934 -15.197
  832    HE2  LYS 103           HE2      LYS 103  20.930  -9.545 -12.891
  833    HE3  LYS 103           HE3      LYS 103  22.434 -10.324 -13.377
  834    HZ1  LYS 103           HZ1      LYS 103  21.816  -7.429 -13.590
  835    HZ2  LYS 103           HZ2      LYS 103  23.244  -8.158 -14.127
  836    HZ3  LYS 103           HZ3      LYS 103  22.866  -8.151 -12.478
  837    H    ASN 104           H        ASN 104  17.588 -12.320 -18.301
  838    HA   ASN 104           HA       ASN 104  18.817 -11.561 -20.841
  839    HB2  ASN 104           HB2      ASN 104  19.004 -13.897 -20.100
  840    HB3  ASN 104           HB3      ASN 104  17.251 -14.043 -20.111
  841   HD21  ASN 104          HD21      ASN 104  16.213 -14.418 -22.012
  842   HD22  ASN 104          HD22      ASN 104  17.013 -14.646 -23.522
  843    H    ILE 105           H        ILE 105  15.816 -11.143 -19.273
  844    HA   ILE 105           HA       ILE 105  14.347 -11.150 -21.790
  845    HB   ILE 105           HB       ILE 105  13.250 -12.087 -19.795
  846   HG12  ILE 105          HG12      ILE 105  11.077 -10.888 -20.079
  847   HG13  ILE 105          HG13      ILE 105  11.928  -9.670 -21.015
  848   HG21  ILE 105          HG21      ILE 105  13.224  -9.249 -18.788
  849   HG22  ILE 105          HG22      ILE 105  14.130 -10.591 -18.094
  850   HG23  ILE 105          HG23      ILE 105  12.368 -10.604 -18.050
  851   HD11  ILE 105          HD11      ILE 105  11.755 -12.585 -21.735
  852   HD12  ILE 105          HD12      ILE 105  12.501 -11.307 -22.694
  853   HD13  ILE 105          HD13      ILE 105  10.759 -11.302 -22.419
  854    H    THR 106           H        THR 106  13.268  -9.417 -22.625
  855    HA   THR 106           HA       THR 106  14.810  -7.073 -22.722
  856    HB   THR 106           HB       THR 106  13.466  -8.169 -24.553
  857    HG1  THR 106           HG1      THR 106  13.294  -5.366 -24.061
  858   HG21  THR 106          HG21      THR 106  11.343  -8.428 -23.404
  859   HG22  THR 106          HG22      THR 106  11.139  -7.418 -24.836
  860   HG23  THR 106          HG23      THR 106  11.198  -6.677 -23.237
  861    H    ALA 107           H        ALA 107  12.071  -7.946 -20.801
  862    HA   ALA 107           HA       ALA 107  11.647  -5.147 -20.010
  863    HB1  ALA 107           HB1      ALA 107   9.623  -6.381 -20.584
  864    HB2  ALA 107           HB2      ALA 107   9.630  -5.974 -18.867
  865    HB3  ALA 107           HB3      ALA 107  10.017  -7.614 -19.385
  866    H    LYS 108           H        LYS 108  12.501  -4.429 -18.158
  867    HA   LYS 108           HA       LYS 108  13.982  -6.223 -16.484
  868    HB2  LYS 108           HB2      LYS 108  13.292  -3.310 -16.054
  869    HB3  LYS 108           HB3      LYS 108  14.440  -4.236 -15.101
  870    HG2  LYS 108           HG2      LYS 108  14.689  -3.570 -18.028
  871    HG3  LYS 108           HG3      LYS 108  15.583  -2.819 -16.708
  872    HD2  LYS 108           HD2      LYS 108  17.152  -4.342 -17.359
  873    HD3  LYS 108           HD3      LYS 108  16.243  -5.368 -16.249
  874    HE2  LYS 108           HE2      LYS 108  14.954  -6.254 -18.146
  875    HE3  LYS 108           HE3      LYS 108  15.873  -5.228 -19.245
  876    HZ1  LYS 108           HZ1      LYS 108  16.745  -7.452 -19.261
  877    HZ2  LYS 108           HZ2      LYS 108  16.952  -7.442 -17.580
  878    HZ3  LYS 108           HZ3      LYS 108  17.885  -6.422 -18.554
  879    H    ARG 109           H        ARG 109  12.876  -7.634 -15.369
  880    HA   ARG 109           HA       ARG 109  10.506  -6.699 -13.908
  881    HB2  ARG 109           HB2      ARG 109  11.076  -9.401 -15.128
  882    HB3  ARG 109           HB3      ARG 109   9.715  -9.069 -14.061
  883    HG2  ARG 109           HG2      ARG 109   8.959  -7.334 -15.664
  884    HG3  ARG 109           HG3      ARG 109  10.248  -7.843 -16.754
  885    HD2  ARG 109           HD2      ARG 109   8.286  -9.829 -15.683
  886    HD3  ARG 109           HD3      ARG 109   7.871  -8.815 -17.060
  887    HE   ARG 109           HE       ARG 109   9.625  -9.851 -18.298
  888   HH11  ARG 109          HH11      ARG 109   9.082 -11.314 -15.168
  889   HH12  ARG 109          HH12      ARG 109   9.747 -12.846 -15.620
  890   HH21  ARG 109          HH21      ARG 109  10.481 -11.893 -18.910
  891   HH22  ARG 109          HH22      ARG 109  10.545 -13.173 -17.749
  892    H    SER 110           H        SER 110  10.656  -6.727 -11.834
  893    HA   SER 110           HA       SER 110  13.011  -7.635 -10.522
  894    HB2  SER 110           HB2      SER 110  11.970  -5.661  -9.677
  895    HB3  SER 110           HB3      SER 110  10.415  -6.473  -9.504
  896    HG   SER 110           HG       SER 110  12.679  -6.562  -7.879
  897    H    ARG 111           H        ARG 111  13.078  -9.020  -8.682
  898    HA   ARG 111           HA       ARG 111  12.400 -11.620  -9.367
  899    HB2  ARG 111           HB2      ARG 111  13.056 -10.571  -6.610
  900    HB3  ARG 111           HB3      ARG 111  13.217 -12.234  -7.153
  901    HG2  ARG 111           HG2      ARG 111  14.764  -9.909  -8.273
  902    HG3  ARG 111           HG3      ARG 111  15.359 -11.016  -7.042
  903    HD2  ARG 111           HD2      ARG 111  14.527 -11.756  -9.840
  904    HD3  ARG 111           HD3      ARG 111  16.182 -11.626  -9.254
  905    HE   ARG 111           HE       ARG 111  14.232 -13.674  -8.471
  906   HH11  ARG 111          HH11      ARG 111  17.534 -12.510  -8.594
  907   HH12  ARG 111          HH12      ARG 111  18.214 -14.019  -8.077
  908   HH21  ARG 111          HH21      ARG 111  15.133 -15.655  -7.770
  909   HH22  ARG 111          HH22      ARG 111  16.863 -15.823  -7.654
  910    H    ALA 112           H        ALA 112  10.896  -9.459  -7.000
  911    HA   ALA 112           HA       ALA 112   9.182 -11.354  -5.843
  912    HB1  ALA 112           HB1      ALA 112   8.761  -8.373  -6.023
  913    HB2  ALA 112           HB2      ALA 112   9.758  -9.190  -4.820
  914    HB3  ALA 112           HB3      ALA 112   8.020  -9.478  -4.865
  915    H    ARG 113           H        ARG 113   8.766  -9.300  -8.685
  916    HA   ARG 113           HA       ARG 113   5.947  -9.946  -8.854
  917    HB2  ARG 113           HB2      ARG 113   6.889  -8.844 -11.310
  918    HB3  ARG 113           HB3      ARG 113   5.812  -8.127 -10.123
  919    HG2  ARG 113           HG2      ARG 113   7.759  -7.270  -8.897
  920    HG3  ARG 113           HG3      ARG 113   8.817  -7.958 -10.135
  921    HD2  ARG 113           HD2      ARG 113   7.658  -6.595 -11.835
  922    HD3  ARG 113           HD3      ARG 113   6.694  -5.855 -10.549
  923    HE   ARG 113           HE       ARG 113   9.340  -5.156 -11.321
  924   HH11  ARG 113          HH11      ARG 113   7.269  -5.369  -8.489
  925   HH12  ARG 113          HH12      ARG 113   8.136  -4.143  -7.620
  926   HH21  ARG 113          HH21      ARG 113  10.455  -3.536 -10.175
  927   HH22  ARG 113          HH22      ARG 113   9.934  -3.105  -8.573
  928    H    ILE 114           H        ILE 114   8.939 -11.124 -10.138
  929    HA   ILE 114           HA       ILE 114   7.802 -12.655 -12.254
  930    HB   ILE 114           HB       ILE 114  10.410 -13.028 -10.763
  931   HG12  ILE 114          HG12      ILE 114   9.787 -11.754 -13.435
  932   HG13  ILE 114          HG13      ILE 114  10.282 -10.907 -11.973
  933   HG21  ILE 114          HG21      ILE 114   9.780 -15.117 -11.751
  934   HG22  ILE 114          HG22      ILE 114  11.071 -14.399 -12.720
  935   HG23  ILE 114          HG23      ILE 114   9.401 -14.332 -13.283
  936   HD11  ILE 114          HD11      ILE 114  11.966 -12.906 -13.471
  937   HD12  ILE 114          HD12      ILE 114  12.456 -11.977 -12.054
  938   HD13  ILE 114          HD13      ILE 114  12.119 -11.152 -13.576
  939    H    VAL 115           H        VAL 115   8.761 -13.320  -8.927
  940    HA   VAL 115           HA       VAL 115   8.145 -16.019  -8.745
  941    HB   VAL 115           HB       VAL 115   8.038 -13.799  -6.719
  942   HG11  VAL 115          HG11      VAL 115   6.427 -15.498  -6.018
  943   HG12  VAL 115          HG12      VAL 115   7.836 -15.472  -4.960
  944   HG13  VAL 115          HG13      VAL 115   7.667 -16.743  -6.174
  945   HG21  VAL 115          HG21      VAL 115  10.017 -15.061  -5.817
  946   HG22  VAL 115          HG22      VAL 115  10.249 -14.301  -7.389
  947   HG23  VAL 115          HG23      VAL 115   9.964 -16.039  -7.285
  948    H    ASP 116           H        ASP 116   6.062 -13.239  -7.993
  949    HA   ASP 116           HA       ASP 116   3.799 -14.696  -7.208
  950    HB2  ASP 116           HB2      ASP 116   4.307 -12.175  -6.958
  951    HB3  ASP 116           HB3      ASP 116   3.660 -12.025  -8.584
  952    H    LYS 117           H        LYS 117   4.886 -13.584 -10.367
  953    HA   LYS 117           HA       LYS 117   2.429 -14.175 -11.688
  954    HB2  LYS 117           HB2      LYS 117   4.583 -12.637 -12.289
  955    HB3  LYS 117           HB3      LYS 117   4.897 -14.038 -13.300
  956    HG2  LYS 117           HG2      LYS 117   2.183 -12.814 -13.367
  957    HG3  LYS 117           HG3      LYS 117   3.510 -11.993 -14.188
  958    HD2  LYS 117           HD2      LYS 117   3.976 -14.011 -15.469
  959    HD3  LYS 117           HD3      LYS 117   2.666 -14.846 -14.639
  960    HE2  LYS 117           HE2      LYS 117   2.301 -12.367 -16.302
  961    HE3  LYS 117           HE3      LYS 117   2.101 -14.003 -16.923
  962    HZ1  LYS 117           HZ1      LYS 117  -0.027 -13.228 -16.371
  963    HZ2  LYS 117           HZ2      LYS 117   0.466 -12.627 -14.870
  964    HZ3  LYS 117           HZ3      LYS 117   0.384 -14.296 -15.125
  965    H    LEU 118           H        LEU 118   5.438 -15.954 -11.128
  966    HA   LEU 118           HA       LEU 118   4.921 -18.173 -12.786
  967    HB2  LEU 118           HB2      LEU 118   6.278 -18.060 -10.101
  968    HB3  LEU 118           HB3      LEU 118   6.208 -19.497 -11.088
  969    HG   LEU 118           HG       LEU 118   7.794 -16.998 -11.519
  970   HD11  LEU 118          HD11      LEU 118   8.378 -19.957 -11.498
  971   HD12  LEU 118          HD12      LEU 118   8.778 -18.789 -10.234
  972   HD13  LEU 118          HD13      LEU 118   9.573 -18.691 -11.807
  973   HD21  LEU 118          HD21      LEU 118   6.611 -17.486 -13.641
  974   HD22  LEU 118          HD22      LEU 118   7.283 -19.116 -13.604
  975   HD23  LEU 118          HD23      LEU 118   8.354 -17.723 -13.750
  976    H    LEU 119           H        LEU 119   4.186 -17.621  -9.380
  977    HA   LEU 119           HA       LEU 119   2.847 -20.001  -8.835
  978    HB2  LEU 119           HB2      LEU 119   2.842 -17.254  -7.661
  979    HB3  LEU 119           HB3      LEU 119   1.617 -18.391  -7.129
  980    HG   LEU 119           HG       LEU 119   3.534 -18.339  -5.595
  981   HD11  LEU 119          HD11      LEU 119   3.294 -20.948  -7.087
  982   HD12  LEU 119          HD12      LEU 119   2.209 -20.380  -5.819
  983   HD13  LEU 119          HD13      LEU 119   3.893 -20.738  -5.443
  984   HD21  LEU 119          HD21      LEU 119   5.333 -17.814  -7.144
  985   HD22  LEU 119          HD22      LEU 119   5.135 -19.379  -7.936
  986   HD23  LEU 119          HD23      LEU 119   5.696 -19.300  -6.264
  987    H    ALA 120           H        ALA 120   1.766 -17.032 -10.274
  988    HA   ALA 120           HA       ALA 120  -1.018 -17.541 -10.105
  989    HB1  ALA 120           HB1      ALA 120   0.415 -15.738 -12.037
  990    HB2  ALA 120           HB2      ALA 120   0.045 -15.308 -10.368
  991    HB3  ALA 120           HB3      ALA 120  -1.266 -15.625 -11.513
  992    H    LEU 121           H        LEU 121   1.395 -17.991 -12.679
  993    HA   LEU 121           HA       LEU 121  -0.383 -19.134 -14.570
  994    HB2  LEU 121           HB2      LEU 121   2.567 -19.022 -14.188
  995    HB3  LEU 121           HB3      LEU 121   1.928 -20.213 -15.301
  996    HG   LEU 121           HG       LEU 121   0.996 -18.515 -16.698
  997   HD11  LEU 121          HD11      LEU 121   0.196 -16.926 -15.111
  998   HD12  LEU 121          HD12      LEU 121   1.341 -16.108 -16.177
  999   HD13  LEU 121          HD13      LEU 121   1.834 -16.590 -14.553
 1000   HD21  LEU 121          HD21      LEU 121   3.036 -17.345 -17.371
 1001   HD22  LEU 121          HD22      LEU 121   3.360 -19.038 -16.989
 1002   HD23  LEU 121          HD23      LEU 121   3.784 -17.779 -15.830
 1003    H    GLY 122           H        GLY 122   1.152 -20.332 -11.747
 1004    HA2  GLY 122           HA2      GLY 122   1.062 -22.414 -10.755
 1005    HA3  GLY 122           HA3      GLY 122   0.102 -22.989 -12.116
 1006    H    LEU 123           H        LEU 123   3.178 -21.348 -12.496
 1007    HA   LEU 123           HA       LEU 123   4.243 -23.553 -13.996
 1008    HB2  LEU 123           HB2      LEU 123   5.421 -20.929 -13.099
 1009    HB3  LEU 123           HB3      LEU 123   6.340 -22.120 -14.004
 1010    HG   LEU 123           HG       LEU 123   3.909 -20.599 -14.944
 1011   HD11  LEU 123          HD11      LEU 123   5.495 -19.821 -16.693
 1012   HD12  LEU 123          HD12      LEU 123   6.796 -20.607 -15.799
 1013   HD13  LEU 123          HD13      LEU 123   5.897 -19.280 -15.064
 1014   HD21  LEU 123          HD21      LEU 123   5.418 -22.821 -16.307
 1015   HD22  LEU 123          HD22      LEU 123   4.231 -21.776 -17.087
 1016   HD23  LEU 123          HD23      LEU 123   3.734 -22.851 -15.783
 1017    H    VAL 124           H        VAL 124   4.312 -22.403 -10.802
 1018    HA   VAL 124           HA       VAL 124   5.849 -24.740  -9.965
 1019    HB   VAL 124           HB       VAL 124   7.014 -23.365  -8.235
 1020   HG11  VAL 124          HG11      VAL 124   8.711 -22.436  -9.743
 1021   HG12  VAL 124          HG12      VAL 124   7.601 -22.632 -11.099
 1022   HG13  VAL 124          HG13      VAL 124   8.202 -24.048 -10.240
 1023   HG21  VAL 124          HG21      VAL 124   5.610 -21.450  -8.129
 1024   HG22  VAL 124          HG22      VAL 124   5.834 -21.114  -9.844
 1025   HG23  VAL 124          HG23      VAL 124   7.179 -20.911  -8.725
 1026    H    ALA 125           H        ALA 125   5.694 -24.908  -7.514
 1027    HA   ALA 125           HA       ALA 125   2.988 -24.116  -6.655
 1028    HB1  ALA 125           HB1      ALA 125   2.898 -26.147  -5.321
 1029    HB2  ALA 125           HB2      ALA 125   4.523 -26.585  -5.842
 1030    HB3  ALA 125           HB3      ALA 125   3.203 -26.538  -7.013
 1031    H    GLU 126           H        GLU 126   6.188 -23.572  -6.219
 1032    HA   GLU 126           HA       GLU 126   5.902 -22.290  -3.677
 1033    HB2  GLU 126           HB2      GLU 126   7.662 -23.657  -2.557
 1034    HB3  GLU 126           HB3      GLU 126   6.194 -24.569  -2.876
 1035    HG2  GLU 126           HG2      GLU 126   7.387 -25.284  -5.046
 1036    HG3  GLU 126           HG3      GLU 126   8.846 -24.737  -4.227
 1037    H    ARG 127           H        ARG 127   7.989 -21.235  -3.060
 1038    HA   ARG 127           HA       ARG 127   9.229 -20.175  -5.425
 1039    HB2  ARG 127           HB2      ARG 127   9.868 -19.597  -2.533
 1040    HB3  ARG 127           HB3      ARG 127  10.409 -18.665  -3.924
 1041    HG2  ARG 127           HG2      ARG 127   7.939 -18.323  -4.438
 1042    HG3  ARG 127           HG3      ARG 127   7.649 -18.920  -2.804
 1043    HD2  ARG 127           HD2      ARG 127   9.276 -17.151  -2.022
 1044    HD3  ARG 127           HD3      ARG 127   9.180 -16.493  -3.657
 1045    HE   ARG 127           HE       ARG 127   6.581 -16.821  -2.619
 1046   HH11  ARG 127          HH11      ARG 127   9.406 -14.794  -2.211
 1047   HH12  ARG 127          HH12      ARG 127   8.501 -13.424  -1.663
 1048   HH21  ARG 127          HH21      ARG 127   5.387 -15.019  -1.906
 1049   HH22  ARG 127          HH22      ARG 127   6.207 -13.543  -1.498
 1050    H    ARG 128           H        ARG 128   9.922 -22.623  -3.168
 1051    HA   ARG 128           HA       ARG 128  12.698 -22.810  -3.338
 1052    HB2  ARG 128           HB2      ARG 128  11.710 -24.196  -1.747
 1053    HB3  ARG 128           HB3      ARG 128  10.503 -24.800  -2.874
 1054    HG2  ARG 128           HG2      ARG 128  12.159 -26.130  -4.005
 1055    HG3  ARG 128           HG3      ARG 128  13.438 -25.448  -2.997
 1056    HD2  ARG 128           HD2      ARG 128  12.717 -27.692  -2.287
 1057    HD3  ARG 128           HD3      ARG 128  12.513 -26.468  -1.039
 1058    HE   ARG 128           HE       ARG 128  10.154 -26.978  -2.630
 1059   HH11  ARG 128          HH11      ARG 128  12.011 -27.908   0.203
 1060   HH12  ARG 128          HH12      ARG 128  10.635 -28.603   1.024
 1061   HH21  ARG 128          HH21      ARG 128   8.353 -27.841  -1.548
 1062   HH22  ARG 128          HH22      ARG 128   8.553 -28.573   0.021
 1063    H    GLU 129           H        GLU 129  10.197 -23.802  -5.569
 1064    HA   GLU 129           HA       GLU 129  11.857 -25.505  -7.143
 1065    HB2  GLU 129           HB2      GLU 129   9.114 -24.341  -7.551
 1066    HB3  GLU 129           HB3      GLU 129   9.879 -25.423  -8.707
 1067    HG2  GLU 129           HG2      GLU 129   9.569 -26.157  -5.823
 1068    HG3  GLU 129           HG3      GLU 129   8.280 -26.435  -7.004
 1069    H    LEU 130           H        LEU 130  11.704 -22.180  -6.935
 1070    HA   LEU 130           HA       LEU 130  12.207 -21.690  -9.759
 1071    HB2  LEU 130           HB2      LEU 130  12.770 -19.507  -7.894
 1072    HB3  LEU 130           HB3      LEU 130  11.784 -19.520  -9.336
 1073    HG   LEU 130           HG       LEU 130  10.924 -20.422  -6.588
 1074   HD11  LEU 130          HD11      LEU 130  11.155 -18.029  -6.751
 1075   HD12  LEU 130          HD12      LEU 130   9.453 -18.485  -6.663
 1076   HD13  LEU 130          HD13      LEU 130  10.160 -18.012  -8.206
 1077   HD21  LEU 130          HD21      LEU 130   9.387 -20.354  -9.179
 1078   HD22  LEU 130          HD22      LEU 130   8.642 -20.460  -7.582
 1079   HD23  LEU 130          HD23      LEU 130   9.709 -21.749  -8.142
 1080    H    TYR 131           H        TYR 131  13.874 -22.988  -7.383
 1081    HA   TYR 131           HA       TYR 131  16.480 -22.084  -8.388
 1082    HB2  TYR 131           HB2      TYR 131  15.842 -22.671  -5.478
 1083    HB3  TYR 131           HB3      TYR 131  17.401 -22.175  -6.124
 1084    HD1  TYR 131           HD1      TYR 131  13.919 -21.023  -5.528
 1085    HD2  TYR 131           HD2      TYR 131  17.930 -19.889  -6.372
 1086    HE1  TYR 131           HE1      TYR 131  13.335 -18.676  -5.085
 1087    HE2  TYR 131           HE2      TYR 131  17.356 -17.540  -5.945
 1088    HH   TYR 131           HH       TYR 131  15.569 -16.079  -5.777
 1089    H    LYS 132           H        LYS 132  17.737 -23.843  -8.966
 1090    HA   LYS 132           HA       LYS 132  16.546 -26.404  -8.919
 1091    HB2  LYS 132           HB2      LYS 132  18.196 -25.691 -10.647
 1092    HB3  LYS 132           HB3      LYS 132  19.464 -25.797  -9.429
 1093    HG2  LYS 132           HG2      LYS 132  19.153 -28.148  -9.197
 1094    HG3  LYS 132           HG3      LYS 132  17.697 -28.113 -10.187
 1095    HD2  LYS 132           HD2      LYS 132  19.486 -28.988 -11.509
 1096    HD3  LYS 132           HD3      LYS 132  19.102 -27.373 -12.104
 1097    HE2  LYS 132           HE2      LYS 132  21.012 -26.445 -10.993
 1098    HE3  LYS 132           HE3      LYS 132  21.334 -27.974 -10.174
 1099    HZ1  LYS 132           HZ1      LYS 132  21.798 -28.988 -12.311
 1100    HZ2  LYS 132           HZ2      LYS 132  22.798 -27.646 -12.074
 1101    HZ3  LYS 132           HZ3      LYS 132  21.467 -27.532 -13.111
 1102    H    LYS 133           H        LYS 133  16.137 -27.353  -7.063
 1103    HA   LYS 133           HA       LYS 133  18.358 -27.794  -5.185
 1104    HB2  LYS 133           HB2      LYS 133  16.652 -26.072  -4.417
 1105    HB3  LYS 133           HB3      LYS 133  15.470 -27.370  -4.389
 1106    HG2  LYS 133           HG2      LYS 133  16.750 -28.536  -2.693
 1107    HG3  LYS 133           HG3      LYS 133  17.995 -27.287  -2.751
 1108    HD2  LYS 133           HD2      LYS 133  16.290 -25.622  -2.064
 1109    HD3  LYS 133           HD3      LYS 133  15.120 -26.933  -1.904
 1110    HE2  LYS 133           HE2      LYS 133  15.985 -26.449   0.270
 1111    HE3  LYS 133           HE3      LYS 133  16.646 -27.997  -0.246
 1112    HZ1  LYS 133           HZ1      LYS 133  18.378 -26.700   0.736
 1113    HZ2  LYS 133           HZ2      LYS 133  18.042 -25.378  -0.259
 1114    HZ3  LYS 133           HZ3      LYS 133  18.682 -26.793  -0.924
 1115    H    ARG 134           H        ARG 134  17.949 -29.779  -3.795
 1116    HA   ARG 134           HA       ARG 134  16.393 -31.759  -5.311
 1117    HB2  ARG 134           HB2      ARG 134  18.977 -32.528  -3.978
 1118    HB3  ARG 134           HB3      ARG 134  18.081 -33.390  -5.217
 1119    HG2  ARG 134           HG2      ARG 134  19.950 -32.581  -6.334
 1120    HG3  ARG 134           HG3      ARG 134  18.686 -31.417  -6.746
 1121    HD2  ARG 134           HD2      ARG 134  20.772 -30.287  -6.151
 1122    HD3  ARG 134           HD3      ARG 134  19.480 -29.925  -4.998
 1123    HE   ARG 134           HE       ARG 134  21.191 -32.135  -4.258
 1124   HH11  ARG 134          HH11      ARG 134  20.765 -28.664  -4.055
 1125   HH12  ARG 134          HH12      ARG 134  21.604 -28.532  -2.546
 1126   HH21  ARG 134          HH21      ARG 134  22.300 -31.950  -2.283
 1127   HH22  ARG 134          HH22      ARG 134  22.491 -30.389  -1.548
 1128    H    GLN 135           H        GLN 135  14.824 -31.266  -3.720
 1129    HA   GLN 135           HA       GLN 135  15.347 -32.573  -1.139
 1130    HB2  GLN 135           HB2      GLN 135  13.570 -31.290  -0.170
 1131    HB3  GLN 135           HB3      GLN 135  14.642 -30.187  -1.015
 1132    HG2  GLN 135           HG2      GLN 135  12.012 -31.196  -2.089
 1133    HG3  GLN 135           HG3      GLN 135  12.244 -29.648  -1.269
 1134   HE21  GLN 135          HE21      GLN 135  11.286 -30.179  -3.971
 1135   HE22  GLN 135          HE22      GLN 135  12.362 -29.341  -5.035
 1136    H    LYS 136           H        LYS 136  13.818 -34.031  -0.297
 1137    HA   LYS 136           HA       LYS 136  12.089 -35.260  -2.328
 1138    HB2  LYS 136           HB2      LYS 136  13.097 -36.418   0.284
 1139    HB3  LYS 136           HB3      LYS 136  12.169 -37.279  -0.931
 1140    HG2  LYS 136           HG2      LYS 136  14.990 -36.271  -1.141
 1141    HG3  LYS 136           HG3      LYS 136  14.426 -37.941  -1.176
 1142    HD2  LYS 136           HD2      LYS 136  13.878 -35.835  -3.272
 1143    HD3  LYS 136           HD3      LYS 136  15.030 -37.162  -3.411
 1144    HE2  LYS 136           HE2      LYS 136  12.064 -37.517  -3.020
 1145    HE3  LYS 136           HE3      LYS 136  12.870 -37.548  -4.586
 1146    HZ1  LYS 136           HZ1      LYS 136  14.115 -39.461  -3.920
 1147    HZ2  LYS 136           HZ2      LYS 136  12.475 -39.770  -3.640
 1148    HZ3  LYS 136           HZ3      LYS 136  13.498 -39.392  -2.349
 1149    H    LYS 137           H        LYS 137  10.511 -36.673  -0.224
 1150    HA   LYS 137           HA       LYS 137   8.495 -34.728   0.105
 1151    HB2  LYS 137           HB2      LYS 137   7.380 -36.446   1.538
 1152    HB3  LYS 137           HB3      LYS 137   7.855 -37.027  -0.046
 1153    HG2  LYS 137           HG2      LYS 137   8.850 -38.740   0.947
 1154    HG3  LYS 137           HG3      LYS 137  10.014 -37.612   1.641
 1155    HD2  LYS 137           HD2      LYS 137   7.600 -37.521   3.177
 1156    HD3  LYS 137           HD3      LYS 137   8.092 -39.202   2.985
 1157    HE2  LYS 137           HE2      LYS 137  10.253 -38.743   3.914
 1158    HE3  LYS 137           HE3      LYS 137   9.946 -37.002   3.912
 1159    HZ1  LYS 137           HZ1      LYS 137   9.680 -37.910   6.117
 1160    HZ2  LYS 137           HZ2      LYS 137   8.538 -39.030   5.572
 1161    HZ3  LYS 137           HZ3      LYS 137   8.180 -37.376   5.545
 1162    H    LEU 138           H        LEU 138   9.565 -32.977   1.159
 1163    HA   LEU 138           HA       LEU 138   9.349 -33.282   4.040
 1164    HB2  LEU 138           HB2      LEU 138  11.438 -31.909   4.353
 1165    HB3  LEU 138           HB3      LEU 138  11.651 -33.576   3.841
 1166    HG   LEU 138           HG       LEU 138  11.750 -32.471   1.442
 1167   HD11  LEU 138          HD11      LEU 138  12.880 -30.311   1.485
 1168   HD12  LEU 138          HD12      LEU 138  12.681 -30.237   3.236
 1169   HD13  LEU 138          HD13      LEU 138  11.265 -30.208   2.186
 1170   HD21  LEU 138          HD21      LEU 138  13.491 -33.811   2.462
 1171   HD22  LEU 138          HD22      LEU 138  14.020 -32.426   3.420
 1172   HD23  LEU 138          HD23      LEU 138  14.182 -32.398   1.663
 1173    H    ALA 139           H        ALA 139   9.535 -31.011   5.103
 1174    HA   ALA 139           HA       ALA 139   7.339 -29.544   4.132
 1175    HB1  ALA 139           HB1      ALA 139   7.877 -27.946   5.917
 1176    HB2  ALA 139           HB2      ALA 139   9.433 -28.742   6.151
 1177    HB3  ALA 139           HB3      ALA 139   7.938 -29.614   6.493
 1178    H    SER 140           H        SER 140   7.572 -27.015   3.956
 1179    HA   SER 140           HA       SER 140   8.907 -26.521   1.519
 1180    HB2  SER 140           HB2      SER 140   6.847 -25.326   2.321
 1181    HB3  SER 140           HB3      SER 140   7.858 -24.462   3.478
 1182    HG   SER 140           HG       SER 140   9.119 -23.970   1.385
 1183    H    SER 141           H        SER 141  11.076 -26.770   1.541
 1184    HA   SER 141           HA       SER 141  12.660 -24.823   2.975
 1185    HB2  SER 141           HB2      SER 141  12.347 -26.813   4.543
 1186    HB3  SER 141           HB3      SER 141  13.248 -27.770   3.372
 1187    HG   SER 141           HG       SER 141  14.842 -25.872   3.666
  Start of MODEL    9
    1    H1   ASP   1           HT1      ASP   1 -20.768  14.722  -8.659
    2    H2   ASP   1           HT2      ASP   1 -21.584  13.754  -9.780
    3    H3   ASP   1           HT3      ASP   1 -19.944  13.491  -9.474
    4    HA   ASP   1           HA       ASP   1 -20.377  12.768  -7.269
    5    HB2  ASP   1           HB2      ASP   1 -23.209  13.556  -7.952
    6    HB3  ASP   1           HB3      ASP   1 -22.838  12.465  -6.620
    7    HA   PRO   2           HA       PRO   2 -20.588   8.612  -8.713
    8    HB2  PRO   2           HB2      PRO   2 -22.298   7.552  -6.729
    9    HB3  PRO   2           HB3      PRO   2 -20.536   7.573  -6.707
   10    HG2  PRO   2           HG2      PRO   2 -22.472   9.409  -5.402
   11    HG3  PRO   2           HG3      PRO   2 -20.869   8.888  -4.853
   12    HD2  PRO   2           HD2      PRO   2 -21.256  11.341  -5.835
   13    HD3  PRO   2           HD3      PRO   2 -19.769  10.437  -6.198
   14    H    SER   3           H        SER   3 -23.756   8.979  -7.180
   15    HA   SER   3           HA       SER   3 -25.030   8.658  -9.812
   16    HB2  SER   3           HB2      SER   3 -26.097   7.550  -7.200
   17    HB3  SER   3           HB3      SER   3 -26.750   7.276  -8.815
   18    HG   SER   3           HG       SER   3 -24.965   6.054  -9.322
   19    H    ARG   4           H        ARG   4 -25.533   9.623  -6.448
   20    HA   ARG   4           HA       ARG   4 -26.734  12.121  -7.411
   21    HB2  ARG   4           HB2      ARG   4 -27.620  10.538  -4.983
   22    HB3  ARG   4           HB3      ARG   4 -28.236  12.117  -5.452
   23    HG2  ARG   4           HG2      ARG   4 -29.080  11.117  -7.550
   24    HG3  ARG   4           HG3      ARG   4 -28.550   9.537  -6.969
   25    HD2  ARG   4           HD2      ARG   4 -30.898   9.794  -6.521
   26    HD3  ARG   4           HD3      ARG   4 -30.015   9.817  -4.997
   27    HE   ARG   4           HE       ARG   4 -30.225  12.440  -5.618
   28   HH11  ARG   4          HH11      ARG   4 -32.541   9.831  -5.354
   29   HH12  ARG   4          HH12      ARG   4 -33.864  10.880  -4.949
   30   HH21  ARG   4          HH21      ARG   4 -31.968  13.819  -5.058
   31   HH22  ARG   4          HH22      ARG   4 -33.538  13.138  -4.772
   32    H    ARG   5           H        ARG   5 -26.715  13.720  -5.405
   33    HA   ARG   5           HA       ARG   5 -24.113  14.309  -4.694
   34    HB2  ARG   5           HB2      ARG   5 -26.065  15.848  -4.502
   35    HB3  ARG   5           HB3      ARG   5 -26.605  14.950  -3.095
   36    HG2  ARG   5           HG2      ARG   5 -23.872  16.148  -3.118
   37    HG3  ARG   5           HG3      ARG   5 -25.277  17.170  -2.812
   38    HD2  ARG   5           HD2      ARG   5 -25.914  15.761  -0.936
   39    HD3  ARG   5           HD3      ARG   5 -24.568  14.675  -1.271
   40    HE   ARG   5           HE       ARG   5 -23.411  17.128  -0.919
   41   HH11  ARG   5          HH11      ARG   5 -25.527  15.108   0.998
   42   HH12  ARG   5          HH12      ARG   5 -24.881  15.642   2.515
   43   HH21  ARG   5          HH21      ARG   5 -22.544  17.831   1.088
   44   HH22  ARG   5          HH22      ARG   5 -23.180  17.181   2.565
   45    H    ALA   6           H        ALA   6 -22.700  13.286  -3.451
   46    HA   ALA   6           HA       ALA   6 -23.466  10.960  -2.010
   47    HB1  ALA   6           HB1      ALA   6 -21.319  11.078  -3.110
   48    HB2  ALA   6           HB2      ALA   6 -21.132  10.780  -1.379
   49    HB3  ALA   6           HB3      ALA   6 -20.829  12.388  -2.034
   50    HA   PRO   7           HA       PRO   7 -23.987  12.882   1.955
   51    HB2  PRO   7           HB2      PRO   7 -25.123  10.839   3.160
   52    HB3  PRO   7           HB3      PRO   7 -25.893  11.557   1.739
   53    HG2  PRO   7           HG2      PRO   7 -24.238   9.069   1.905
   54    HG3  PRO   7           HG3      PRO   7 -25.794   9.319   1.088
   55    HD2  PRO   7           HD2      PRO   7 -23.303   9.483  -0.137
   56    HD3  PRO   7           HD3      PRO   7 -24.800  10.208  -0.762
   57    H    THR   8           H        THR   8 -23.529  12.050   4.316
   58    HA   THR   8           HA       THR   8 -20.767  11.133   4.374
   59    HB   THR   8           HB       THR   8 -21.094  11.656   6.898
   60    HG1  THR   8           HG1      THR   8 -22.772  13.130   7.301
   61   HG21  THR   8          HG21      THR   8 -20.610  14.029   6.476
   62   HG22  THR   8          HG22      THR   8 -21.135  13.827   4.803
   63   HG23  THR   8          HG23      THR   8 -19.711  12.969   5.389
   64    H    TRP   9           H        TRP   9 -20.066   9.522   5.919
   65    HA   TRP   9           HA       TRP   9 -21.932   7.296   6.061
   66    HB2  TRP   9           HB2      TRP   9 -18.970   7.542   6.576
   67    HB3  TRP   9           HB3      TRP   9 -19.872   6.083   6.967
   68    HD1  TRP   9           HD1      TRP   9 -18.708   8.154   3.954
   69    HE1  TRP   9           HE1      TRP   9 -18.790   6.657   1.864
   70    HE3  TRP   9           HE3      TRP   9 -20.948   4.034   5.989
   71    HZ2  TRP   9           HZ2      TRP   9 -19.679   4.071   1.171
   72    HZ3  TRP   9           HZ3      TRP   9 -21.372   2.087   4.545
   73    HH2  TRP   9           HH2      TRP   9 -20.750   2.107   2.185
   74    H    SER  10           H        SER  10 -23.244   7.248   7.747
   75    HA   SER  10           HA       SER  10 -22.628   8.339  10.304
   76    HB2  SER  10           HB2      SER  10 -24.956   7.988   9.366
   77    HB3  SER  10           HB3      SER  10 -24.728   6.259   9.624
   78    HG   SER  10           HG       SER  10 -25.548   8.084  11.363
   79    HA   PRO  11           HA       PRO  11 -20.025   5.304  12.221
   80    HB2  PRO  11           HB2      PRO  11 -22.184   5.179  14.291
   81    HB3  PRO  11           HB3      PRO  11 -20.435   5.312  14.499
   82    HG2  PRO  11           HG2      PRO  11 -21.989   7.456  14.757
   83    HG3  PRO  11           HG3      PRO  11 -20.405   7.569  13.972
   84    HD2  PRO  11           HD2      PRO  11 -23.118   7.651  12.774
   85    HD3  PRO  11           HD3      PRO  11 -21.609   8.396  12.211
   86    H    GLU  12           H        GLU  12 -23.485   4.473  12.577
   87    HA   GLU  12           HA       GLU  12 -23.198   1.703  12.695
   88    HB2  GLU  12           HB2      GLU  12 -25.283   2.763  13.280
   89    HB3  GLU  12           HB3      GLU  12 -25.473   3.397  11.653
   90    HG2  GLU  12           HG2      GLU  12 -26.956   1.545  11.945
   91    HG3  GLU  12           HG3      GLU  12 -25.685   1.087  10.815
   92    H    GLU  13           H        GLU  13 -23.382   3.858   9.915
   93    HA   GLU  13           HA       GLU  13 -23.720   1.765   8.003
   94    HB2  GLU  13           HB2      GLU  13 -24.203   4.367   7.852
   95    HB3  GLU  13           HB3      GLU  13 -22.562   4.402   7.219
   96    HG2  GLU  13           HG2      GLU  13 -24.115   4.270   5.395
   97    HG3  GLU  13           HG3      GLU  13 -23.227   2.749   5.506
   98    H    GLU  14           H        GLU  14 -20.963   3.532   9.322
   99    HA   GLU  14           HA       GLU  14 -18.978   2.424   7.634
  100    HB2  GLU  14           HB2      GLU  14 -18.762   3.324  10.519
  101    HB3  GLU  14           HB3      GLU  14 -17.400   2.979   9.467
  102    HG2  GLU  14           HG2      GLU  14 -18.170   4.791   7.964
  103    HG3  GLU  14           HG3      GLU  14 -19.420   5.180   9.146
  104    H    ALA  15           H        ALA  15 -20.319   1.422  10.756
  105    HA   ALA  15           HA       ALA  15 -18.772  -0.930  11.045
  106    HB1  ALA  15           HB1      ALA  15 -20.371  -1.551  12.768
  107    HB2  ALA  15           HB2      ALA  15 -21.488  -0.308  12.204
  108    HB3  ALA  15           HB3      ALA  15 -19.942   0.155  12.914
  109    H    HIS  16           H        HIS  16 -21.722  -0.197   9.394
  110    HA   HIS  16           HA       HIS  16 -22.504  -2.855   8.786
  111    HB2  HIS  16           HB2      HIS  16 -24.065  -0.912   8.802
  112    HB3  HIS  16           HB3      HIS  16 -23.248  -0.279   7.379
  113    HD1  HIS  16           HD1      HIS  16 -25.455  -0.404   6.051
  114    HD2  HIS  16           HD2      HIS  16 -24.053  -4.077   7.408
  115    HE1  HIS  16           HE1      HIS  16 -26.806  -2.156   4.836
  116    HE2  HIS  16           HE2      HIS  16 -26.106  -4.342   5.870
  117    H    LEU  17           H        LEU  17 -20.451  -0.459   7.280
  118    HA   LEU  17           HA       LEU  17 -20.239  -1.703   4.750
  119    HB2  LEU  17           HB2      LEU  17 -19.594   0.668   5.338
  120    HB3  LEU  17           HB3      LEU  17 -18.166   0.012   6.113
  121    HG   LEU  17           HG       LEU  17 -17.404  -0.895   3.961
  122   HD11  LEU  17          HD11      LEU  17 -18.586  -0.151   1.901
  123   HD12  LEU  17          HD12      LEU  17 -19.920   0.389   2.918
  124   HD13  LEU  17          HD13      LEU  17 -19.487  -1.319   2.864
  125   HD21  LEU  17          HD21      LEU  17 -16.879   1.228   2.893
  126   HD22  LEU  17          HD22      LEU  17 -16.708   1.343   4.645
  127   HD23  LEU  17          HD23      LEU  17 -18.127   2.028   3.850
  128    H    ARG  18           H        ARG  18 -18.374  -1.919   7.743
  129    HA   ARG  18           HA       ARG  18 -16.611  -3.912   6.678
  130    HB2  ARG  18           HB2      ARG  18 -15.746  -4.091   8.957
  131    HB3  ARG  18           HB3      ARG  18 -15.845  -2.409   8.467
  132    HG2  ARG  18           HG2      ARG  18 -18.055  -2.336   9.711
  133    HG3  ARG  18           HG3      ARG  18 -17.593  -3.892  10.399
  134    HD2  ARG  18           HD2      ARG  18 -15.992  -1.342  10.593
  135    HD3  ARG  18           HD3      ARG  18 -17.002  -2.014  11.870
  136    HE   ARG  18           HE       ARG  18 -15.186  -3.987  11.144
  137   HH11  ARG  18          HH11      ARG  18 -15.107  -0.776  12.544
  138   HH12  ARG  18          HH12      ARG  18 -13.668  -1.075  13.465
  139   HH21  ARG  18          HH21      ARG  18 -13.284  -4.381  12.359
  140   HH22  ARG  18          HH22      ARG  18 -12.637  -3.129  13.369
  141    H    GLU  19           H        GLU  19 -19.591  -3.741   8.446
  142    HA   GLU  19           HA       GLU  19 -19.868  -6.257   9.465
  143    HB2  GLU  19           HB2      GLU  19 -21.478  -4.405   9.766
  144    HB3  GLU  19           HB3      GLU  19 -22.036  -4.658   8.118
  145    HG2  GLU  19           HG2      GLU  19 -23.573  -5.681   9.623
  146    HG3  GLU  19           HG3      GLU  19 -22.709  -6.935   8.739
  147    H    LEU  20           H        LEU  20 -20.947  -5.156   6.282
  148    HA   LEU  20           HA       LEU  20 -21.694  -7.725   5.350
  149    HB2  LEU  20           HB2      LEU  20 -21.847  -5.039   4.461
  150    HB3  LEU  20           HB3      LEU  20 -21.055  -5.956   3.195
  151    HG   LEU  20           HG       LEU  20 -23.667  -6.829   4.401
  152   HD11  LEU  20          HD11      LEU  20 -23.258  -5.150   1.937
  153   HD12  LEU  20          HD12      LEU  20 -23.897  -4.565   3.472
  154   HD13  LEU  20          HD13      LEU  20 -24.791  -5.771   2.550
  155   HD21  LEU  20          HD21      LEU  20 -22.266  -7.464   1.812
  156   HD22  LEU  20          HD22      LEU  20 -23.853  -8.063   2.292
  157   HD23  LEU  20          HD23      LEU  20 -22.418  -8.531   3.205
  158    H    TYR  21           H        TYR  21 -18.702  -5.903   5.278
  159    HA   TYR  21           HA       TYR  21 -17.446  -7.448   3.252
  160    HB2  TYR  21           HB2      TYR  21 -16.571  -5.238   3.805
  161    HB3  TYR  21           HB3      TYR  21 -16.213  -5.770   5.447
  162    HD1  TYR  21           HD1      TYR  21 -14.182  -6.856   5.949
  163    HD2  TYR  21           HD2      TYR  21 -15.318  -6.320   1.890
  164    HE1  TYR  21           HE1      TYR  21 -11.959  -7.625   5.237
  165    HE2  TYR  21           HE2      TYR  21 -13.092  -7.076   1.163
  166    HH   TYR  21           HH       TYR  21 -10.875  -7.347   1.961
  167    H    LEU  22           H        LEU  22 -17.393  -7.531   6.781
  168    HA   LEU  22           HA       LEU  22 -15.574  -9.633   7.078
  169    HB2  LEU  22           HB2      LEU  22 -17.918  -9.004   8.866
  170    HB3  LEU  22           HB3      LEU  22 -16.466  -9.875   9.311
  171    HG   LEU  22           HG       LEU  22 -16.613  -6.959   8.560
  172   HD11  LEU  22          HD11      LEU  22 -17.559  -7.455  10.755
  173   HD12  LEU  22          HD12      LEU  22 -16.067  -6.523  10.870
  174   HD13  LEU  22          HD13      LEU  22 -16.056  -8.253  11.217
  175   HD21  LEU  22          HD21      LEU  22 -14.267  -6.858   9.232
  176   HD22  LEU  22          HD22      LEU  22 -14.508  -7.911   7.840
  177   HD23  LEU  22          HD23      LEU  22 -14.253  -8.611   9.439
  178    H    ALA  23           H        ALA  23 -18.879  -9.613   6.118
  179    HA   ALA  23           HA       ALA  23 -19.387 -12.376   6.702
  180    HB1  ALA  23           HB1      ALA  23 -21.139 -10.644   6.755
  181    HB2  ALA  23           HB2      ALA  23 -21.541 -11.997   5.698
  182    HB3  ALA  23           HB3      ALA  23 -20.988 -10.472   5.008
  183    H    ASN  24           H        ASN  24 -18.256 -10.610   3.841
  184    HA   ASN  24           HA       ASN  24 -18.337 -13.155   2.352
  185    HB2  ASN  24           HB2      ASN  24 -18.937 -10.385   1.305
  186    HB3  ASN  24           HB3      ASN  24 -18.770 -11.818   0.297
  187   HD21  ASN  24          HD21      ASN  24 -20.768 -10.133   2.582
  188   HD22  ASN  24          HD22      ASN  24 -22.178 -11.117   2.379
  189    H    LYS  25           H        LYS  25 -16.139 -11.610   3.820
  190    HA   LYS  25           HA       LYS  25 -14.500 -10.400   1.818
  191    HB2  LYS  25           HB2      LYS  25 -12.837 -10.159   3.576
  192    HB3  LYS  25           HB3      LYS  25 -14.427  -9.698   4.171
  193    HG2  LYS  25           HG2      LYS  25 -14.632 -11.943   5.194
  194    HG3  LYS  25           HG3      LYS  25 -12.968 -12.271   4.710
  195    HD2  LYS  25           HD2      LYS  25 -12.226 -10.342   6.038
  196    HD3  LYS  25           HD3      LYS  25 -13.891 -10.068   6.549
  197    HE2  LYS  25           HE2      LYS  25 -12.072 -12.350   7.211
  198    HE3  LYS  25           HE3      LYS  25 -12.928 -11.268   8.306
  199    HZ1  LYS  25           HZ1      LYS  25 -14.029 -13.364   8.313
  200    HZ2  LYS  25           HZ2      LYS  25 -14.104 -13.420   6.625
  201    HZ3  LYS  25           HZ3      LYS  25 -15.031 -12.286   7.479
  202    H    ASP  26           H        ASP  26 -14.630 -13.586   3.262
  203    HA   ASP  26           HA       ASP  26 -12.139 -14.280   1.879
  204    HB2  ASP  26           HB2      ASP  26 -12.180 -16.333   3.364
  205    HB3  ASP  26           HB3      ASP  26 -11.907 -14.796   4.169
  206    H    VAL  27           H        VAL  27 -15.099 -14.200   0.961
  207    HA   VAL  27           HA       VAL  27 -15.312 -16.895  -0.117
  208    HB   VAL  27           HB       VAL  27 -17.023 -14.471  -0.726
  209   HG11  VAL  27          HG11      VAL  27 -18.642 -16.091  -1.568
  210   HG12  VAL  27          HG12      VAL  27 -17.528 -17.408  -1.202
  211   HG13  VAL  27          HG13      VAL  27 -17.113 -16.221  -2.439
  212   HG21  VAL  27          HG21      VAL  27 -17.144 -15.026   1.643
  213   HG22  VAL  27          HG22      VAL  27 -17.501 -16.706   1.244
  214   HG23  VAL  27          HG23      VAL  27 -18.654 -15.437   0.829
  215    H    GLU  28           H        GLU  28 -13.940 -17.364  -1.678
  216    HA   GLU  28           HA       GLU  28 -12.995 -15.240  -3.429
  217    HB2  GLU  28           HB2      GLU  28 -12.024 -18.092  -3.211
  218    HB3  GLU  28           HB3      GLU  28 -11.241 -16.785  -4.087
  219    HG2  GLU  28           HG2      GLU  28 -10.963 -15.581  -1.935
  220    HG3  GLU  28           HG3      GLU  28 -11.605 -16.999  -1.110
  221    H    GLY  29           H        GLY  29 -13.024 -15.422  -5.679
  222    HA2  GLY  29           HA2      GLY  29 -13.844 -16.248  -7.732
  223    HA3  GLY  29           HA3      GLY  29 -14.823 -17.413  -6.846
  224    H    GLN  30           H        GLN  30 -15.327 -14.838  -5.120
  225    HA   GLN  30           HA       GLN  30 -17.562 -13.856  -6.754
  226    HB2  GLN  30           HB2      GLN  30 -18.634 -14.861  -4.966
  227    HB3  GLN  30           HB3      GLN  30 -17.323 -14.516  -3.848
  228    HG2  GLN  30           HG2      GLN  30 -17.968 -12.206  -3.723
  229    HG3  GLN  30           HG3      GLN  30 -19.200 -12.442  -4.955
  230   HE21  GLN  30          HE21      GLN  30 -19.280 -11.504  -2.160
  231   HE22  GLN  30          HE22      GLN  30 -20.501 -12.461  -1.427
  232    H    ASP  31           H        ASP  31 -17.974 -11.664  -6.789
  233    HA   ASP  31           HA       ASP  31 -15.875  -9.822  -6.256
  234    HB2  ASP  31           HB2      ASP  31 -18.815  -9.471  -6.824
  235    HB3  ASP  31           HB3      ASP  31 -17.710  -8.111  -6.622
  236    H    VAL  32           H        VAL  32 -15.259  -9.515  -4.148
  237    HA   VAL  32           HA       VAL  32 -17.095  -9.700  -1.998
  238    HB   VAL  32           HB       VAL  32 -14.611 -10.019  -1.746
  239   HG11  VAL  32          HG11      VAL  32 -14.609  -7.006  -1.915
  240   HG12  VAL  32          HG12      VAL  32 -13.785  -8.136  -2.997
  241   HG13  VAL  32          HG13      VAL  32 -13.257  -7.982  -1.320
  242   HG21  VAL  32          HG21      VAL  32 -16.023  -8.077   0.071
  243   HG22  VAL  32          HG22      VAL  32 -14.528  -8.917   0.478
  244   HG23  VAL  32          HG23      VAL  32 -16.007  -9.836   0.193
  245    H    VAL  33           H        VAL  33 -15.755  -6.991  -3.853
  246    HA   VAL  33           HA       VAL  33 -16.789  -5.001  -2.129
  247    HB   VAL  33           HB       VAL  33 -14.920  -4.584  -3.708
  248   HG11  VAL  33          HG11      VAL  33 -15.358  -4.037  -6.023
  249   HG12  VAL  33          HG12      VAL  33 -17.044  -4.514  -5.824
  250   HG13  VAL  33          HG13      VAL  33 -15.764  -5.716  -5.676
  251   HG21  VAL  33          HG21      VAL  33 -17.304  -2.768  -3.867
  252   HG22  VAL  33          HG22      VAL  33 -15.684  -2.312  -4.389
  253   HG23  VAL  33          HG23      VAL  33 -15.987  -2.706  -2.697
  254    H    GLU  34           H        GLU  34 -18.015  -6.534  -5.056
  255    HA   GLU  34           HA       GLU  34 -20.251  -4.804  -5.308
  256    HB2  GLU  34           HB2      GLU  34 -19.241  -6.243  -7.141
  257    HB3  GLU  34           HB3      GLU  34 -20.056  -7.609  -6.391
  258    HG2  GLU  34           HG2      GLU  34 -22.193  -6.661  -6.799
  259    HG3  GLU  34           HG3      GLU  34 -21.479  -5.130  -7.310
  260    H    ALA  35           H        ALA  35 -19.638  -7.838  -3.656
  261    HA   ALA  35           HA       ALA  35 -22.241  -8.412  -2.819
  262    HB1  ALA  35           HB1      ALA  35 -21.216  -9.639  -0.985
  263    HB2  ALA  35           HB2      ALA  35 -19.679  -8.831  -1.288
  264    HB3  ALA  35           HB3      ALA  35 -20.346  -9.935  -2.491
  265    H    ILE  36           H        ILE  36 -19.793  -6.235  -1.513
  266    HA   ILE  36           HA       ILE  36 -21.278  -5.563   0.825
  267    HB   ILE  36           HB       ILE  36 -19.182  -3.793  -0.402
  268   HG12  ILE  36          HG12      ILE  36 -18.104  -5.907  -0.453
  269   HG13  ILE  36          HG13      ILE  36 -17.517  -5.093   0.993
  270   HG21  ILE  36          HG21      ILE  36 -20.380  -2.928   1.522
  271   HG22  ILE  36          HG22      ILE  36 -18.692  -3.239   1.925
  272   HG23  ILE  36          HG23      ILE  36 -19.946  -4.359   2.456
  273   HD11  ILE  36          HD11      ILE  36 -17.983  -7.466   1.355
  274   HD12  ILE  36          HD12      ILE  36 -19.673  -7.189   0.936
  275   HD13  ILE  36          HD13      ILE  36 -18.985  -6.428   2.370
  276    H    LEU  37           H        LEU  37 -20.414  -3.631  -2.051
  277    HA   LEU  37           HA       LEU  37 -21.964  -1.428  -1.213
  278    HB2  LEU  37           HB2      LEU  37 -21.594  -0.579  -3.558
  279    HB3  LEU  37           HB3      LEU  37 -20.177  -0.916  -2.594
  280    HG   LEU  37           HG       LEU  37 -20.064  -3.155  -3.841
  281   HD11  LEU  37          HD11      LEU  37 -21.920  -1.632  -5.674
  282   HD12  LEU  37          HD12      LEU  37 -22.275  -3.146  -4.841
  283   HD13  LEU  37          HD13      LEU  37 -21.046  -3.100  -6.104
  284   HD21  LEU  37          HD21      LEU  37 -19.617  -0.590  -5.343
  285   HD22  LEU  37          HD22      LEU  37 -18.825  -2.135  -5.647
  286   HD23  LEU  37          HD23      LEU  37 -18.530  -1.271  -4.137
  287    H    ALA  38           H        ALA  38 -22.861  -4.201  -3.047
  288    HA   ALA  38           HA       ALA  38 -25.211  -2.956  -4.164
  289    HB1  ALA  38           HB1      ALA  38 -24.443  -5.861  -4.112
  290    HB2  ALA  38           HB2      ALA  38 -24.063  -4.713  -5.396
  291    HB3  ALA  38           HB3      ALA  38 -25.742  -5.144  -5.065
  292    H    HIS  39           H        HIS  39 -24.516  -5.121  -1.439
  293    HA   HIS  39           HA       HIS  39 -27.311  -5.626  -0.993
  294    HB2  HIS  39           HB2      HIS  39 -24.836  -6.306   0.562
  295    HB3  HIS  39           HB3      HIS  39 -26.434  -6.541   1.260
  296    HD1  HIS  39           HD1      HIS  39 -27.903  -8.436   0.267
  297    HD2  HIS  39           HD2      HIS  39 -24.142  -8.103  -1.472
  298    HE1  HIS  39           HE1      HIS  39 -27.599 -10.530  -1.089
  299    HE2  HIS  39           HE2      HIS  39 -25.319 -10.303  -2.144
  300    H    LEU  40           H        LEU  40 -24.959  -3.311   0.223
  301    HA   LEU  40           HA       LEU  40 -27.100  -2.191   1.862
  302    HB2  LEU  40           HB2      LEU  40 -25.198  -0.510   2.502
  303    HB3  LEU  40           HB3      LEU  40 -25.301  -2.086   3.247
  304    HG   LEU  40           HG       LEU  40 -23.573  -2.816   1.479
  305   HD11  LEU  40          HD11      LEU  40 -22.062  -0.998   0.757
  306   HD12  LEU  40          HD12      LEU  40 -23.257   0.174   1.317
  307   HD13  LEU  40          HD13      LEU  40 -23.654  -0.932  -0.001
  308   HD21  LEU  40          HD21      LEU  40 -23.098  -2.620   3.852
  309   HD22  LEU  40          HD22      LEU  40 -22.821  -0.887   3.670
  310   HD23  LEU  40          HD23      LEU  40 -21.738  -2.043   2.894
  311    H    ASN  41           H        ASN  41 -28.357  -1.600   0.069
  312    HA   ASN  41           HA       ASN  41 -27.379   0.418  -1.756
  313    HB2  ASN  41           HB2      ASN  41 -29.737   0.376  -2.612
  314    HB3  ASN  41           HB3      ASN  41 -28.943  -1.194  -2.625
  315   HD21  ASN  41          HD21      ASN  41 -31.477   0.718  -1.265
  316   HD22  ASN  41          HD22      ASN  41 -32.252  -0.557  -0.395
  317    H    THR  42           H        THR  42 -27.150   1.131   0.889
  318    HA   THR  42           HA       THR  42 -29.273   3.040   1.483
  319    HB   THR  42           HB       THR  42 -28.575   1.674   3.341
  320    HG1  THR  42           HG1      THR  42 -27.433   3.483   4.654
  321   HG21  THR  42          HG21      THR  42 -25.763   2.649   2.835
  322   HG22  THR  42          HG22      THR  42 -26.369   1.024   2.523
  323   HG23  THR  42          HG23      THR  42 -26.274   1.622   4.177
  324    H    VAL  43           H        VAL  43 -26.126   2.836   0.145
  325    HA   VAL  43           HA       VAL  43 -25.955   5.767   0.084
  326    HB   VAL  43           HB       VAL  43 -23.424   5.455   0.053
  327   HG11  VAL  43          HG11      VAL  43 -24.911   4.784   2.587
  328   HG12  VAL  43          HG12      VAL  43 -24.621   6.405   1.952
  329   HG13  VAL  43          HG13      VAL  43 -23.264   5.411   2.482
  330   HG21  VAL  43          HG21      VAL  43 -24.167   2.776   1.229
  331   HG22  VAL  43          HG22      VAL  43 -22.543   3.459   1.145
  332   HG23  VAL  43          HG23      VAL  43 -23.399   3.036  -0.337
  333    HA   PRO  44           HA       PRO  44 -25.630   4.742  -4.290
  334    HB2  PRO  44           HB2      PRO  44 -26.208   7.219  -5.198
  335    HB3  PRO  44           HB3      PRO  44 -27.460   6.100  -4.650
  336    HG2  PRO  44           HG2      PRO  44 -26.261   8.440  -3.251
  337    HG3  PRO  44           HG3      PRO  44 -27.932   7.854  -3.231
  338    HD2  PRO  44           HD2      PRO  44 -26.073   7.401  -1.233
  339    HD3  PRO  44           HD3      PRO  44 -27.517   6.410  -1.512
  340    H    ARG  45           H        ARG  45 -23.371   4.395  -4.166
  341    HA   ARG  45           HA       ARG  45 -21.728   6.783  -4.644
  342    HB2  ARG  45           HB2      ARG  45 -21.027   4.520  -2.773
  343    HB3  ARG  45           HB3      ARG  45 -19.964   5.850  -3.207
  344    HG2  ARG  45           HG2      ARG  45 -21.621   7.408  -2.209
  345    HG3  ARG  45           HG3      ARG  45 -22.523   5.997  -1.645
  346    HD2  ARG  45           HD2      ARG  45 -20.284   5.260  -0.621
  347    HD3  ARG  45           HD3      ARG  45 -19.794   6.934  -0.854
  348    HE   ARG  45           HE       ARG  45 -21.755   5.929   1.037
  349   HH11  ARG  45          HH11      ARG  45 -20.346   8.718  -0.532
  350   HH12  ARG  45          HH12      ARG  45 -20.778   9.816   0.747
  351   HH21  ARG  45          HH21      ARG  45 -22.322   7.376   2.726
  352   HH22  ARG  45          HH22      ARG  45 -21.896   9.054   2.588
  353    H    THR  46           H        THR  46 -19.406   6.012  -5.204
  354    HA   THR  46           HA       THR  46 -19.616   4.329  -7.518
  355    HB   THR  46           HB       THR  46 -17.294   4.887  -7.928
  356    HG1  THR  46           HG1      THR  46 -16.512   6.479  -6.073
  357   HG21  THR  46          HG21      THR  46 -17.427   7.285  -8.045
  358   HG22  THR  46          HG22      THR  46 -18.642   7.317  -6.767
  359   HG23  THR  46          HG23      THR  46 -19.039   6.628  -8.343
  360    H    ARG  47           H        ARG  47 -17.873   2.623  -7.844
  361    HA   ARG  47           HA       ARG  47 -18.123   0.683  -5.757
  362    HB2  ARG  47           HB2      ARG  47 -16.216   0.457  -8.085
  363    HB3  ARG  47           HB3      ARG  47 -17.050  -0.830  -7.227
  364    HG2  ARG  47           HG2      ARG  47 -18.329   1.171  -9.082
  365    HG3  ARG  47           HG3      ARG  47 -17.978  -0.514  -9.448
  366    HD2  ARG  47           HD2      ARG  47 -19.566  -1.269  -7.844
  367    HD3  ARG  47           HD3      ARG  47 -19.773   0.355  -7.198
  368    HE   ARG  47           HE       ARG  47 -20.766   0.922  -9.411
  369   HH11  ARG  47          HH11      ARG  47 -20.758  -2.413  -8.323
  370   HH12  ARG  47          HH12      ARG  47 -22.216  -2.815  -9.172
  371   HH21  ARG  47          HH21      ARG  47 -22.682   0.385 -10.509
  372   HH22  ARG  47          HH22      ARG  47 -23.302  -1.237 -10.413
  373    H    LYS  48           H        LYS  48 -15.897   3.110  -6.635
  374    HA   LYS  48           HA       LYS  48 -13.526   2.104  -5.460
  375    HB2  LYS  48           HB2      LYS  48 -13.481   3.845  -7.156
  376    HB3  LYS  48           HB3      LYS  48 -14.403   4.924  -6.120
  377    HG2  LYS  48           HG2      LYS  48 -12.513   4.904  -4.510
  378    HG3  LYS  48           HG3      LYS  48 -11.594   3.945  -5.670
  379    HD2  LYS  48           HD2      LYS  48 -10.955   6.257  -5.897
  380    HD3  LYS  48           HD3      LYS  48 -11.872   5.781  -7.328
  381    HE2  LYS  48           HE2      LYS  48 -13.856   6.854  -6.458
  382    HE3  LYS  48           HE3      LYS  48 -13.027   7.235  -4.951
  383    HZ1  LYS  48           HZ1      LYS  48 -12.326   8.298  -7.636
  384    HZ2  LYS  48           HZ2      LYS  48 -11.514   8.656  -6.198
  385    HZ3  LYS  48           HZ3      LYS  48 -13.118   9.150  -6.406
  386    H    GLN  49           H        GLN  49 -16.195   4.063  -4.256
  387    HA   GLN  49           HA       GLN  49 -14.913   5.097  -1.983
  388    HB2  GLN  49           HB2      GLN  49 -17.854   4.613  -2.464
  389    HB3  GLN  49           HB3      GLN  49 -17.191   5.598  -1.168
  390    HG2  GLN  49           HG2      GLN  49 -16.910   6.115  -4.118
  391    HG3  GLN  49           HG3      GLN  49 -17.958   6.978  -2.999
  392   HE21  GLN  49          HE21      GLN  49 -17.094   8.471  -1.607
  393   HE22  GLN  49          HE22      GLN  49 -15.471   9.059  -1.747
  394    H    ILE  50           H        ILE  50 -16.992   2.230  -2.345
  395    HA   ILE  50           HA       ILE  50 -16.948   1.530   0.384
  396    HB   ILE  50           HB       ILE  50 -17.539  -0.053  -2.100
  397   HG12  ILE  50          HG12      ILE  50 -19.737  -0.300  -0.687
  398   HG13  ILE  50          HG13      ILE  50 -19.102   1.080   0.195
  399   HG21  ILE  50          HG21      ILE  50 -18.199  -1.944  -0.630
  400   HG22  ILE  50          HG22      ILE  50 -17.402  -1.121   0.712
  401   HG23  ILE  50          HG23      ILE  50 -16.461  -1.653  -0.681
  402   HD11  ILE  50          HD11      ILE  50 -20.657   1.792  -1.500
  403   HD12  ILE  50          HD12      ILE  50 -19.713   0.974  -2.745
  404   HD13  ILE  50          HD13      ILE  50 -19.034   2.363  -1.890
  405    H    ILE  51           H        ILE  51 -14.963   0.395  -2.353
  406    HA   ILE  51           HA       ILE  51 -13.328  -1.414  -1.055
  407    HB   ILE  51           HB       ILE  51 -12.429   0.583  -3.139
  408   HG12  ILE  51          HG12      ILE  51 -13.477  -2.226  -3.505
  409   HG13  ILE  51          HG13      ILE  51 -14.383  -0.753  -3.844
  410   HG21  ILE  51          HG21      ILE  51 -10.714  -1.102  -3.680
  411   HG22  ILE  51          HG22      ILE  51 -11.241  -2.051  -2.290
  412   HG23  ILE  51          HG23      ILE  51 -10.542  -0.450  -2.051
  413   HD11  ILE  51          HD11      ILE  51 -11.840  -1.599  -5.206
  414   HD12  ILE  51          HD12      ILE  51 -12.777  -0.146  -5.560
  415   HD13  ILE  51          HD13      ILE  51 -13.467  -1.738  -5.870
  416    H    HIS  52           H        HIS  52 -13.025   2.084  -1.287
  417    HA   HIS  52           HA       HIS  52 -10.452   2.248  -0.167
  418    HB2  HIS  52           HB2      HIS  52 -12.534   4.158  -0.995
  419    HB3  HIS  52           HB3      HIS  52 -11.393   4.748   0.208
  420    HD1  HIS  52           HD1      HIS  52  -9.747   6.126  -1.028
  421    HD2  HIS  52           HD2      HIS  52 -10.642   2.600  -3.054
  422    HE1  HIS  52           HE1      HIS  52  -8.202   6.070  -3.006
  423    HE2  HIS  52           HE2      HIS  52  -8.636   3.852  -4.107
  424    H    HIS  53           H        HIS  53 -13.651   2.874   1.359
  425    HA   HIS  53           HA       HIS  53 -12.554   3.724   3.819
  426    HB2  HIS  53           HB2      HIS  53 -15.218   2.417   3.276
  427    HB3  HIS  53           HB3      HIS  53 -14.768   3.142   4.811
  428    HD1  HIS  53           HD1      HIS  53 -13.663   5.802   4.065
  429    HD2  HIS  53           HD2      HIS  53 -16.933   4.104   2.135
  430    HE1  HIS  53           HE1      HIS  53 -14.872   7.718   2.989
  431    HE2  HIS  53           HE2      HIS  53 -16.739   6.656   1.681
  432    H    LEU  54           H        LEU  54 -12.970   0.569   2.500
  433    HA   LEU  54           HA       LEU  54 -12.933  -0.753   5.064
  434    HB2  LEU  54           HB2      LEU  54 -13.011  -1.728   2.224
  435    HB3  LEU  54           HB3      LEU  54 -12.804  -2.833   3.567
  436    HG   LEU  54           HG       LEU  54 -15.158  -0.960   3.294
  437   HD11  LEU  54          HD11      LEU  54 -15.205  -2.512   1.453
  438   HD12  LEU  54          HD12      LEU  54 -16.426  -2.974   2.640
  439   HD13  LEU  54          HD13      LEU  54 -14.909  -3.867   2.543
  440   HD21  LEU  54          HD21      LEU  54 -14.734  -3.381   5.048
  441   HD22  LEU  54          HD22      LEU  54 -16.167  -2.358   5.002
  442   HD23  LEU  54          HD23      LEU  54 -14.638  -1.704   5.585
  443    H    VAL  55           H        VAL  55 -10.711  -0.453   2.294
  444    HA   VAL  55           HA       VAL  55  -8.650  -1.943   3.596
  445    HB   VAL  55           HB       VAL  55  -7.202  -1.324   1.808
  446   HG11  VAL  55          HG11      VAL  55  -8.876  -2.954   1.235
  447   HG12  VAL  55          HG12      VAL  55  -8.557  -1.924  -0.159
  448   HG13  VAL  55          HG13      VAL  55 -10.016  -1.680   0.801
  449   HG21  VAL  55          HG21      VAL  55  -9.226   0.782   1.064
  450   HG22  VAL  55          HG22      VAL  55  -7.801   0.348   0.116
  451   HG23  VAL  55          HG23      VAL  55  -7.611   1.062   1.717
  452    H    GLN  56           H        GLN  56  -9.675   1.344   3.612
  453    HA   GLN  56           HA       GLN  56  -7.295   2.359   4.860
  454    HB2  GLN  56           HB2      GLN  56  -9.986   3.469   4.179
  455    HB3  GLN  56           HB3      GLN  56  -8.951   4.344   5.286
  456    HG2  GLN  56           HG2      GLN  56  -7.190   4.400   3.570
  457    HG3  GLN  56           HG3      GLN  56  -8.271   3.556   2.464
  458   HE21  GLN  56          HE21      GLN  56 -10.056   4.634   1.641
  459   HE22  GLN  56          HE22      GLN  56 -10.184   6.358   1.658
  460    H    MET  57           H        MET  57 -10.117   0.735   5.910
  461    HA   MET  57           HA       MET  57 -10.027   1.810   8.590
  462    HB2  MET  57           HB2      MET  57 -12.119   0.946   7.339
  463    HB3  MET  57           HB3      MET  57 -11.546  -0.654   7.788
  464    HG2  MET  57           HG2      MET  57 -11.624  -0.015  10.149
  465    HG3  MET  57           HG3      MET  57 -12.211   1.581   9.691
  466    HE1  MET  57           HE1      MET  57 -14.488   1.867   8.219
  467    HE2  MET  57           HE2      MET  57 -15.677   0.581   8.013
  468    HE3  MET  57           HE3      MET  57 -14.138   0.503   7.157
  469    H    GLY  58           H        GLY  58  -8.270  -0.436   6.880
  470    HA2  GLY  58           HA2      GLY  58  -6.416  -1.599   7.685
  471    HA3  GLY  58           HA3      GLY  58  -6.993  -1.338   9.323
  472    H    LEU  59           H        LEU  59  -9.596  -2.442   7.697
  473    HA   LEU  59           HA       LEU  59  -9.239  -5.094   8.804
  474    HB2  LEU  59           HB2      LEU  59 -11.629  -5.412   8.153
  475    HB3  LEU  59           HB3      LEU  59 -11.333  -4.111   9.287
  476    HG   LEU  59           HG       LEU  59 -11.365  -2.593   7.175
  477   HD11  LEU  59          HD11      LEU  59 -11.380  -4.405   5.540
  478   HD12  LEU  59          HD12      LEU  59 -12.813  -3.387   5.407
  479   HD13  LEU  59          HD13      LEU  59 -12.924  -4.967   6.183
  480   HD21  LEU  59          HD21      LEU  59 -13.783  -2.338   7.400
  481   HD22  LEU  59          HD22      LEU  59 -12.991  -2.498   8.967
  482   HD23  LEU  59          HD23      LEU  59 -13.857  -3.868   8.272
  483    H    ALA  60           H        ALA  60  -9.140  -3.532   5.748
  484    HA   ALA  60           HA       ALA  60  -8.847  -6.169   4.453
  485    HB1  ALA  60           HB1      ALA  60  -9.228  -4.955   2.311
  486    HB2  ALA  60           HB2      ALA  60  -9.601  -3.509   3.249
  487    HB3  ALA  60           HB3      ALA  60 -10.617  -4.943   3.399
  488    H    ASP  61           H        ASP  61  -7.219  -6.235   2.707
  489    HA   ASP  61           HA       ASP  61  -4.709  -5.267   3.655
  490    HB2  ASP  61           HB2      ASP  61  -4.900  -7.414   2.477
  491    HB3  ASP  61           HB3      ASP  61  -5.436  -6.574   1.024
  492    H    SER  62           H        SER  62  -6.286  -4.789   0.501
  493    HA   SER  62           HA       SER  62  -5.729  -1.997   0.448
  494    HB2  SER  62           HB2      SER  62  -4.150  -2.090  -1.438
  495    HB3  SER  62           HB3      SER  62  -3.476  -2.791   0.028
  496    HG   SER  62           HG       SER  62  -3.661  -4.788  -0.810
  497    H    VAL  63           H        VAL  63  -5.945  -1.267  -1.999
  498    HA   VAL  63           HA       VAL  63  -8.601  -1.728  -2.705
  499    HB   VAL  63           HB       VAL  63  -6.283  -0.374  -4.013
  500   HG11  VAL  63          HG11      VAL  63  -7.305  -1.474  -5.923
  501   HG12  VAL  63          HG12      VAL  63  -7.678   0.249  -5.954
  502   HG13  VAL  63          HG13      VAL  63  -8.900  -0.907  -5.424
  503   HG21  VAL  63          HG21      VAL  63  -9.069   0.508  -3.281
  504   HG22  VAL  63          HG22      VAL  63  -7.781   1.549  -3.892
  505   HG23  VAL  63          HG23      VAL  63  -7.612   0.766  -2.319
  506    H    LYS  64           H        LYS  64  -5.636  -3.236  -3.764
  507    HA   LYS  64           HA       LYS  64  -6.615  -4.411  -6.119
  508    HB2  LYS  64           HB2      LYS  64  -4.281  -5.089  -4.364
  509    HB3  LYS  64           HB3      LYS  64  -4.618  -5.935  -5.844
  510    HG2  LYS  64           HG2      LYS  64  -3.072  -4.414  -6.564
  511    HG3  LYS  64           HG3      LYS  64  -4.570  -3.555  -6.899
  512    HD2  LYS  64           HD2      LYS  64  -2.866  -2.107  -5.869
  513    HD3  LYS  64           HD3      LYS  64  -4.315  -2.247  -4.874
  514    HE2  LYS  64           HE2      LYS  64  -2.195  -2.367  -3.585
  515    HE3  LYS  64           HE3      LYS  64  -3.220  -3.783  -3.387
  516    HZ1  LYS  64           HZ1      LYS  64  -0.839  -4.301  -3.691
  517    HZ2  LYS  64           HZ2      LYS  64  -0.910  -3.652  -5.250
  518    HZ3  LYS  64           HZ3      LYS  64  -1.822  -5.016  -4.861
  519    H    ASP  65           H        ASP  65  -7.102  -5.253  -2.841
  520    HA   ASP  65           HA       ASP  65  -7.507  -8.060  -3.236
  521    HB2  ASP  65           HB2      ASP  65  -6.918  -7.119  -1.031
  522    HB3  ASP  65           HB3      ASP  65  -8.456  -6.265  -0.989
  523    H    PHE  66           H        PHE  66  -9.490  -5.190  -3.367
  524    HA   PHE  66           HA       PHE  66 -11.944  -6.710  -3.811
  525    HB2  PHE  66           HB2      PHE  66 -11.431  -3.722  -3.930
  526    HB3  PHE  66           HB3      PHE  66 -13.005  -4.493  -4.019
  527    HD1  PHE  66           HD1      PHE  66 -10.055  -4.654  -1.741
  528    HD2  PHE  66           HD2      PHE  66 -14.265  -4.211  -2.135
  529    HE1  PHE  66           HE1      PHE  66 -10.259  -4.434   0.691
  530    HE2  PHE  66           HE2      PHE  66 -14.475  -4.007   0.294
  531    HZ   PHE  66           HZ       PHE  66 -12.467  -4.108   1.717
  532    H    GLN  67           H        GLN  67  -9.840  -4.416  -5.420
  533    HA   GLN  67           HA       GLN  67 -10.506  -5.492  -8.047
  534    HB2  GLN  67           HB2      GLN  67 -10.766  -2.583  -7.232
  535    HB3  GLN  67           HB3      GLN  67 -10.695  -3.120  -8.911
  536    HG2  GLN  67           HG2      GLN  67 -12.730  -4.499  -8.473
  537    HG3  GLN  67           HG3      GLN  67 -12.826  -3.748  -6.878
  538   HE21  GLN  67          HE21      GLN  67 -14.789  -2.779  -7.303
  539   HE22  GLN  67          HE22      GLN  67 -14.965  -1.454  -8.392
  540    H    ARG  68           H        ARG  68  -8.523  -6.063  -8.771
  541    HA   ARG  68           HA       ARG  68  -6.121  -4.962  -7.832
  542    HB2  ARG  68           HB2      ARG  68  -6.259  -7.222  -8.781
  543    HB3  ARG  68           HB3      ARG  68  -6.618  -6.540 -10.360
  544    HG2  ARG  68           HG2      ARG  68  -4.448  -5.598 -10.543
  545    HG3  ARG  68           HG3      ARG  68  -4.083  -5.952  -8.854
  546    HD2  ARG  68           HD2      ARG  68  -4.602  -8.021 -10.988
  547    HD3  ARG  68           HD3      ARG  68  -3.006  -7.528 -10.420
  548    HE   ARG  68           HE       ARG  68  -4.741  -8.404  -8.307
  549   HH11  ARG  68          HH11      ARG  68  -2.542  -9.502 -10.794
  550   HH12  ARG  68          HH12      ARG  68  -2.099 -10.945  -9.940
  551   HH21  ARG  68          HH21      ARG  68  -4.163 -10.283  -7.174
  552   HH22  ARG  68          HH22      ARG  68  -3.021 -11.388  -7.869
  553    H    LYS  69           H        LYS  69  -6.539  -2.732  -8.035
  554    HA   LYS  69           HA       LYS  69  -6.594  -1.504 -10.611
  555    HB2  LYS  69           HB2      LYS  69  -7.325  -0.601  -8.215
  556    HB3  LYS  69           HB3      LYS  69  -5.656  -0.058  -8.169
  557    HG2  LYS  69           HG2      LYS  69  -7.614   0.654 -10.341
  558    HG3  LYS  69           HG3      LYS  69  -7.274   1.660  -8.935
  559    HD2  LYS  69           HD2      LYS  69  -4.914   1.793  -9.630
  560    HD3  LYS  69           HD3      LYS  69  -5.298   0.833 -11.062
  561    HE2  LYS  69           HE2      LYS  69  -6.857   2.554 -11.808
  562    HE3  LYS  69           HE3      LYS  69  -6.510   3.504 -10.366
  563    HZ1  LYS  69           HZ1      LYS  69  -5.264   4.360 -12.200
  564    HZ2  LYS  69           HZ2      LYS  69  -4.606   2.843 -12.541
  565    HZ3  LYS  69           HZ3      LYS  69  -4.183   3.643 -11.116
  566    H    GLY  70           H        GLY  70  -4.949  -2.129 -11.817
  567    HA2  GLY  70           HA2      GLY  70  -2.449  -2.855 -11.406
  568    HA3  GLY  70           HA3      GLY  70  -2.828  -1.738 -12.707
  569    H    THR  71           H        THR  71  -0.832  -2.244 -10.197
  570    HA   THR  71           HA       THR  71  -1.046   0.027  -8.615
  571    HB   THR  71           HB       THR  71   1.539  -0.661  -8.241
  572    HG1  THR  71           HG1      THR  71   1.908  -2.482  -9.275
  573   HG21  THR  71          HG21      THR  71  -0.978  -1.992  -7.231
  574   HG22  THR  71          HG22      THR  71  -0.175  -0.575  -6.547
  575   HG23  THR  71          HG23      THR  71   0.611  -2.156  -6.476
  576    H    HIS  72           H        HIS  72  -0.415   1.979  -8.732
  577    HA   HIS  72           HA       HIS  72   0.886   3.086 -11.017
  578    HB2  HIS  72           HB2      HIS  72   0.634   5.198  -9.857
  579    HB3  HIS  72           HB3      HIS  72  -0.845   4.274  -9.656
  580    HD1  HIS  72           HD1      HIS  72  -0.992   2.997  -7.221
  581    HD2  HIS  72           HD2      HIS  72   1.714   6.124  -7.562
  582    HE1  HIS  72           HE1      HIS  72  -0.326   3.587  -4.880
  583    HE2  HIS  72           HE2      HIS  72   0.976   5.714  -5.115
  584    H    ILE  73           H        ILE  73   2.499   1.102  -9.629
  585    HA   ILE  73           HA       ILE  73   4.259   2.373  -7.827
  586    HB   ILE  73           HB       ILE  73   4.239  -0.290  -9.119
  587   HG12  ILE  73          HG12      ILE  73   3.102   0.243  -6.950
  588   HG13  ILE  73          HG13      ILE  73   4.267  -1.081  -6.867
  589   HG21  ILE  73          HG21      ILE  73   6.499   0.075  -9.486
  590   HG22  ILE  73          HG22      ILE  73   6.458  -0.736  -7.918
  591   HG23  ILE  73          HG23      ILE  73   6.669   1.014  -8.007
  592   HD11  ILE  73          HD11      ILE  73   4.719   1.753  -5.965
  593   HD12  ILE  73          HD12      ILE  73   5.926   0.467  -5.936
  594   HD13  ILE  73          HD13      ILE  73   4.478   0.342  -4.936
  595    H    VAL  74           H        VAL  74   5.379   4.015  -8.456
  596    HA   VAL  74           HA       VAL  74   7.066   4.323 -10.602
  597    HB   VAL  74           HB       VAL  74   7.230   6.125  -9.197
  598   HG11  VAL  74          HG11      VAL  74   5.845   5.368  -7.428
  599   HG12  VAL  74          HG12      VAL  74   7.354   5.884  -6.676
  600   HG13  VAL  74          HG13      VAL  74   7.034   4.167  -6.921
  601   HG21  VAL  74          HG21      VAL  74   9.354   6.241  -8.111
  602   HG22  VAL  74          HG22      VAL  74   9.540   5.230  -9.544
  603   HG23  VAL  74          HG23      VAL  74   9.425   4.486  -7.946
  604    H    LEU  75           H        LEU  75   8.776   3.109 -11.330
  605    HA   LEU  75           HA       LEU  75   8.848   0.458 -10.643
  606    HB2  LEU  75           HB2      LEU  75  10.820   0.243 -12.023
  607    HB3  LEU  75           HB3      LEU  75   9.668   1.330 -12.771
  608    HG   LEU  75           HG       LEU  75  11.199   3.134 -11.502
  609   HD11  LEU  75          HD11      LEU  75  12.732   1.503 -10.563
  610   HD12  LEU  75          HD12      LEU  75  13.560   2.507 -11.753
  611   HD13  LEU  75          HD13      LEU  75  13.071   0.865 -12.172
  612   HD21  LEU  75          HD21      LEU  75  10.610   3.132 -13.867
  613   HD22  LEU  75          HD22      LEU  75  11.813   1.880 -14.174
  614   HD23  LEU  75          HD23      LEU  75  12.323   3.481 -13.639
  615    H    TRP  76           H        TRP  76   9.989  -0.842  -9.372
  616    HA   TRP  76           HA       TRP  76  11.905   0.395  -7.518
  617    HB2  TRP  76           HB2      TRP  76   9.551  -1.354  -6.980
  618    HB3  TRP  76           HB3      TRP  76  10.952  -1.504  -5.941
  619    HD1  TRP  76           HD1      TRP  76   7.974   0.670  -6.596
  620    HE1  TRP  76           HE1      TRP  76   7.885   2.553  -4.864
  621    HE3  TRP  76           HE3      TRP  76  12.602   0.049  -4.578
  622    HZ2  TRP  76           HZ2      TRP  76   9.604   3.634  -2.867
  623    HZ3  TRP  76           HZ3      TRP  76  13.315   1.564  -2.777
  624    HH2  TRP  76           HH2      TRP  76  11.849   3.302  -1.939
  625    H    THR  77           H        THR  77  13.706  -0.754  -7.051
  626    HA   THR  77           HA       THR  77  13.890  -3.526  -8.021
  627    HB   THR  77           HB       THR  77  16.288  -3.156  -8.434
  628    HG1  THR  77           HG1      THR  77  16.860  -0.764  -8.463
  629   HG21  THR  77          HG21      THR  77  14.559  -1.109  -9.826
  630   HG22  THR  77          HG22      THR  77  14.759  -2.792 -10.308
  631   HG23  THR  77          HG23      THR  77  16.126  -1.682 -10.396
  632    H    GLY  78           H        GLY  78  15.440  -4.836  -6.689
  633    HA2  GLY  78           HA2      GLY  78  14.994  -4.572  -3.933
  634    HA3  GLY  78           HA3      GLY  78  16.245  -5.571  -4.662
  635    H    ASP  79           H        ASP  79  17.595  -3.405  -5.966
  636    HA   ASP  79           HA       ASP  79  19.243  -2.498  -3.822
  637    HB2  ASP  79           HB2      ASP  79  19.200  -1.747  -6.753
  638    HB3  ASP  79           HB3      ASP  79  20.426  -1.208  -5.611
  639    H    GLN  80           H        GLN  80  16.590  -1.150  -5.652
  640    HA   GLN  80           HA       GLN  80  16.983   1.538  -4.730
  641    HB2  GLN  80           HB2      GLN  80  15.683   0.806  -6.827
  642    HB3  GLN  80           HB3      GLN  80  14.380   0.392  -5.724
  643    HG2  GLN  80           HG2      GLN  80  14.212   2.663  -4.972
  644    HG3  GLN  80           HG3      GLN  80  15.613   3.125  -5.941
  645   HE21  GLN  80          HE21      GLN  80  12.265   2.260  -5.970
  646   HE22  GLN  80          HE22      GLN  80  11.938   2.709  -7.610
  647    H    GLU  81           H        GLU  81  15.155  -1.273  -3.693
  648    HA   GLU  81           HA       GLU  81  13.518  -0.043  -1.783
  649    HB2  GLU  81           HB2      GLU  81  14.625  -2.847  -1.809
  650    HB3  GLU  81           HB3      GLU  81  13.336  -2.283  -0.748
  651    HG2  GLU  81           HG2      GLU  81  12.051  -1.664  -2.816
  652    HG3  GLU  81           HG3      GLU  81  13.284  -2.513  -3.744
  653    H    LEU  82           H        LEU  82  16.825  -1.231  -1.560
  654    HA   LEU  82           HA       LEU  82  16.963  -0.489   1.226
  655    HB2  LEU  82           HB2      LEU  82  19.275  -1.215   1.136
  656    HB3  LEU  82           HB3      LEU  82  18.207  -2.419   0.450
  657    HG   LEU  82           HG       LEU  82  18.900  -1.296  -1.828
  658   HD11  LEU  82          HD11      LEU  82  21.276  -0.683  -0.071
  659   HD12  LEU  82          HD12      LEU  82  20.205   0.511  -0.805
  660   HD13  LEU  82          HD13      LEU  82  21.203  -0.523  -1.827
  661   HD21  LEU  82          HD21      LEU  82  20.702  -2.941  -2.001
  662   HD22  LEU  82          HD22      LEU  82  19.274  -3.612  -1.216
  663   HD23  LEU  82          HD23      LEU  82  20.674  -3.148  -0.250
  664    H    GLU  83           H        GLU  83  17.574   0.992  -1.831
  665    HA   GLU  83           HA       GLU  83  19.391   2.987  -0.999
  666    HB2  GLU  83           HB2      GLU  83  18.953   2.441  -3.376
  667    HB3  GLU  83           HB3      GLU  83  17.346   3.132  -3.221
  668    HG2  GLU  83           HG2      GLU  83  18.209   5.310  -2.917
  669    HG3  GLU  83           HG3      GLU  83  19.851   4.708  -2.708
  670    H    LEU  84           H        LEU  84  15.864   3.184  -1.540
  671    HA   LEU  84           HA       LEU  84  15.663   5.739  -0.309
  672    HB2  LEU  84           HB2      LEU  84  14.026   4.897  -1.969
  673    HB3  LEU  84           HB3      LEU  84  13.478   3.710  -0.800
  674    HG   LEU  84           HG       LEU  84  12.574   5.421   0.630
  675   HD11  LEU  84          HD11      LEU  84  14.270   7.116   0.379
  676   HD12  LEU  84          HD12      LEU  84  12.687   7.798   0.012
  677   HD13  LEU  84          HD13      LEU  84  13.794   7.387  -1.296
  678   HD21  LEU  84          HD21      LEU  84  11.048   6.625  -1.055
  679   HD22  LEU  84          HD22      LEU  84  10.981   4.869  -0.972
  680   HD23  LEU  84          HD23      LEU  84  11.873   5.655  -2.275
  681    H    GLN  85           H        GLN  85  15.624   2.491   0.846
  682    HA   GLN  85           HA       GLN  85  14.444   2.813   3.362
  683    HB2  GLN  85           HB2      GLN  85  15.102   0.666   2.210
  684    HB3  GLN  85           HB3      GLN  85  16.764   1.010   2.650
  685    HG2  GLN  85           HG2      GLN  85  14.663   0.835   4.760
  686    HG3  GLN  85           HG3      GLN  85  15.354  -0.628   4.067
  687   HE21  GLN  85          HE21      GLN  85  17.614  -0.989   4.298
  688   HE22  GLN  85          HE22      GLN  85  18.480  -0.275   5.616
  689    H    ARG  86           H        ARG  86  17.884   2.974   2.435
  690    HA   ARG  86           HA       ARG  86  18.687   3.863   5.030
  691    HB2  ARG  86           HB2      ARG  86  20.236   3.993   2.445
  692    HB3  ARG  86           HB3      ARG  86  20.899   4.104   4.068
  693    HG2  ARG  86           HG2      ARG  86  19.952   1.766   4.438
  694    HG3  ARG  86           HG3      ARG  86  19.741   1.709   2.687
  695    HD2  ARG  86           HD2      ARG  86  21.852   0.697   3.265
  696    HD3  ARG  86           HD3      ARG  86  22.144   2.220   2.421
  697    HE   ARG  86           HE       ARG  86  22.162   2.169   5.350
  698   HH11  ARG  86          HH11      ARG  86  23.901   2.578   2.342
  699   HH12  ARG  86          HH12      ARG  86  25.284   3.303   3.098
  700   HH21  ARG  86          HH21      ARG  86  23.985   3.124   6.340
  701   HH22  ARG  86          HH22      ARG  86  25.333   3.606   5.359
  702    H    LEU  87           H        LEU  87  18.129   5.428   1.914
  703    HA   LEU  87           HA       LEU  87  18.945   8.027   2.458
  704    HB2  LEU  87           HB2      LEU  87  18.086   7.080   0.282
  705    HB3  LEU  87           HB3      LEU  87  16.466   7.220   0.928
  706    HG   LEU  87           HG       LEU  87  17.096   9.750   1.203
  707   HD11  LEU  87          HD11      LEU  87  19.465   9.436   0.557
  708   HD12  LEU  87          HD12      LEU  87  18.604  10.572  -0.486
  709   HD13  LEU  87          HD13      LEU  87  18.924   8.931  -1.048
  710   HD21  LEU  87          HD21      LEU  87  15.332   8.877  -0.218
  711   HD22  LEU  87          HD22      LEU  87  16.519   8.471  -1.457
  712   HD23  LEU  87          HD23      LEU  87  16.224  10.157  -1.039
  713    H    PHE  88           H        PHE  88  15.866   6.443   3.120
  714    HA   PHE  88           HA       PHE  88  14.478   8.479   4.361
  715    HB2  PHE  88           HB2      PHE  88  13.206   6.621   3.895
  716    HB3  PHE  88           HB3      PHE  88  14.443   5.502   4.433
  717    HD1  PHE  88           HD1      PHE  88  12.054   8.029   5.789
  718    HD2  PHE  88           HD2      PHE  88  14.154   4.379   6.379
  719    HE1  PHE  88           HE1      PHE  88  10.805   7.647   7.877
  720    HE2  PHE  88           HE2      PHE  88  12.915   3.990   8.458
  721    HZ   PHE  88           HZ       PHE  88  11.241   5.624   9.213
  722    H    GLU  89           H        GLU  89  16.456   5.960   6.015
  723    HA   GLU  89           HA       GLU  89  16.135   7.014   8.589
  724    HB2  GLU  89           HB2      GLU  89  18.527   5.522   7.516
  725    HB3  GLU  89           HB3      GLU  89  18.113   5.724   9.210
  726    HG2  GLU  89           HG2      GLU  89  15.948   4.526   8.664
  727    HG3  GLU  89           HG3      GLU  89  16.708   4.108   7.126
  728    H    GLU  90           H        GLU  90  18.672   7.543   6.207
  729    HA   GLU  90           HA       GLU  90  20.444   9.052   7.690
  730    HB2  GLU  90           HB2      GLU  90  19.765   8.876   4.790
  731    HB3  GLU  90           HB3      GLU  90  20.925  10.090   5.329
  732    HG2  GLU  90           HG2      GLU  90  21.142   7.121   5.796
  733    HG3  GLU  90           HG3      GLU  90  21.998   8.028   4.548
  734    H    PHE  91           H        PHE  91  17.495  10.123   6.049
  735    HA   PHE  91           HA       PHE  91  18.182  12.868   6.811
  736    HB2  PHE  91           HB2      PHE  91  16.346  11.814   4.674
  737    HB3  PHE  91           HB3      PHE  91  16.407  13.513   5.137
  738    HD1  PHE  91           HD1      PHE  91  17.708  11.086   2.961
  739    HD2  PHE  91           HD2      PHE  91  18.821  14.559   5.154
  740    HE1  PHE  91           HE1      PHE  91  19.628  11.413   1.460
  741    HE2  PHE  91           HE2      PHE  91  20.742  14.894   3.650
  742    HZ   PHE  91           HZ       PHE  91  21.149  13.317   1.802
  743    H    ARG  92           H        ARG  92  16.581  10.513   8.275
  744    HA   ARG  92           HA       ARG  92  14.189  11.881   9.085
  745    HB2  ARG  92           HB2      ARG  92  15.753   9.777  10.604
  746    HB3  ARG  92           HB3      ARG  92  14.116  10.306  10.964
  747    HG2  ARG  92           HG2      ARG  92  13.390   9.458   8.775
  748    HG3  ARG  92           HG3      ARG  92  15.034   8.885   8.491
  749    HD2  ARG  92           HD2      ARG  92  13.752   7.026   9.254
  750    HD3  ARG  92           HD3      ARG  92  14.818   7.505  10.571
  751    HE   ARG  92           HE       ARG  92  12.332   8.800  10.854
  752   HH11  ARG  92          HH11      ARG  92  13.819   5.647  11.209
  753   HH12  ARG  92          HH12      ARG  92  12.629   5.068  12.330
  754   HH21  ARG  92          HH21      ARG  92  10.762   8.033  12.344
  755   HH22  ARG  92          HH22      ARG  92  10.895   6.420  12.980
  756    H    ASP  93           H        ASP  93  17.434  12.298   9.598
  757    HA   ASP  93           HA       ASP  93  17.498  13.500  12.157
  758    HB2  ASP  93           HB2      ASP  93  19.419  12.585  10.771
  759    HB3  ASP  93           HB3      ASP  93  19.317  14.058   9.812
  760    H    SER  94           H        SER  94  16.246  14.468   9.159
  761    HA   SER  94           HA       SER  94  16.313  17.315   9.874
  762    HB2  SER  94           HB2      SER  94  17.188  16.601   7.613
  763    HB3  SER  94           HB3      SER  94  15.552  16.086   7.212
  764    HG   SER  94           HG       SER  94  16.434  18.713   7.835
  765    H    ASP  95           H        ASP  95  14.262  18.501   9.197
  766    HA   ASP  95           HA       ASP  95  12.109  17.455  10.698
  767    HB2  ASP  95           HB2      ASP  95  12.107  19.788   8.767
  768    HB3  ASP  95           HB3      ASP  95  10.893  19.464   9.999
  769    H    ASP  96           H        ASP  96  12.527  17.970   7.206
  770    HA   ASP  96           HA       ASP  96  10.271  16.127   6.774
  771    HB2  ASP  96           HB2      ASP  96   9.831  18.382   5.891
  772    HB3  ASP  96           HB3      ASP  96  11.303  18.301   4.933
  773    H    VAL  97           H        VAL  97  11.255  14.199   6.628
  774    HA   VAL  97           HA       VAL  97  13.803  13.840   5.455
  775    HB   VAL  97           HB       VAL  97  12.991  12.245   7.123
  776   HG11  VAL  97          HG11      VAL  97  10.637  12.143   6.570
  777   HG12  VAL  97          HG12      VAL  97  11.349  10.525   6.538
  778   HG13  VAL  97          HG13      VAL  97  11.015  11.373   5.027
  779   HG21  VAL  97          HG21      VAL  97  13.613  10.162   5.964
  780   HG22  VAL  97          HG22      VAL  97  14.711  11.498   5.628
  781   HG23  VAL  97          HG23      VAL  97  13.513  11.019   4.427
  782    H    LEU  98           H        LEU  98  10.515  13.558   4.201
  783    HA   LEU  98           HA       LEU  98  11.307  12.236   1.809
  784    HB2  LEU  98           HB2      LEU  98   8.776  13.747   2.408
  785    HB3  LEU  98           HB3      LEU  98   9.044  12.755   0.989
  786    HG   LEU  98           HG       LEU  98   9.575  10.959   2.927
  787   HD11  LEU  98          HD11      LEU  98   7.851  11.176   4.660
  788   HD12  LEU  98          HD12      LEU  98   7.460  12.784   4.048
  789   HD13  LEU  98          HD13      LEU  98   9.050  12.467   4.741
  790   HD21  LEU  98          HD21      LEU  98   6.860  11.633   1.809
  791   HD22  LEU  98          HD22      LEU  98   7.330  10.089   2.520
  792   HD23  LEU  98          HD23      LEU  98   8.091  10.641   1.027
  793    H    GLY  99           H        GLY  99  10.936  15.563   2.785
  794    HA2  GLY  99           HA2      GLY  99  11.115  16.802   0.274
  795    HA3  GLY  99           HA3      GLY  99  11.681  17.500   1.793
  796    H    HIS 100           H        HIS 100  13.672  15.782   2.508
  797    HA   HIS 100           HA       HIS 100  15.773  16.537   0.722
  798    HB2  HIS 100           HB2      HIS 100  15.691  14.903   3.248
  799    HB3  HIS 100           HB3      HIS 100  17.160  15.018   2.283
  800    HD1  HIS 100           HD1      HIS 100  18.605  17.023   2.662
  801    HD2  HIS 100           HD2      HIS 100  14.793  17.499   4.256
  802    HE1  HIS 100           HE1      HIS 100  18.678  19.172   3.961
  803    HE2  HIS 100           HE2      HIS 100  16.392  19.390   5.001
  804    H    ILE 101           H        ILE 101  14.002  13.582   1.421
  805    HA   ILE 101           HA       ILE 101  15.439  11.714   0.008
  806    HB   ILE 101           HB       ILE 101  12.486  12.060   0.392
  807   HG12  ILE 101          HG12      ILE 101  14.438   9.961   1.362
  808   HG13  ILE 101          HG13      ILE 101  13.896  11.347   2.300
  809   HG21  ILE 101          HG21      ILE 101  13.802   9.836  -1.146
  810   HG22  ILE 101          HG22      ILE 101  12.634  11.008  -1.757
  811   HG23  ILE 101          HG23      ILE 101  12.139   9.808  -0.563
  812   HD11  ILE 101          HD11      ILE 101  12.031   9.240   1.247
  813   HD12  ILE 101          HD12      ILE 101  11.693  10.488   2.443
  814   HD13  ILE 101          HD13      ILE 101  12.790   9.167   2.835
  815    H    MET 102           H        MET 102  12.786  13.702  -1.317
  816    HA   MET 102           HA       MET 102  13.015  12.805  -3.947
  817    HB2  MET 102           HB2      MET 102  11.999  15.424  -2.857
  818    HB3  MET 102           HB3      MET 102  11.833  14.939  -4.540
  819    HG2  MET 102           HG2      MET 102  10.571  12.955  -3.811
  820    HG3  MET 102           HG3      MET 102  10.677  13.529  -2.148
  821    HE1  MET 102           HE1      MET 102   8.051  12.774  -3.839
  822    HE2  MET 102           HE2      MET 102   6.936  14.032  -3.302
  823    HE3  MET 102           HE3      MET 102   7.991  13.230  -2.138
  824    H    LYS 103           H        LYS 103  14.653  15.453  -2.311
  825    HA   LYS 103           HA       LYS 103  15.712  16.524  -4.763
  826    HB2  LYS 103           HB2      LYS 103  16.375  17.169  -1.885
  827    HB3  LYS 103           HB3      LYS 103  16.957  18.067  -3.277
  828    HG2  LYS 103           HG2      LYS 103  14.080  17.779  -2.434
  829    HG3  LYS 103           HG3      LYS 103  15.093  19.207  -2.217
  830    HD2  LYS 103           HD2      LYS 103  15.312  19.417  -4.646
  831    HD3  LYS 103           HD3      LYS 103  14.310  17.983  -4.864
  832    HE2  LYS 103           HE2      LYS 103  12.970  19.961  -5.205
  833    HE3  LYS 103           HE3      LYS 103  12.452  19.143  -3.732
  834    HZ1  LYS 103           HZ1      LYS 103  12.594  21.543  -3.440
  835    HZ2  LYS 103           HZ2      LYS 103  14.236  21.516  -3.836
  836    HZ3  LYS 103           HZ3      LYS 103  13.692  20.745  -2.435
  837    H    ASN 104           H        ASN 104  16.727  14.186  -2.427
  838    HA   ASN 104           HA       ASN 104  19.481  14.317  -3.455
  839    HB2  ASN 104           HB2      ASN 104  18.445  13.228  -0.834
  840    HB3  ASN 104           HB3      ASN 104  20.124  13.148  -1.356
  841   HD21  ASN 104          HD21      ASN 104  20.177  15.773  -2.561
  842   HD22  ASN 104          HD22      ASN 104  20.138  16.912  -1.262
  843    H    ILE 105           H        ILE 105  16.788  12.582  -4.060
  844    HA   ILE 105           HA       ILE 105  18.323  10.094  -4.380
  845    HB   ILE 105           HB       ILE 105  16.173   9.938  -3.077
  846   HG12  ILE 105          HG12      ILE 105  16.294   8.257  -5.578
  847   HG13  ILE 105          HG13      ILE 105  17.303   8.014  -4.165
  848   HG21  ILE 105          HG21      ILE 105  14.776  11.423  -4.397
  849   HG22  ILE 105          HG22      ILE 105  14.074   9.805  -4.362
  850   HG23  ILE 105          HG23      ILE 105  14.939  10.358  -5.793
  851   HD11  ILE 105          HD11      ILE 105  14.312   7.769  -4.266
  852   HD12  ILE 105          HD12      ILE 105  15.307   7.559  -2.827
  853   HD13  ILE 105          HD13      ILE 105  15.473   6.442  -4.181
  854    H    THR 106           H        THR 106  17.984   8.856  -6.276
  855    HA   THR 106           HA       THR 106  18.258  10.450  -8.626
  856    HB   THR 106           HB       THR 106  19.559   8.376  -8.039
  857    HG1  THR 106           HG1      THR 106  18.364   7.924 -10.552
  858   HG21  THR 106          HG21      THR 106  17.735   6.950  -7.304
  859   HG22  THR 106          HG22      THR 106  18.582   6.203  -8.659
  860   HG23  THR 106          HG23      THR 106  17.024   6.988  -8.918
  861    H    ALA 107           H        ALA 107  15.646   8.846  -7.078
  862    HA   ALA 107           HA       ALA 107  14.150   8.585  -9.593
  863    HB1  ALA 107           HB1      ALA 107  14.196   6.619  -8.142
  864    HB2  ALA 107           HB2      ALA 107  12.556   7.250  -8.302
  865    HB3  ALA 107           HB3      ALA 107  13.481   7.562  -6.833
  866    H    LYS 108           H        LYS 108  12.592   9.990 -10.131
  867    HA   LYS 108           HA       LYS 108  11.833  12.012  -8.159
  868    HB2  LYS 108           HB2      LYS 108  11.137  11.977 -11.095
  869    HB3  LYS 108           HB3      LYS 108  11.080  13.347  -9.998
  870    HG2  LYS 108           HG2      LYS 108  13.659  11.964 -10.641
  871    HG3  LYS 108           HG3      LYS 108  12.999  13.216 -11.687
  872    HD2  LYS 108           HD2      LYS 108  14.486  14.360 -10.303
  873    HD3  LYS 108           HD3      LYS 108  12.918  14.669  -9.573
  874    HE2  LYS 108           HE2      LYS 108  13.331  13.184  -7.800
  875    HE3  LYS 108           HE3      LYS 108  14.685  12.427  -8.638
  876    HZ1  LYS 108           HZ1      LYS 108  14.647  15.229  -7.669
  877    HZ2  LYS 108           HZ2      LYS 108  15.965  14.420  -8.351
  878    HZ3  LYS 108           HZ3      LYS 108  15.366  13.941  -6.843
  879    H    ARG 109           H        ARG 109  10.208  11.321  -6.930
  880    HA   ARG 109           HA       ARG 109   7.830  10.257  -8.286
  881    HB2  ARG 109           HB2      ARG 109   7.659   8.584  -6.354
  882    HB3  ARG 109           HB3      ARG 109   8.841   8.257  -7.615
  883    HG2  ARG 109           HG2      ARG 109  10.560   9.342  -6.149
  884    HG3  ARG 109           HG3      ARG 109   9.343   9.366  -4.870
  885    HD2  ARG 109           HD2      ARG 109  10.060   6.849  -6.325
  886    HD3  ARG 109           HD3      ARG 109  10.977   7.403  -4.924
  887    HE   ARG 109           HE       ARG 109   8.540   7.393  -3.926
  888   HH11  ARG 109          HH11      ARG 109  10.049   5.143  -6.092
  889   HH12  ARG 109          HH12      ARG 109   9.305   3.739  -5.404
  890   HH21  ARG 109          HH21      ARG 109   7.528   5.565  -2.955
  891   HH22  ARG 109          HH22      ARG 109   7.869   3.988  -3.575
  892    H    SER 110           H        SER 110   6.157   9.772  -6.337
  893    HA   SER 110           HA       SER 110   5.660  12.444  -5.283
  894    HB2  SER 110           HB2      SER 110   3.322  11.509  -4.995
  895    HB3  SER 110           HB3      SER 110   3.898  11.594  -6.660
  896    HG   SER 110           HG       SER 110   3.493   9.544  -6.740
  897    H    ARG 111           H        ARG 111   4.546  12.623  -3.192
  898    HA   ARG 111           HA       ARG 111   5.970  11.399  -1.088
  899    HB2  ARG 111           HB2      ARG 111   3.362  12.932  -1.103
  900    HB3  ARG 111           HB3      ARG 111   4.177  12.419   0.367
  901    HG2  ARG 111           HG2      ARG 111   5.497  14.157  -1.692
  902    HG3  ARG 111           HG3      ARG 111   4.548  14.805  -0.354
  903    HD2  ARG 111           HD2      ARG 111   6.034  13.811   1.253
  904    HD3  ARG 111           HD3      ARG 111   6.913  12.969  -0.023
  905    HE   ARG 111           HE       ARG 111   7.525  15.262  -0.836
  906   HH11  ARG 111          HH11      ARG 111   6.854  14.643   2.549
  907   HH12  ARG 111          HH12      ARG 111   7.841  15.955   3.114
  908   HH21  ARG 111          HH21      ARG 111   8.754  17.047  -0.078
  909   HH22  ARG 111          HH22      ARG 111   8.874  17.339   1.637
  910    H    ALA 112           H        ALA 112   2.754  10.833  -2.427
  911    HA   ALA 112           HA       ALA 112   1.777   9.090  -0.482
  912    HB1  ALA 112           HB1      ALA 112   1.087   9.152  -3.415
  913    HB2  ALA 112           HB2      ALA 112   0.378  10.180  -2.169
  914    HB3  ALA 112           HB3      ALA 112   0.116   8.437  -2.131
  915    H    ARG 113           H        ARG 113   3.914   8.491  -3.175
  916    HA   ARG 113           HA       ARG 113   3.598   5.628  -2.989
  917    HB2  ARG 113           HB2      ARG 113   4.916   7.505  -4.806
  918    HB3  ARG 113           HB3      ARG 113   5.822   6.022  -4.537
  919    HG2  ARG 113           HG2      ARG 113   2.916   5.993  -5.275
  920    HG3  ARG 113           HG3      ARG 113   4.195   6.067  -6.488
  921    HD2  ARG 113           HD2      ARG 113   3.627   3.780  -6.251
  922    HD3  ARG 113           HD3      ARG 113   5.177   4.006  -5.434
  923    HE   ARG 113           HE       ARG 113   2.610   3.902  -3.950
  924   HH11  ARG 113          HH11      ARG 113   5.950   2.946  -4.292
  925   HH12  ARG 113          HH12      ARG 113   5.900   1.809  -2.991
  926   HH21  ARG 113          HH21      ARG 113   2.529   2.375  -2.221
  927   HH22  ARG 113          HH22      ARG 113   3.968   1.486  -1.824
  928    H    ILE 114           H        ILE 114   5.834   8.045  -1.809
  929    HA   ILE 114           HA       ILE 114   7.824   6.133  -1.021
  930    HB   ILE 114           HB       ILE 114   7.431   9.020  -0.230
  931   HG12  ILE 114          HG12      ILE 114   9.450   7.775  -2.105
  932   HG13  ILE 114          HG13      ILE 114   7.926   8.471  -2.645
  933   HG21  ILE 114          HG21      ILE 114   8.687   7.891   1.503
  934   HG22  ILE 114          HG22      ILE 114   9.783   8.897   0.554
  935   HG23  ILE 114          HG23      ILE 114   9.744   7.153   0.302
  936   HD11  ILE 114          HD11      ILE 114  10.149   9.932  -1.228
  937   HD12  ILE 114          HD12      ILE 114   8.612  10.649  -1.714
  938   HD13  ILE 114          HD13      ILE 114   9.738  10.055  -2.937
  939    H    VAL 115           H        VAL 115   5.323   8.013   0.669
  940    HA   VAL 115           HA       VAL 115   5.854   7.014   3.241
  941    HB   VAL 115           HB       VAL 115   3.666   7.816   3.888
  942   HG11  VAL 115          HG11      VAL 115   5.397   9.485   3.570
  943   HG12  VAL 115          HG12      VAL 115   3.821  10.145   3.133
  944   HG13  VAL 115          HG13      VAL 115   4.950   9.649   1.873
  945   HG21  VAL 115          HG21      VAL 115   2.348   6.969   2.013
  946   HG22  VAL 115          HG22      VAL 115   3.082   8.172   0.952
  947   HG23  VAL 115          HG23      VAL 115   2.045   8.684   2.284
  948    H    ASP 116           H        ASP 116   3.907   5.806   0.604
  949    HA   ASP 116           HA       ASP 116   2.539   3.776   2.048
  950    HB2  ASP 116           HB2      ASP 116   1.947   4.863  -0.205
  951    HB3  ASP 116           HB3      ASP 116   3.127   3.772  -0.909
  952    H    LYS 117           H        LYS 117   5.563   3.949   0.296
  953    HA   LYS 117           HA       LYS 117   6.044   1.144   0.188
  954    HB2  LYS 117           HB2      LYS 117   7.108   2.772  -1.351
  955    HB3  LYS 117           HB3      LYS 117   8.018   3.432  -0.002
  956    HG2  LYS 117           HG2      LYS 117   9.508   2.018  -1.113
  957    HG3  LYS 117           HG3      LYS 117   8.982   1.109   0.301
  958    HD2  LYS 117           HD2      LYS 117   7.357  -0.105  -1.107
  959    HD3  LYS 117           HD3      LYS 117   7.945   0.787  -2.520
  960    HE2  LYS 117           HE2      LYS 117  10.140  -0.181  -2.271
  961    HE3  LYS 117           HE3      LYS 117   9.670  -0.965  -0.769
  962    HZ1  LYS 117           HZ1      LYS 117   8.635  -1.579  -3.483
  963    HZ2  LYS 117           HZ2      LYS 117   8.035  -2.259  -2.059
  964    HZ3  LYS 117           HZ3      LYS 117   9.631  -2.564  -2.526
  965    H    LEU 118           H        LEU 118   6.915   3.733   2.432
  966    HA   LEU 118           HA       LEU 118   8.757   2.343   4.018
  967    HB2  LEU 118           HB2      LEU 118   6.778   4.435   4.896
  968    HB3  LEU 118           HB3      LEU 118   8.162   3.903   5.820
  969    HG   LEU 118           HG       LEU 118   8.119   5.580   3.331
  970   HD11  LEU 118          HD11      LEU 118   9.243   5.898   6.109
  971   HD12  LEU 118          HD12      LEU 118   7.816   6.700   5.450
  972   HD13  LEU 118          HD13      LEU 118   9.414   7.074   4.801
  973   HD21  LEU 118          HD21      LEU 118  10.543   4.324   4.618
  974   HD22  LEU 118          HD22      LEU 118  10.541   5.466   3.273
  975   HD23  LEU 118          HD23      LEU 118   9.862   3.852   3.060
  976    H    LEU 119           H        LEU 119   5.251   2.676   4.330
  977    HA   LEU 119           HA       LEU 119   5.020   1.212   6.735
  978    HB2  LEU 119           HB2      LEU 119   3.121   2.054   4.586
  979    HB3  LEU 119           HB3      LEU 119   2.585   0.932   5.820
  980    HG   LEU 119           HG       LEU 119   1.939   3.228   6.367
  981   HD11  LEU 119          HD11      LEU 119   2.760   3.271   8.647
  982   HD12  LEU 119          HD12      LEU 119   4.050   2.147   8.223
  983   HD13  LEU 119          HD13      LEU 119   2.368   1.623   8.159
  984   HD21  LEU 119          HD21      LEU 119   4.906   3.773   6.395
  985   HD22  LEU 119          HD22      LEU 119   3.689   4.852   7.073
  986   HD23  LEU 119          HD23      LEU 119   3.698   4.510   5.340
  987    H    ALA 120           H        ALA 120   5.216   0.310   3.421
  988    HA   ALA 120           HA       ALA 120   4.145  -2.330   3.733
  989    HB1  ALA 120           HB1      ALA 120   4.101  -1.020   1.623
  990    HB2  ALA 120           HB2      ALA 120   4.769  -2.646   1.440
  991    HB3  ALA 120           HB3      ALA 120   5.846  -1.248   1.494
  992    H    LEU 121           H        LEU 121   7.347  -0.876   3.668
  993    HA   LEU 121           HA       LEU 121   8.767  -3.327   4.119
  994    HB2  LEU 121           HB2      LEU 121   9.395  -0.412   4.161
  995    HB3  LEU 121           HB3      LEU 121  10.510  -1.516   4.937
  996    HG   LEU 121           HG       LEU 121  10.911  -2.647   2.848
  997   HD11  LEU 121          HD11      LEU 121   9.029  -0.697   1.550
  998   HD12  LEU 121          HD12      LEU 121   8.625  -2.373   1.918
  999   HD13  LEU 121          HD13      LEU 121   9.917  -2.010   0.775
 1000   HD21  LEU 121          HD21      LEU 121  12.238  -0.680   3.373
 1001   HD22  LEU 121          HD22      LEU 121  11.043   0.351   2.588
 1002   HD23  LEU 121          HD23      LEU 121  11.978  -0.802   1.631
 1003    H    GLY 122           H        GLY 122   7.058  -1.054   6.045
 1004    HA2  GLY 122           HA2      GLY 122   6.681  -0.943   8.311
 1005    HA3  GLY 122           HA3      GLY 122   7.621  -2.421   8.503
 1006    H    LEU 123           H        LEU 123   8.716   0.503   6.905
 1007    HA   LEU 123           HA       LEU 123  11.027   0.691   8.595
 1008    HB2  LEU 123           HB2      LEU 123   9.933   2.553   6.485
 1009    HB3  LEU 123           HB3      LEU 123  11.475   2.769   7.294
 1010    HG   LEU 123           HG       LEU 123  10.694   0.567   5.393
 1011   HD11  LEU 123          HD11      LEU 123  12.751   2.760   5.309
 1012   HD12  LEU 123          HD12      LEU 123  11.331   2.577   4.278
 1013   HD13  LEU 123          HD13      LEU 123  12.665   1.435   4.151
 1014   HD21  LEU 123          HD21      LEU 123  13.184   0.814   7.071
 1015   HD22  LEU 123          HD22      LEU 123  12.968  -0.322   5.742
 1016   HD23  LEU 123          HD23      LEU 123  11.959  -0.449   7.183
 1017    H    VAL 124           H        VAL 124   7.877   1.882   8.485
 1018    HA   VAL 124           HA       VAL 124   8.188   3.145  11.090
 1019    HB   VAL 124           HB       VAL 124   6.673   5.015  10.379
 1020   HG11  VAL 124          HG11      VAL 124   9.353   4.911   9.001
 1021   HG12  VAL 124          HG12      VAL 124   9.065   5.397  10.673
 1022   HG13  VAL 124          HG13      VAL 124   8.430   6.372   9.347
 1023   HG21  VAL 124          HG21      VAL 124   7.249   3.821   7.688
 1024   HG22  VAL 124          HG22      VAL 124   6.781   5.504   7.872
 1025   HG23  VAL 124          HG23      VAL 124   5.688   4.227   8.401
 1026    H    ALA 125           H        ALA 125   5.793   3.797  11.757
 1027    HA   ALA 125           HA       ALA 125   4.067   1.530  10.999
 1028    HB1  ALA 125           HB1      ALA 125   3.123   1.607  13.250
 1029    HB2  ALA 125           HB2      ALA 125   4.209   2.934  13.664
 1030    HB3  ALA 125           HB3      ALA 125   4.866   1.342  13.296
 1031    H    GLU 126           H        GLU 126   4.445   4.806  10.773
 1032    HA   GLU 126           HA       GLU 126   1.738   5.269   9.956
 1033    HB2  GLU 126           HB2      GLU 126   1.290   7.060  11.596
 1034    HB3  GLU 126           HB3      GLU 126   1.452   5.489  12.370
 1035    HG2  GLU 126           HG2      GLU 126   3.846   6.092  12.838
 1036    HG3  GLU 126           HG3      GLU 126   3.457   7.723  12.298
 1037    H    ARG 127           H        ARG 127   1.466   7.495   9.146
 1038    HA   ARG 127           HA       ARG 127   3.848   8.359   7.797
 1039    HB2  ARG 127           HB2      ARG 127   0.964   9.112   7.675
 1040    HB3  ARG 127           HB3      ARG 127   2.157  10.222   7.017
 1041    HG2  ARG 127           HG2      ARG 127   1.373   8.865   5.233
 1042    HG3  ARG 127           HG3      ARG 127   3.018   8.355   5.616
 1043    HD2  ARG 127           HD2      ARG 127   1.521   6.448   5.212
 1044    HD3  ARG 127           HD3      ARG 127   2.184   6.451   6.846
 1045    HE   ARG 127           HE       ARG 127  -0.286   7.758   6.908
 1046   HH11  ARG 127          HH11      ARG 127   0.937   4.555   6.219
 1047   HH12  ARG 127          HH12      ARG 127  -0.442   3.740   6.883
 1048   HH21  ARG 127          HH21      ARG 127  -2.120   6.688   7.761
 1049   HH22  ARG 127          HH22      ARG 127  -2.178   4.951   7.767
 1050    H    ARG 128           H        ARG 128   2.241   9.222  10.681
 1051    HA   ARG 128           HA       ARG 128   2.771  11.981  10.826
 1052    HB2  ARG 128           HB2      ARG 128   2.803  10.149  13.216
 1053    HB3  ARG 128           HB3      ARG 128   2.323  11.836  13.150
 1054    HG2  ARG 128           HG2      ARG 128   0.346  11.204  11.829
 1055    HG3  ARG 128           HG3      ARG 128   0.827   9.510  11.970
 1056    HD2  ARG 128           HD2      ARG 128   0.813   9.869  14.477
 1057    HD3  ARG 128           HD3      ARG 128  -0.021  11.386  14.150
 1058    HE   ARG 128           HE       ARG 128  -1.804  10.053  13.120
 1059   HH11  ARG 128          HH11      ARG 128   0.471   8.386  15.202
 1060   HH12  ARG 128          HH12      ARG 128  -0.667   7.159  15.666
 1061   HH21  ARG 128          HH21      ARG 128  -3.278   8.404  13.688
 1062   HH22  ARG 128          HH22      ARG 128  -2.795   7.169  14.803
 1063    H    GLU 129           H        GLU 129   4.763   9.207  11.331
 1064    HA   GLU 129           HA       GLU 129   6.766  10.596  12.862
 1065    HB2  GLU 129           HB2      GLU 129   6.671   7.807  11.714
 1066    HB3  GLU 129           HB3      GLU 129   7.934   8.412  12.775
 1067    HG2  GLU 129           HG2      GLU 129   5.013   8.183  13.462
 1068    HG3  GLU 129           HG3      GLU 129   6.289   7.086  13.994
 1069    H    LEU 130           H        LEU 130   6.048  10.409   9.608
 1070    HA   LEU 130           HA       LEU 130   8.828  10.445   8.738
 1071    HB2  LEU 130           HB2      LEU 130   6.791  11.078   6.731
 1072    HB3  LEU 130           HB3      LEU 130   8.106   9.926   6.669
 1073    HG   LEU 130           HG       LEU 130   5.430   9.456   7.988
 1074   HD11  LEU 130          HD11      LEU 130   6.575   8.476   5.382
 1075   HD12  LEU 130          HD12      LEU 130   5.209   9.572   5.597
 1076   HD13  LEU 130          HD13      LEU 130   5.082   7.891   6.113
 1077   HD21  LEU 130          HD21      LEU 130   7.228   8.166   9.055
 1078   HD22  LEU 130          HD22      LEU 130   7.688   7.515   7.477
 1079   HD23  LEU 130          HD23      LEU 130   6.103   7.136   8.162
 1080    H    TYR 131           H        TYR 131   6.490  12.596   9.800
 1081    HA   TYR 131           HA       TYR 131   7.928  14.878   8.600
 1082    HB2  TYR 131           HB2      TYR 131   5.048  14.955   9.487
 1083    HB3  TYR 131           HB3      TYR 131   5.911  16.154   8.533
 1084    HD1  TYR 131           HD1      TYR 131   6.485  15.632   6.144
 1085    HD2  TYR 131           HD2      TYR 131   3.963  13.121   8.475
 1086    HE1  TYR 131           HE1      TYR 131   5.635  14.581   4.088
 1087    HE2  TYR 131           HE2      TYR 131   3.108  12.064   6.432
 1088    HH   TYR 131           HH       TYR 131   2.918  12.414   4.114
 1089    H    LYS 132           H        LYS 132   9.306  14.708  10.486
 1090    HA   LYS 132           HA       LYS 132   8.023  15.646  12.957
 1091    HB2  LYS 132           HB2      LYS 132   9.697  13.244  12.475
 1092    HB3  LYS 132           HB3      LYS 132   9.942  14.094  13.992
 1093    HG2  LYS 132           HG2      LYS 132   7.340  12.954  12.995
 1094    HG3  LYS 132           HG3      LYS 132   8.375  12.254  14.240
 1095    HD2  LYS 132           HD2      LYS 132   8.079  14.397  15.531
 1096    HD3  LYS 132           HD3      LYS 132   6.843  14.845  14.355
 1097    HE2  LYS 132           HE2      LYS 132   6.822  12.407  16.125
 1098    HE3  LYS 132           HE3      LYS 132   5.841  13.856  16.339
 1099    HZ1  LYS 132           HZ1      LYS 132   5.235  11.593  14.855
 1100    HZ2  LYS 132           HZ2      LYS 132   5.481  12.839  13.731
 1101    HZ3  LYS 132           HZ3      LYS 132   4.339  13.029  14.967
 1102    H    LYS 133           H        LYS 133  10.088  15.954  14.587
 1103    HA   LYS 133           HA       LYS 133  12.238  17.297  13.098
 1104    HB2  LYS 133           HB2      LYS 133  11.245  17.749  15.904
 1105    HB3  LYS 133           HB3      LYS 133  12.786  18.359  15.322
 1106    HG2  LYS 133           HG2      LYS 133  11.558  19.622  13.564
 1107    HG3  LYS 133           HG3      LYS 133  10.043  19.094  14.298
 1108    HD2  LYS 133           HD2      LYS 133  12.166  20.578  15.831
 1109    HD3  LYS 133           HD3      LYS 133  10.878  21.400  14.951
 1110    HE2  LYS 133           HE2      LYS 133  10.406  19.322  17.082
 1111    HE3  LYS 133           HE3      LYS 133  10.430  21.057  17.389
 1112    HZ1  LYS 133           HZ1      LYS 133   8.581  19.693  15.509
 1113    HZ2  LYS 133           HZ2      LYS 133   8.576  21.337  15.896
 1114    HZ3  LYS 133           HZ3      LYS 133   8.178  20.191  17.074
 1115    H    ARG 134           H        ARG 134  14.348  17.180  14.407
 1116    HA   ARG 134           HA       ARG 134  15.061  14.546  14.998
 1117    HB2  ARG 134           HB2      ARG 134  16.639  16.432  14.458
 1118    HB3  ARG 134           HB3      ARG 134  16.382  17.037  16.089
 1119    HG2  ARG 134           HG2      ARG 134  18.454  15.715  15.835
 1120    HG3  ARG 134           HG3      ARG 134  17.342  15.054  17.038
 1121    HD2  ARG 134           HD2      ARG 134  16.546  13.418  15.461
 1122    HD3  ARG 134           HD3      ARG 134  17.536  14.121  14.184
 1123    HE   ARG 134           HE       ARG 134  19.176  13.381  16.352
 1124   HH11  ARG 134          HH11      ARG 134  17.284  11.898  13.801
 1125   HH12  ARG 134          HH12      ARG 134  18.294  10.493  13.702
 1126   HH21  ARG 134          HH21      ARG 134  20.493  11.539  16.223
 1127   HH22  ARG 134          HH22      ARG 134  20.114  10.284  15.088
 1128    H    GLN 135           H        GLN 135  13.310  13.856  16.305
 1129    HA   GLN 135           HA       GLN 135  12.660  14.866  18.835
 1130    HB2  GLN 135           HB2      GLN 135  12.433  12.003  17.897
 1131    HB3  GLN 135           HB3      GLN 135  11.544  12.741  19.219
 1132    HG2  GLN 135           HG2      GLN 135  10.494  14.271  17.560
 1133    HG3  GLN 135           HG3      GLN 135  11.283  13.343  16.287
 1134   HE21  GLN 135          HE21      GLN 135  10.584  11.243  15.863
 1135   HE22  GLN 135          HE22      GLN 135   9.082  10.629  16.460
 1136    H    LYS 136           H        LYS 136  12.918  13.670  20.888
 1137    HA   LYS 136           HA       LYS 136  15.534  13.101  21.679
 1138    HB2  LYS 136           HB2      LYS 136  14.517  12.082  23.673
 1139    HB3  LYS 136           HB3      LYS 136  13.755  13.616  23.280
 1140    HG2  LYS 136           HG2      LYS 136  11.847  12.493  22.351
 1141    HG3  LYS 136           HG3      LYS 136  12.631  10.924  22.535
 1142    HD2  LYS 136           HD2      LYS 136  12.675  11.270  24.979
 1143    HD3  LYS 136           HD3      LYS 136  11.807  12.789  24.758
 1144    HE2  LYS 136           HE2      LYS 136  10.778  10.095  23.882
 1145    HE3  LYS 136           HE3      LYS 136  10.365  10.867  25.412
 1146    HZ1  LYS 136           HZ1      LYS 136   8.667  11.249  23.755
 1147    HZ2  LYS 136           HZ2      LYS 136   9.792  11.962  22.711
 1148    HZ3  LYS 136           HZ3      LYS 136   9.407  12.709  24.178
 1149    H    LYS 137           H        LYS 137  16.155  10.848  22.621
 1150    HA   LYS 137           HA       LYS 137  16.149   9.072  20.393
 1151    HB2  LYS 137           HB2      LYS 137  17.703   7.723  21.567
 1152    HB3  LYS 137           HB3      LYS 137  18.108   9.387  21.928
 1153    HG2  LYS 137           HG2      LYS 137  16.627   7.514  23.768
 1154    HG3  LYS 137           HG3      LYS 137  18.344   7.892  23.859
 1155    HD2  LYS 137           HD2      LYS 137  17.788   9.527  25.263
 1156    HD3  LYS 137           HD3      LYS 137  17.091  10.371  23.884
 1157    HE2  LYS 137           HE2      LYS 137  14.919   9.475  24.337
 1158    HE3  LYS 137           HE3      LYS 137  15.571   8.368  25.547
 1159    HZ1  LYS 137           HZ1      LYS 137  16.127  10.241  26.943
 1160    HZ2  LYS 137           HZ2      LYS 137  14.482  10.298  26.548
 1161    HZ3  LYS 137           HZ3      LYS 137  15.575  11.330  25.775
 1162    H    LEU 138           H        LEU 138  13.998   8.540  20.065
 1163    HA   LEU 138           HA       LEU 138  13.111   6.358  21.802
 1164    HB2  LEU 138           HB2      LEU 138  10.982   7.151  22.139
 1165    HB3  LEU 138           HB3      LEU 138  11.894   8.644  22.181
 1166    HG   LEU 138           HG       LEU 138  10.239   7.612  19.860
 1167   HD11  LEU 138          HD11      LEU 138   8.823   9.548  20.361
 1168   HD12  LEU 138          HD12      LEU 138   9.834   9.922  21.757
 1169   HD13  LEU 138          HD13      LEU 138   8.907   8.424  21.717
 1170   HD21  LEU 138          HD21      LEU 138  10.691   9.781  18.810
 1171   HD22  LEU 138          HD22      LEU 138  12.179   8.868  19.048
 1172   HD23  LEU 138          HD23      LEU 138  11.782  10.202  20.131
 1173    H    ALA 139           H        ALA 139  11.365   5.063  20.674
 1174    HA   ALA 139           HA       ALA 139  12.147   4.766  17.867
 1175    HB1  ALA 139           HB1      ALA 139  12.286   2.760  19.250
 1176    HB2  ALA 139           HB2      ALA 139  11.051   2.573  18.006
 1177    HB3  ALA 139           HB3      ALA 139  10.579   2.917  19.671
 1178    H    SER 140           H        SER 140  10.769   5.253  16.223
 1179    HA   SER 140           HA       SER 140   8.309   6.534  16.651
 1180    HB2  SER 140           HB2      SER 140   8.002   5.620  14.129
 1181    HB3  SER 140           HB3      SER 140   9.023   7.002  14.523
 1182    HG   SER 140           HG       SER 140   9.786   4.322  14.025
 1183    H    SER 141           H        SER 141   6.553   5.646  17.525
 1184    HA   SER 141           HA       SER 141   6.495   2.708  17.592
 1185    HB2  SER 141           HB2      SER 141   7.149   4.081  19.679
 1186    HB3  SER 141           HB3      SER 141   5.446   4.535  19.750
 1187    HG   SER 141           HG       SER 141   4.886   2.502  20.225
  Start of MODEL   10
    1    H1   ASP   1           HT1      ASP   1 -22.923   9.198 -12.460
    2    H2   ASP   1           HT2      ASP   1 -22.830  10.476 -13.563
    3    H3   ASP   1           HT3      ASP   1 -23.180   8.915 -14.106
    4    HA   ASP   1           HA       ASP   1 -25.159  10.282 -14.063
    5    HB2  ASP   1           HB2      ASP   1 -26.573   8.723 -12.884
    6    HB3  ASP   1           HB3      ASP   1 -25.247   7.809 -13.595
    7    HA   PRO   2           HA       PRO   2 -25.491  13.075 -10.652
    8    HB2  PRO   2           HB2      PRO   2 -27.900  14.100 -11.083
    9    HB3  PRO   2           HB3      PRO   2 -26.619  14.277 -12.289
   10    HG2  PRO   2           HG2      PRO   2 -28.957  12.421 -12.264
   11    HG3  PRO   2           HG3      PRO   2 -28.222  13.282 -13.625
   12    HD2  PRO   2           HD2      PRO   2 -27.751  10.611 -12.917
   13    HD3  PRO   2           HD3      PRO   2 -26.765  11.587 -14.022
   14    H    SER   3           H        SER   3 -26.750  10.140 -10.331
   15    HA   SER   3           HA       SER   3 -28.738  10.729  -8.283
   16    HB2  SER   3           HB2      SER   3 -27.684   8.018  -9.121
   17    HB3  SER   3           HB3      SER   3 -29.174   8.365  -8.244
   18    HG   SER   3           HG       SER   3 -28.706   8.356 -10.913
   19    H    ARG   4           H        ARG   4 -25.443  10.545  -8.444
   20    HA   ARG   4           HA       ARG   4 -25.060   9.070  -5.978
   21    HB2  ARG   4           HB2      ARG   4 -22.965  10.523  -7.599
   22    HB3  ARG   4           HB3      ARG   4 -22.702   9.263  -6.401
   23    HG2  ARG   4           HG2      ARG   4 -24.084   8.898  -9.051
   24    HG3  ARG   4           HG3      ARG   4 -22.419   8.449  -8.688
   25    HD2  ARG   4           HD2      ARG   4 -23.123   6.785  -7.134
   26    HD3  ARG   4           HD3      ARG   4 -24.790   7.356  -7.184
   27    HE   ARG   4           HE       ARG   4 -24.210   6.676  -9.779
   28   HH11  ARG   4          HH11      ARG   4 -24.083   4.970  -6.713
   29   HH12  ARG   4          HH12      ARG   4 -24.543   3.447  -7.398
   30   HH21  ARG   4          HH21      ARG   4 -24.770   4.667 -10.678
   31   HH22  ARG   4          HH22      ARG   4 -24.910   3.268  -9.660
   32    H    ARG   5           H        ARG   5 -25.900  10.273  -4.372
   33    HA   ARG   5           HA       ARG   5 -24.792  12.941  -3.903
   34    HB2  ARG   5           HB2      ARG   5 -27.155  12.906  -3.575
   35    HB3  ARG   5           HB3      ARG   5 -27.083  11.402  -2.670
   36    HG2  ARG   5           HG2      ARG   5 -27.541  13.280  -1.205
   37    HG3  ARG   5           HG3      ARG   5 -25.977  12.559  -0.825
   38    HD2  ARG   5           HD2      ARG   5 -24.866  14.333  -2.110
   39    HD3  ARG   5           HD3      ARG   5 -26.437  15.065  -2.443
   40    HE   ARG   5           HE       ARG   5 -26.315  14.878   0.286
   41   HH11  ARG   5          HH11      ARG   5 -24.312  16.336  -2.184
   42   HH12  ARG   5          HH12      ARG   5 -23.775  17.632  -1.163
   43   HH21  ARG   5          HH21      ARG   5 -25.583  16.566   1.649
   44   HH22  ARG   5          HH22      ARG   5 -24.492  17.761   1.021
   45    H    ALA   6           H        ALA   6 -22.920  12.939  -2.850
   46    HA   ALA   6           HA       ALA   6 -22.235  10.651  -1.175
   47    HB1  ALA   6           HB1      ALA   6 -20.561  12.970  -2.080
   48    HB2  ALA   6           HB2      ALA   6 -20.604  11.372  -2.823
   49    HB3  ALA   6           HB3      ALA   6 -19.988  11.569  -1.182
   50    HA   PRO   7           HA       PRO   7 -22.778  13.378   2.338
   51    HB2  PRO   7           HB2      PRO   7 -24.284  11.829   3.793
   52    HB3  PRO   7           HB3      PRO   7 -24.901  12.425   2.241
   53    HG2  PRO   7           HG2      PRO   7 -23.805   9.723   2.901
   54    HG3  PRO   7           HG3      PRO   7 -25.228  10.146   1.929
   55    HD2  PRO   7           HD2      PRO   7 -22.611   9.649   0.972
   56    HD3  PRO   7           HD3      PRO   7 -23.968  10.330   0.050
   57    H    THR   8           H        THR   8 -22.412  12.781   4.778
   58    HA   THR   8           HA       THR   8 -19.805  11.580   4.939
   59    HB   THR   8           HB       THR   8 -20.132  12.176   7.435
   60    HG1  THR   8           HG1      THR   8 -21.754  13.808   7.721
   61   HG21  THR   8          HG21      THR   8 -18.716  13.412   5.863
   62   HG22  THR   8          HG22      THR   8 -19.548  14.507   6.971
   63   HG23  THR   8          HG23      THR   8 -20.123  14.323   5.313
   64    H    TRP   9           H        TRP   9 -19.258   9.968   6.547
   65    HA   TRP   9           HA       TRP   9 -21.218   7.822   6.461
   66    HB2  TRP   9           HB2      TRP   9 -18.270   7.926   7.052
   67    HB3  TRP   9           HB3      TRP   9 -19.227   6.480   7.354
   68    HD1  TRP   9           HD1      TRP   9 -17.993   8.689   4.468
   69    HE1  TRP   9           HE1      TRP   9 -18.144   7.329   2.294
   70    HE3  TRP   9           HE3      TRP   9 -20.348   4.534   6.275
   71    HZ2  TRP   9           HZ2      TRP   9 -19.134   4.814   1.452
   72    HZ3  TRP   9           HZ3      TRP   9 -20.860   2.695   4.721
   73    HH2  TRP   9           HH2      TRP   9 -20.265   2.836   2.360
   74    H    SER  10           H        SER  10 -22.318   7.103   8.137
   75    HA   SER  10           HA       SER  10 -21.827   8.228  10.770
   76    HB2  SER  10           HB2      SER  10 -23.951   7.073  11.363
   77    HB3  SER  10           HB3      SER  10 -24.140   8.141   9.973
   78    HG   SER  10           HG       SER  10 -24.883   6.443   8.990
   79    HA   PRO  11           HA       PRO  11 -19.678   4.707  12.462
   80    HB2  PRO  11           HB2      PRO  11 -21.713   4.645  14.632
   81    HB3  PRO  11           HB3      PRO  11 -19.952   4.749  14.739
   82    HG2  PRO  11           HG2      PRO  11 -21.469   6.885  15.214
   83    HG3  PRO  11           HG3      PRO  11 -19.925   7.031  14.354
   84    HD2  PRO  11           HD2      PRO  11 -22.711   7.078  13.270
   85    HD3  PRO  11           HD3      PRO  11 -21.294   8.026  12.776
   86    H    GLU  12           H        GLU  12 -23.073   4.676  11.908
   87    HA   GLU  12           HA       GLU  12 -23.430   1.832  12.264
   88    HB2  GLU  12           HB2      GLU  12 -25.327   3.769  10.938
   89    HB3  GLU  12           HB3      GLU  12 -25.717   2.260  11.759
   90    HG2  GLU  12           HG2      GLU  12 -25.188   3.209  13.890
   91    HG3  GLU  12           HG3      GLU  12 -24.558   4.671  13.136
   92    H    GLU  13           H        GLU  13 -23.372   4.148   9.587
   93    HA   GLU  13           HA       GLU  13 -23.811   2.283   7.517
   94    HB2  GLU  13           HB2      GLU  13 -24.000   4.867   7.521
   95    HB3  GLU  13           HB3      GLU  13 -22.277   4.850   7.179
   96    HG2  GLU  13           HG2      GLU  13 -22.657   3.623   5.137
   97    HG3  GLU  13           HG3      GLU  13 -24.381   3.510   5.493
   98    H    GLU  14           H        GLU  14 -20.867   3.581   8.995
   99    HA   GLU  14           HA       GLU  14 -19.039   2.337   7.217
  100    HB2  GLU  14           HB2      GLU  14 -18.624   3.176  10.092
  101    HB3  GLU  14           HB3      GLU  14 -17.350   2.793   8.944
  102    HG2  GLU  14           HG2      GLU  14 -18.142   4.672   7.531
  103    HG3  GLU  14           HG3      GLU  14 -19.276   5.093   8.814
  104    H    ALA  15           H        ALA  15 -20.526   1.303  10.261
  105    HA   ALA  15           HA       ALA  15 -18.976  -1.021  10.634
  106    HB1  ALA  15           HB1      ALA  15 -21.821  -0.536  11.508
  107    HB2  ALA  15           HB2      ALA  15 -20.381  -0.021  12.388
  108    HB3  ALA  15           HB3      ALA  15 -20.709  -1.739  12.162
  109    H    HIS  16           H        HIS  16 -21.898  -0.383   8.844
  110    HA   HIS  16           HA       HIS  16 -22.568  -2.977   8.086
  111    HB2  HIS  16           HB2      HIS  16 -23.903  -0.762   7.852
  112    HB3  HIS  16           HB3      HIS  16 -23.051  -0.587   6.324
  113    HD1  HIS  16           HD1      HIS  16 -26.087  -0.859   6.330
  114    HD2  HIS  16           HD2      HIS  16 -23.490  -4.082   5.975
  115    HE1  HIS  16           HE1      HIS  16 -27.402  -2.670   5.182
  116    HE2  HIS  16           HE2      HIS  16 -25.853  -4.654   5.102
  117    H    LEU  17           H        LEU  17 -20.209  -0.703   6.814
  118    HA   LEU  17           HA       LEU  17 -19.570  -1.972   4.400
  119    HB2  LEU  17           HB2      LEU  17 -17.856  -0.445   6.350
  120    HB3  LEU  17           HB3      LEU  17 -17.231  -1.061   4.835
  121    HG   LEU  17           HG       LEU  17 -19.489   0.924   5.077
  122   HD11  LEU  17          HD11      LEU  17 -17.863   2.572   4.327
  123   HD12  LEU  17          HD12      LEU  17 -16.598   1.343   4.325
  124   HD13  LEU  17          HD13      LEU  17 -17.343   1.837   5.844
  125   HD21  LEU  17          HD21      LEU  17 -19.074   1.224   2.656
  126   HD22  LEU  17          HD22      LEU  17 -19.653  -0.392   3.059
  127   HD23  LEU  17          HD23      LEU  17 -17.945  -0.128   2.710
  128    H    ARG  18           H        ARG  18 -17.881  -2.303   7.526
  129    HA   ARG  18           HA       ARG  18 -16.463  -4.611   6.734
  130    HB2  ARG  18           HB2      ARG  18 -15.958  -4.879   9.161
  131    HB3  ARG  18           HB3      ARG  18 -15.578  -3.288   8.525
  132    HG2  ARG  18           HG2      ARG  18 -17.691  -2.441   9.485
  133    HG3  ARG  18           HG3      ARG  18 -17.965  -4.032  10.197
  134    HD2  ARG  18           HD2      ARG  18 -15.561  -2.291  10.729
  135    HD3  ARG  18           HD3      ARG  18 -16.969  -2.414  11.781
  136    HE   ARG  18           HE       ARG  18 -16.364  -4.863  11.914
  137   HH11  ARG  18          HH11      ARG  18 -13.942  -2.377  11.369
  138   HH12  ARG  18          HH12      ARG  18 -12.671  -3.284  12.124
  139   HH21  ARG  18          HH21      ARG  18 -14.696  -6.032  12.907
  140   HH22  ARG  18          HH22      ARG  18 -13.103  -5.353  13.004
  141    H    GLU  19           H        GLU  19 -19.579  -4.086   8.199
  142    HA   GLU  19           HA       GLU  19 -20.241  -6.558   9.158
  143    HB2  GLU  19           HB2      GLU  19 -21.695  -4.583   9.297
  144    HB3  GLU  19           HB3      GLU  19 -22.030  -4.729   7.578
  145    HG2  GLU  19           HG2      GLU  19 -23.859  -5.603   8.898
  146    HG3  GLU  19           HG3      GLU  19 -23.100  -6.881   7.952
  147    H    LEU  20           H        LEU  20 -20.816  -5.348   5.893
  148    HA   LEU  20           HA       LEU  20 -21.654  -7.854   4.841
  149    HB2  LEU  20           HB2      LEU  20 -21.483  -5.107   4.007
  150    HB3  LEU  20           HB3      LEU  20 -20.878  -6.154   2.740
  151    HG   LEU  20           HG       LEU  20 -23.534  -6.683   4.031
  152   HD11  LEU  20          HD11      LEU  20 -24.617  -5.372   2.343
  153   HD12  LEU  20          HD12      LEU  20 -23.071  -4.961   1.603
  154   HD13  LEU  20          HD13      LEU  20 -23.476  -4.341   3.202
  155   HD21  LEU  20          HD21      LEU  20 -22.577  -8.465   2.702
  156   HD22  LEU  20          HD22      LEU  20 -22.308  -7.356   1.359
  157   HD23  LEU  20          HD23      LEU  20 -23.954  -7.761   1.852
  158    H    TYR  21           H        TYR  21 -18.591  -6.257   5.141
  159    HA   TYR  21           HA       TYR  21 -17.283  -7.684   3.038
  160    HB2  TYR  21           HB2      TYR  21 -16.408  -5.527   3.722
  161    HB3  TYR  21           HB3      TYR  21 -16.178  -6.108   5.367
  162    HD1  TYR  21           HD1      TYR  21 -13.991  -6.511   5.940
  163    HD2  TYR  21           HD2      TYR  21 -15.205  -7.243   1.934
  164    HE1  TYR  21           HE1      TYR  21 -11.704  -7.228   5.386
  165    HE2  TYR  21           HE2      TYR  21 -12.921  -7.959   1.367
  166    HH   TYR  21           HH       TYR  21 -10.666  -7.722   2.138
  167    H    LEU  22           H        LEU  22 -17.203  -7.867   6.573
  168    HA   LEU  22           HA       LEU  22 -15.474 -10.062   6.767
  169    HB2  LEU  22           HB2      LEU  22 -17.697  -9.332   8.675
  170    HB3  LEU  22           HB3      LEU  22 -16.263 -10.269   9.045
  171    HG   LEU  22           HG       LEU  22 -16.279  -7.354   8.264
  172   HD11  LEU  22          HD11      LEU  22 -15.872  -8.646  10.950
  173   HD12  LEU  22          HD12      LEU  22 -17.259  -7.677  10.446
  174   HD13  LEU  22          HD13      LEU  22 -15.667  -6.931  10.584
  175   HD21  LEU  22          HD21      LEU  22 -14.026  -9.121   9.196
  176   HD22  LEU  22          HD22      LEU  22 -13.933  -7.377   8.942
  177   HD23  LEU  22          HD23      LEU  22 -14.234  -8.451   7.578
  178    H    ALA  23           H        ALA  23 -18.874  -9.863   6.087
  179    HA   ALA  23           HA       ALA  23 -19.457 -12.620   6.500
  180    HB1  ALA  23           HB1      ALA  23 -21.193 -10.905   6.538
  181    HB2  ALA  23           HB2      ALA  23 -21.544 -12.143   5.333
  182    HB3  ALA  23           HB3      ALA  23 -20.911 -10.575   4.829
  183    H    ASN  24           H        ASN  24 -18.933 -10.714   3.495
  184    HA   ASN  24           HA       ASN  24 -19.118 -13.153   1.955
  185    HB2  ASN  24           HB2      ASN  24 -18.987 -10.246   1.262
  186    HB3  ASN  24           HB3      ASN  24 -18.702 -11.465   0.023
  187   HD21  ASN  24          HD21      ASN  24 -21.044 -10.058   2.179
  188   HD22  ASN  24          HD22      ASN  24 -22.435 -10.796   1.459
  189    H    LYS  25           H        LYS  25 -16.566 -11.514   3.442
  190    HA   LYS  25           HA       LYS  25 -14.575 -11.944   1.446
  191    HB2  LYS  25           HB2      LYS  25 -12.947 -11.399   3.107
  192    HB3  LYS  25           HB3      LYS  25 -14.321 -10.335   3.353
  193    HG2  LYS  25           HG2      LYS  25 -15.085 -11.800   5.190
  194    HG3  LYS  25           HG3      LYS  25 -13.637 -12.784   4.970
  195    HD2  LYS  25           HD2      LYS  25 -13.662  -9.845   5.662
  196    HD3  LYS  25           HD3      LYS  25 -13.403 -11.158   6.809
  197    HE2  LYS  25           HE2      LYS  25 -11.659 -10.594   4.414
  198    HE3  LYS  25           HE3      LYS  25 -11.305 -10.072   6.058
  199    HZ1  LYS  25           HZ1      LYS  25 -11.255 -12.400   6.737
  200    HZ2  LYS  25           HZ2      LYS  25 -10.121 -12.094   5.524
  201    HZ3  LYS  25           HZ3      LYS  25 -11.562 -12.886   5.146
  202    H    ASP  26           H        ASP  26 -16.260 -14.016   3.486
  203    HA   ASP  26           HA       ASP  26 -14.238 -16.022   3.822
  204    HB2  ASP  26           HB2      ASP  26 -16.251 -15.733   5.313
  205    HB3  ASP  26           HB3      ASP  26 -17.237 -16.367   3.999
  206    H    VAL  27           H        VAL  27 -16.205 -15.005   1.285
  207    HA   VAL  27           HA       VAL  27 -16.292 -17.588  -0.052
  208    HB   VAL  27           HB       VAL  27 -17.292 -14.920  -1.054
  209   HG11  VAL  27          HG11      VAL  27 -18.637 -16.261  -2.588
  210   HG12  VAL  27          HG12      VAL  27 -17.923 -17.735  -1.936
  211   HG13  VAL  27          HG13      VAL  27 -16.916 -16.580  -2.809
  212   HG21  VAL  27          HG21      VAL  27 -19.519 -15.673  -0.351
  213   HG22  VAL  27          HG22      VAL  27 -18.424 -15.507   1.020
  214   HG23  VAL  27          HG23      VAL  27 -18.797 -17.107   0.380
  215    H    GLU  28           H        GLU  28 -14.545 -18.201  -1.098
  216    HA   GLU  28           HA       GLU  28 -12.559 -16.271  -1.931
  217    HB2  GLU  28           HB2      GLU  28 -12.575 -19.286  -2.152
  218    HB3  GLU  28           HB3      GLU  28 -11.188 -18.240  -2.425
  219    HG2  GLU  28           HG2      GLU  28 -11.160 -17.573  -0.124
  220    HG3  GLU  28           HG3      GLU  28 -12.660 -18.445   0.192
  221    H    GLY  29           H        GLY  29 -12.314 -15.496  -3.919
  222    HA2  GLY  29           HA2      GLY  29 -12.158 -15.669  -6.265
  223    HA3  GLY  29           HA3      GLY  29 -13.187 -17.091  -6.209
  224    H    GLN  30           H        GLN  30 -14.560 -14.815  -4.258
  225    HA   GLN  30           HA       GLN  30 -16.380 -13.973  -6.401
  226    HB2  GLN  30           HB2      GLN  30 -17.693 -15.014  -4.776
  227    HB3  GLN  30           HB3      GLN  30 -16.725 -14.383  -3.449
  228    HG2  GLN  30           HG2      GLN  30 -17.628 -12.153  -3.842
  229    HG3  GLN  30           HG3      GLN  30 -18.584 -12.773  -5.184
  230   HE21  GLN  30          HE21      GLN  30 -19.212 -11.488  -2.566
  231   HE22  GLN  30          HE22      GLN  30 -20.412 -12.506  -1.867
  232    H    ASP  31           H        ASP  31 -16.880 -11.846  -6.747
  233    HA   ASP  31           HA       ASP  31 -15.173  -9.758  -5.917
  234    HB2  ASP  31           HB2      ASP  31 -18.025  -9.653  -6.934
  235    HB3  ASP  31           HB3      ASP  31 -16.984  -8.247  -6.749
  236    H    VAL  32           H        VAL  32 -15.009  -9.742  -3.636
  237    HA   VAL  32           HA       VAL  32 -17.318  -9.669  -1.972
  238    HB   VAL  32           HB       VAL  32 -14.940 -10.247  -1.223
  239   HG11  VAL  32          HG11      VAL  32 -13.820  -8.294  -2.171
  240   HG12  VAL  32          HG12      VAL  32 -13.551  -8.406  -0.435
  241   HG13  VAL  32          HG13      VAL  32 -14.717  -7.242  -1.074
  242   HG21  VAL  32          HG21      VAL  32 -16.564  -8.282   0.384
  243   HG22  VAL  32          HG22      VAL  32 -15.302  -9.328   1.034
  244   HG23  VAL  32          HG23      VAL  32 -16.764 -10.034   0.345
  245    H    VAL  33           H        VAL  33 -15.415  -7.357  -3.684
  246    HA   VAL  33           HA       VAL  33 -16.207  -4.967  -2.541
  247    HB   VAL  33           HB       VAL  33 -14.844  -4.145  -4.101
  248   HG11  VAL  33          HG11      VAL  33 -15.010  -6.815  -5.474
  249   HG12  VAL  33          HG12      VAL  33 -13.884  -6.358  -4.191
  250   HG13  VAL  33          HG13      VAL  33 -13.793  -5.574  -5.766
  251   HG21  VAL  33          HG21      VAL  33 -16.827  -3.551  -5.405
  252   HG22  VAL  33          HG22      VAL  33 -16.738  -5.099  -6.243
  253   HG23  VAL  33          HG23      VAL  33 -15.448  -3.912  -6.441
  254    H    GLU  34           H        GLU  34 -17.728  -6.778  -5.194
  255    HA   GLU  34           HA       GLU  34 -19.766  -4.832  -5.542
  256    HB2  GLU  34           HB2      GLU  34 -18.946  -6.434  -7.314
  257    HB3  GLU  34           HB3      GLU  34 -19.853  -7.694  -6.482
  258    HG2  GLU  34           HG2      GLU  34 -21.910  -6.405  -6.790
  259    HG3  GLU  34           HG3      GLU  34 -20.993  -5.163  -7.649
  260    H    ALA  35           H        ALA  35 -19.578  -7.973  -3.943
  261    HA   ALA  35           HA       ALA  35 -22.176  -8.389  -3.176
  262    HB1  ALA  35           HB1      ALA  35 -19.717  -8.819  -1.482
  263    HB2  ALA  35           HB2      ALA  35 -20.340  -9.934  -2.701
  264    HB3  ALA  35           HB3      ALA  35 -21.285  -9.594  -1.251
  265    H    ILE  36           H        ILE  36 -19.774  -6.332  -1.614
  266    HA   ILE  36           HA       ILE  36 -21.453  -5.586   0.555
  267    HB   ILE  36           HB       ILE  36 -18.993  -4.199  -0.505
  268   HG12  ILE  36          HG12      ILE  36 -19.172  -6.163   1.778
  269   HG13  ILE  36          HG13      ILE  36 -18.764  -6.646   0.134
  270   HG21  ILE  36          HG21      ILE  36 -18.817  -3.297   1.777
  271   HG22  ILE  36          HG22      ILE  36 -20.365  -4.045   2.172
  272   HG23  ILE  36          HG23      ILE  36 -20.288  -2.774   0.954
  273   HD11  ILE  36          HD11      ILE  36 -16.781  -6.359   1.489
  274   HD12  ILE  36          HD12      ILE  36 -17.234  -4.695   1.834
  275   HD13  ILE  36          HD13      ILE  36 -16.822  -5.175   0.188
  276    H    LEU  37           H        LEU  37 -20.201  -3.654  -2.174
  277    HA   LEU  37           HA       LEU  37 -21.754  -1.390  -1.566
  278    HB2  LEU  37           HB2      LEU  37 -21.135  -0.631  -3.870
  279    HB3  LEU  37           HB3      LEU  37 -19.802  -1.072  -2.830
  280    HG   LEU  37           HG       LEU  37 -19.916  -3.366  -4.048
  281   HD11  LEU  37          HD11      LEU  37 -20.654  -3.170  -6.387
  282   HD12  LEU  37          HD12      LEU  37 -21.305  -1.567  -6.038
  283   HD13  LEU  37          HD13      LEU  37 -21.993  -2.990  -5.254
  284   HD21  LEU  37          HD21      LEU  37 -18.455  -2.430  -5.841
  285   HD22  LEU  37          HD22      LEU  37 -18.022  -1.953  -4.200
  286   HD23  LEU  37          HD23      LEU  37 -18.870  -0.824  -5.252
  287    H    ALA  38           H        ALA  38 -22.627  -4.246  -3.183
  288    HA   ALA  38           HA       ALA  38 -24.810  -3.133  -4.697
  289    HB1  ALA  38           HB1      ALA  38 -25.374  -5.467  -5.177
  290    HB2  ALA  38           HB2      ALA  38 -24.146  -5.987  -4.022
  291    HB3  ALA  38           HB3      ALA  38 -23.671  -5.122  -5.482
  292    H    HIS  39           H        HIS  39 -24.439  -4.886  -1.647
  293    HA   HIS  39           HA       HIS  39 -27.301  -5.037  -1.237
  294    HB2  HIS  39           HB2      HIS  39 -24.932  -5.779   0.472
  295    HB3  HIS  39           HB3      HIS  39 -26.571  -5.812   1.104
  296    HD1  HIS  39           HD1      HIS  39 -27.777  -7.965   0.826
  297    HD2  HIS  39           HD2      HIS  39 -24.603  -7.582  -1.835
  298    HE1  HIS  39           HE1      HIS  39 -27.611 -10.178  -0.351
  299    HE2  HIS  39           HE2      HIS  39 -25.752  -9.896  -2.026
  300    H    LEU  40           H        LEU  40 -24.731  -2.883  -0.556
  301    HA   LEU  40           HA       LEU  40 -26.062  -1.406   1.509
  302    HB2  LEU  40           HB2      LEU  40 -23.782  -0.629  -0.306
  303    HB3  LEU  40           HB3      LEU  40 -24.326   0.301   1.075
  304    HG   LEU  40           HG       LEU  40 -23.288  -2.512   1.311
  305   HD11  LEU  40          HD11      LEU  40 -21.531  -1.218   0.359
  306   HD12  LEU  40          HD12      LEU  40 -21.190  -1.430   2.076
  307   HD13  LEU  40          HD13      LEU  40 -21.820   0.109   1.485
  308   HD21  LEU  40          HD21      LEU  40 -24.660  -1.720   3.167
  309   HD22  LEU  40          HD22      LEU  40 -23.638  -0.289   3.317
  310   HD23  LEU  40          HD23      LEU  40 -22.970  -1.889   3.646
  311    H    ASN  41           H        ASN  41 -28.139  -1.148   0.456
  312    HA   ASN  41           HA       ASN  41 -28.126   0.945  -1.612
  313    HB2  ASN  41           HB2      ASN  41 -29.361  -1.230  -2.058
  314    HB3  ASN  41           HB3      ASN  41 -30.475  -0.771  -0.773
  315   HD21  ASN  41          HD21      ASN  41 -28.998   1.451  -3.048
  316   HD22  ASN  41          HD22      ASN  41 -30.462   1.898  -3.849
  317    H    THR  42           H        THR  42 -27.531   1.498   1.069
  318    HA   THR  42           HA       THR  42 -29.890   2.979   1.983
  319    HB   THR  42           HB       THR  42 -28.819   1.608   3.705
  320    HG1  THR  42           HG1      THR  42 -28.734   4.419   3.877
  321   HG21  THR  42          HG21      THR  42 -26.346   3.270   3.164
  322   HG22  THR  42          HG22      THR  42 -26.537   1.547   2.828
  323   HG23  THR  42          HG23      THR  42 -26.541   2.125   4.494
  324    H    VAL  43           H        VAL  43 -26.902   3.319   0.394
  325    HA   VAL  43           HA       VAL  43 -27.034   6.226   0.595
  326    HB   VAL  43           HB       VAL  43 -25.483   5.576   2.357
  327   HG11  VAL  43          HG11      VAL  43 -24.805   3.400   1.600
  328   HG12  VAL  43          HG12      VAL  43 -23.380   4.407   1.846
  329   HG13  VAL  43          HG13      VAL  43 -23.974   4.106   0.214
  330   HG21  VAL  43          HG21      VAL  43 -25.000   7.618   1.187
  331   HG22  VAL  43          HG22      VAL  43 -24.084   6.733  -0.033
  332   HG23  VAL  43          HG23      VAL  43 -23.497   6.808   1.629
  333    HA   PRO  44           HA       PRO  44 -26.047   5.648  -3.750
  334    HB2  PRO  44           HB2      PRO  44 -25.966   8.281  -4.397
  335    HB3  PRO  44           HB3      PRO  44 -27.475   7.384  -4.202
  336    HG2  PRO  44           HG2      PRO  44 -26.112   9.243  -2.300
  337    HG3  PRO  44           HG3      PRO  44 -27.839   9.066  -2.651
  338    HD2  PRO  44           HD2      PRO  44 -26.631   8.001  -0.450
  339    HD3  PRO  44           HD3      PRO  44 -28.076   7.303  -1.203
  340    H    ARG  45           H        ARG  45 -23.971   4.808  -3.266
  341    HA   ARG  45           HA       ARG  45 -21.775   6.771  -3.221
  342    HB2  ARG  45           HB2      ARG  45 -21.733   3.818  -2.548
  343    HB3  ARG  45           HB3      ARG  45 -20.367   4.912  -2.436
  344    HG2  ARG  45           HG2      ARG  45 -22.873   5.335  -0.856
  345    HG3  ARG  45           HG3      ARG  45 -21.567   4.294  -0.288
  346    HD2  ARG  45           HD2      ARG  45 -20.026   6.202  -0.489
  347    HD3  ARG  45           HD3      ARG  45 -21.381   7.232  -0.943
  348    HE   ARG  45           HE       ARG  45 -21.732   5.838   1.547
  349   HH11  ARG  45          HH11      ARG  45 -20.322   8.698   0.097
  350   HH12  ARG  45          HH12      ARG  45 -20.541   9.679   1.514
  351   HH21  ARG  45          HH21      ARG  45 -22.035   7.116   3.413
  352   HH22  ARG  45          HH22      ARG  45 -21.512   8.781   3.391
  353    H    THR  46           H        THR  46 -19.810   6.076  -4.469
  354    HA   THR  46           HA       THR  46 -20.479   4.546  -6.871
  355    HB   THR  46           HB       THR  46 -18.149   5.214  -7.598
  356    HG1  THR  46           HG1      THR  46 -17.175   6.907  -6.397
  357   HG21  THR  46          HG21      THR  46 -20.105   6.456  -8.372
  358   HG22  THR  46          HG22      THR  46 -18.750   7.549  -8.094
  359   HG23  THR  46          HG23      THR  46 -20.062   7.454  -6.919
  360    H    ARG  47           H        ARG  47 -18.736   2.906  -7.531
  361    HA   ARG  47           HA       ARG  47 -18.543   0.987  -5.482
  362    HB2  ARG  47           HB2      ARG  47 -17.230   1.154  -8.194
  363    HB3  ARG  47           HB3      ARG  47 -16.948  -0.192  -7.105
  364    HG2  ARG  47           HG2      ARG  47 -18.604  -0.791  -8.739
  365    HG3  ARG  47           HG3      ARG  47 -19.347  -0.711  -7.144
  366    HD2  ARG  47           HD2      ARG  47 -20.793   0.287  -8.817
  367    HD3  ARG  47           HD3      ARG  47 -20.236   1.503  -7.671
  368    HE   ARG  47           HE       ARG  47 -18.473   1.537  -9.821
  369   HH11  ARG  47          HH11      ARG  47 -21.867   2.154  -9.222
  370   HH12  ARG  47          HH12      ARG  47 -22.017   3.313 -10.503
  371   HH21  ARG  47          HH21      ARG  47 -18.652   3.097 -11.485
  372   HH22  ARG  47          HH22      ARG  47 -20.179   3.865 -11.781
  373    H    LYS  48           H        LYS  48 -16.338   3.370  -6.732
  374    HA   LYS  48           HA       LYS  48 -13.919   2.621  -5.651
  375    HB2  LYS  48           HB2      LYS  48 -14.203   4.515  -7.166
  376    HB3  LYS  48           HB3      LYS  48 -15.078   5.398  -5.924
  377    HG2  LYS  48           HG2      LYS  48 -12.974   5.221  -4.520
  378    HG3  LYS  48           HG3      LYS  48 -12.168   4.679  -5.994
  379    HD2  LYS  48           HD2      LYS  48 -11.794   7.018  -5.839
  380    HD3  LYS  48           HD3      LYS  48 -13.017   6.790  -7.092
  381    HE2  LYS  48           HE2      LYS  48 -14.772   7.305  -5.434
  382    HE3  LYS  48           HE3      LYS  48 -13.522   7.583  -4.223
  383    HZ1  LYS  48           HZ1      LYS  48 -12.646   9.357  -5.667
  384    HZ2  LYS  48           HZ2      LYS  48 -14.212   9.665  -5.120
  385    HZ3  LYS  48           HZ3      LYS  48 -13.962   9.143  -6.705
  386    H    GLN  49           H        GLN  49 -16.637   4.198  -4.074
  387    HA   GLN  49           HA       GLN  49 -15.213   5.153  -1.831
  388    HB2  GLN  49           HB2      GLN  49 -18.167   4.567  -2.072
  389    HB3  GLN  49           HB3      GLN  49 -17.411   5.574  -0.846
  390    HG2  GLN  49           HG2      GLN  49 -17.341   6.143  -3.801
  391    HG3  GLN  49           HG3      GLN  49 -18.490   6.844  -2.670
  392   HE21  GLN  49          HE21      GLN  49 -17.774   8.912  -3.183
  393   HE22  GLN  49          HE22      GLN  49 -16.260   9.534  -2.609
  394    H    ILE  50           H        ILE  50 -17.259   2.264  -2.254
  395    HA   ILE  50           HA       ILE  50 -17.127   1.447   0.425
  396    HB   ILE  50           HB       ILE  50 -17.758  -0.039  -2.103
  397   HG12  ILE  50          HG12      ILE  50 -19.939  -0.343  -0.743
  398   HG13  ILE  50          HG13      ILE  50 -19.293   0.909   0.307
  399   HG21  ILE  50          HG21      ILE  50 -16.629  -1.679  -0.740
  400   HG22  ILE  50          HG22      ILE  50 -18.362  -2.005  -0.730
  401   HG23  ILE  50          HG23      ILE  50 -17.601  -1.229   0.660
  402   HD11  ILE  50          HD11      ILE  50 -19.197   2.433  -1.624
  403   HD12  ILE  50          HD12      ILE  50 -20.828   1.856  -1.280
  404   HD13  ILE  50          HD13      ILE  50 -19.917   1.166  -2.624
  405    H    ILE  51           H        ILE  51 -15.201   0.343  -2.369
  406    HA   ILE  51           HA       ILE  51 -13.536  -1.438  -1.031
  407    HB   ILE  51           HB       ILE  51 -13.028   0.283  -3.454
  408   HG12  ILE  51          HG12      ILE  51 -13.027  -2.006  -4.555
  409   HG13  ILE  51          HG13      ILE  51 -13.616  -2.636  -3.025
  410   HG21  ILE  51          HG21      ILE  51 -10.995  -1.018  -3.879
  411   HG22  ILE  51          HG22      ILE  51 -11.183  -1.817  -2.318
  412   HG23  ILE  51          HG23      ILE  51 -10.871  -0.082  -2.390
  413   HD11  ILE  51          HD11      ILE  51 -15.621  -1.352  -3.206
  414   HD12  ILE  51          HD12      ILE  51 -15.380  -2.262  -4.696
  415   HD13  ILE  51          HD13      ILE  51 -15.017  -0.538  -4.646
  416    H    HIS  52           H        HIS  52 -13.179   2.039  -1.548
  417    HA   HIS  52           HA       HIS  52 -10.585   2.245  -0.486
  418    HB2  HIS  52           HB2      HIS  52 -12.711   4.118  -1.298
  419    HB3  HIS  52           HB3      HIS  52 -11.554   4.743  -0.128
  420    HD1  HIS  52           HD1      HIS  52  -9.927   6.108  -1.387
  421    HD2  HIS  52           HD2      HIS  52 -10.855   2.586  -3.396
  422    HE1  HIS  52           HE1      HIS  52  -8.460   6.083  -3.421
  423    HE2  HIS  52           HE2      HIS  52  -9.011   3.938  -4.615
  424    H    HIS  53           H        HIS  53 -13.757   2.936   1.054
  425    HA   HIS  53           HA       HIS  53 -12.649   3.833   3.481
  426    HB2  HIS  53           HB2      HIS  53 -15.353   2.586   2.970
  427    HB3  HIS  53           HB3      HIS  53 -14.889   3.402   4.461
  428    HD1  HIS  53           HD1      HIS  53 -13.548   5.897   3.422
  429    HD2  HIS  53           HD2      HIS  53 -17.068   4.353   1.818
  430    HE1  HIS  53           HE1      HIS  53 -14.600   7.796   2.165
  431    HE2  HIS  53           HE2      HIS  53 -16.587   6.778   1.011
  432    H    LEU  54           H        LEU  54 -12.995   0.653   2.257
  433    HA   LEU  54           HA       LEU  54 -13.000  -0.636   4.849
  434    HB2  LEU  54           HB2      LEU  54 -13.025  -1.617   2.017
  435    HB3  LEU  54           HB3      LEU  54 -12.681  -2.721   3.335
  436    HG   LEU  54           HG       LEU  54 -15.190  -1.051   3.246
  437   HD11  LEU  54          HD11      LEU  54 -15.075  -2.453   1.242
  438   HD12  LEU  54          HD12      LEU  54 -16.328  -3.002   2.354
  439   HD13  LEU  54          HD13      LEU  54 -14.794  -3.870   2.256
  440   HD21  LEU  54          HD21      LEU  54 -14.485  -3.595   4.719
  441   HD22  LEU  54          HD22      LEU  54 -16.010  -2.718   4.822
  442   HD23  LEU  54          HD23      LEU  54 -14.528  -1.981   5.429
  443    H    VAL  55           H        VAL  55 -10.758  -0.421   2.088
  444    HA   VAL  55           HA       VAL  55  -8.684  -1.817   3.465
  445    HB   VAL  55           HB       VAL  55  -7.259  -1.306   1.628
  446   HG11  VAL  55          HG11      VAL  55 -10.076  -1.654   0.624
  447   HG12  VAL  55          HG12      VAL  55  -9.000  -2.936   1.183
  448   HG13  VAL  55          HG13      VAL  55  -8.607  -2.027  -0.276
  449   HG21  VAL  55          HG21      VAL  55  -7.657   1.080   1.427
  450   HG22  VAL  55          HG22      VAL  55  -9.274   0.776   0.791
  451   HG23  VAL  55          HG23      VAL  55  -7.853   0.289  -0.136
  452    H    GLN  56           H        GLN  56  -9.730   1.451   3.310
  453    HA   GLN  56           HA       GLN  56  -7.363   2.520   4.550
  454    HB2  GLN  56           HB2      GLN  56 -10.029   3.638   3.762
  455    HB3  GLN  56           HB3      GLN  56  -8.944   4.566   4.775
  456    HG2  GLN  56           HG2      GLN  56  -7.206   4.387   3.035
  457    HG3  GLN  56           HG3      GLN  56  -8.349   3.509   2.021
  458   HE21  GLN  56          HE21      GLN  56 -10.116   4.599   1.176
  459   HE22  GLN  56          HE22      GLN  56 -10.140   6.324   1.027
  460    H    MET  57           H        MET  57 -10.243   0.985   5.601
  461    HA   MET  57           HA       MET  57 -10.179   2.103   8.253
  462    HB2  MET  57           HB2      MET  57 -12.236   1.131   7.054
  463    HB3  MET  57           HB3      MET  57 -11.584  -0.442   7.484
  464    HG2  MET  57           HG2      MET  57 -11.644   0.201   9.856
  465    HG3  MET  57           HG3      MET  57 -12.352   1.747   9.400
  466    HE1  MET  57           HE1      MET  57 -15.786   0.553   7.839
  467    HE2  MET  57           HE2      MET  57 -14.282   0.557   6.920
  468    HE3  MET  57           HE3      MET  57 -14.654   1.895   8.007
  469    H    GLY  58           H        GLY  58  -8.356  -0.143   6.599
  470    HA2  GLY  58           HA2      GLY  58  -6.409  -1.132   7.408
  471    HA3  GLY  58           HA3      GLY  58  -6.960  -0.831   9.047
  472    H    LEU  59           H        LEU  59  -9.530  -2.193   7.577
  473    HA   LEU  59           HA       LEU  59  -8.943  -4.758   8.769
  474    HB2  LEU  59           HB2      LEU  59 -11.319  -5.287   8.123
  475    HB3  LEU  59           HB3      LEU  59 -11.096  -3.990   9.278
  476    HG   LEU  59           HG       LEU  59 -11.295  -2.424   7.229
  477   HD11  LEU  59          HD11      LEU  59 -12.635  -4.887   6.133
  478   HD12  LEU  59          HD12      LEU  59 -11.138  -4.175   5.528
  479   HD13  LEU  59          HD13      LEU  59 -12.650  -3.275   5.417
  480   HD21  LEU  59          HD21      LEU  59 -13.722  -2.402   7.457
  481   HD22  LEU  59          HD22      LEU  59 -12.925  -2.570   9.021
  482   HD23  LEU  59          HD23      LEU  59 -13.660  -3.976   8.252
  483    H    ALA  60           H        ALA  60  -9.055  -3.346   5.625
  484    HA   ALA  60           HA       ALA  60  -8.648  -6.022   4.446
  485    HB1  ALA  60           HB1      ALA  60 -10.464  -4.883   3.372
  486    HB2  ALA  60           HB2      ALA  60  -9.093  -4.923   2.259
  487    HB3  ALA  60           HB3      ALA  60  -9.479  -3.444   3.132
  488    H    ASP  61           H        ASP  61  -7.004  -6.259   2.834
  489    HA   ASP  61           HA       ASP  61  -4.494  -5.290   3.629
  490    HB2  ASP  61           HB2      ASP  61  -4.886  -7.412   2.382
  491    HB3  ASP  61           HB3      ASP  61  -5.268  -6.462   0.948
  492    H    SER  62           H        SER  62  -6.115  -4.702   0.514
  493    HA   SER  62           HA       SER  62  -5.501  -1.922   0.505
  494    HB2  SER  62           HB2      SER  62  -4.018  -2.079  -1.519
  495    HB3  SER  62           HB3      SER  62  -3.273  -2.593  -0.009
  496    HG   SER  62           HG       SER  62  -3.501  -4.716  -0.618
  497    H    VAL  63           H        VAL  63  -5.795  -1.081  -1.867
  498    HA   VAL  63           HA       VAL  63  -8.403  -1.521  -2.687
  499    HB   VAL  63           HB       VAL  63  -5.998  -0.237  -3.889
  500   HG11  VAL  63          HG11      VAL  63  -8.477  -0.814  -5.515
  501   HG12  VAL  63          HG12      VAL  63  -6.839  -1.385  -5.845
  502   HG13  VAL  63          HG13      VAL  63  -7.212   0.334  -5.965
  503   HG21  VAL  63          HG21      VAL  63  -8.826   0.674  -3.382
  504   HG22  VAL  63          HG22      VAL  63  -7.522   1.689  -4.001
  505   HG23  VAL  63          HG23      VAL  63  -7.415   1.005  -2.378
  506    H    LYS  64           H        LYS  64  -5.479  -3.181  -3.504
  507    HA   LYS  64           HA       LYS  64  -6.357  -4.319  -5.945
  508    HB2  LYS  64           HB2      LYS  64  -4.156  -5.456  -4.273
  509    HB3  LYS  64           HB3      LYS  64  -4.277  -5.359  -6.013
  510    HG2  LYS  64           HG2      LYS  64  -4.047  -2.878  -5.821
  511    HG3  LYS  64           HG3      LYS  64  -3.704  -3.112  -4.107
  512    HD2  LYS  64           HD2      LYS  64  -2.103  -4.115  -6.453
  513    HD3  LYS  64           HD3      LYS  64  -1.622  -2.907  -5.259
  514    HE2  LYS  64           HE2      LYS  64  -2.154  -5.824  -4.694
  515    HE3  LYS  64           HE3      LYS  64  -0.562  -5.087  -4.858
  516    HZ1  LYS  64           HZ1      LYS  64  -1.093  -3.676  -2.944
  517    HZ2  LYS  64           HZ2      LYS  64  -1.139  -5.318  -2.552
  518    HZ3  LYS  64           HZ3      LYS  64  -2.580  -4.464  -2.766
  519    H    ASP  65           H        ASP  65  -7.015  -5.102  -2.707
  520    HA   ASP  65           HA       ASP  65  -7.358  -7.940  -3.066
  521    HB2  ASP  65           HB2      ASP  65  -6.912  -6.715  -0.852
  522    HB3  ASP  65           HB3      ASP  65  -8.607  -6.249  -0.896
  523    H    PHE  66           H        PHE  66  -9.110  -5.119  -3.717
  524    HA   PHE  66           HA       PHE  66 -11.620  -6.592  -4.146
  525    HB2  PHE  66           HB2      PHE  66 -11.073  -3.627  -3.876
  526    HB3  PHE  66           HB3      PHE  66 -12.647  -4.314  -4.247
  527    HD1  PHE  66           HD1      PHE  66 -14.117  -4.708  -2.528
  528    HD2  PHE  66           HD2      PHE  66  -9.955  -4.505  -1.684
  529    HE1  PHE  66           HE1      PHE  66 -14.600  -4.897  -0.132
  530    HE2  PHE  66           HE2      PHE  66 -10.428  -4.693   0.720
  531    HZ   PHE  66           HZ       PHE  66 -12.758  -4.886   1.505
  532    H    GLN  67           H        GLN  67  -9.476  -4.168  -5.520
  533    HA   GLN  67           HA       GLN  67 -10.079  -5.125  -8.225
  534    HB2  GLN  67           HB2      GLN  67  -9.939  -2.213  -7.380
  535    HB3  GLN  67           HB3      GLN  67 -10.052  -2.780  -9.040
  536    HG2  GLN  67           HG2      GLN  67 -12.251  -3.731  -8.567
  537    HG3  GLN  67           HG3      GLN  67 -12.134  -3.164  -6.899
  538   HE21  GLN  67          HE21      GLN  67 -13.971  -1.880  -7.116
  539   HE22  GLN  67          HE22      GLN  67 -13.959  -0.400  -8.008
  540    H    ARG  68           H        ARG  68  -8.131  -5.890  -8.888
  541    HA   ARG  68           HA       ARG  68  -5.705  -5.046  -7.698
  542    HB2  ARG  68           HB2      ARG  68  -5.884  -7.312  -8.522
  543    HB3  ARG  68           HB3      ARG  68  -6.213  -6.737 -10.149
  544    HG2  ARG  68           HG2      ARG  68  -3.975  -5.852 -10.335
  545    HG3  ARG  68           HG3      ARG  68  -3.633  -6.291  -8.661
  546    HD2  ARG  68           HD2      ARG  68  -4.459  -8.335 -10.696
  547    HD3  ARG  68           HD3      ARG  68  -2.777  -7.843 -10.509
  548    HE   ARG  68           HE       ARG  68  -3.085  -8.538  -8.100
  549   HH11  ARG  68          HH11      ARG  68  -4.959  -9.990 -10.677
  550   HH12  ARG  68          HH12      ARG  68  -5.084 -11.527  -9.887
  551   HH21  ARG  68          HH21      ARG  68  -3.270 -10.547  -7.051
  552   HH22  ARG  68          HH22      ARG  68  -4.121 -11.846  -7.825
  553    H    LYS  69           H        LYS  69  -5.916  -2.786  -8.029
  554    HA   LYS  69           HA       LYS  69  -5.401  -1.696 -10.619
  555    HB2  LYS  69           HB2      LYS  69  -6.431  -0.296  -8.917
  556    HB3  LYS  69           HB3      LYS  69  -5.067  -0.550  -7.838
  557    HG2  LYS  69           HG2      LYS  69  -3.610   0.666  -9.363
  558    HG3  LYS  69           HG3      LYS  69  -4.952   0.889 -10.483
  559    HD2  LYS  69           HD2      LYS  69  -4.923   1.902  -7.644
  560    HD3  LYS  69           HD3      LYS  69  -4.481   2.871  -9.052
  561    HE2  LYS  69           HE2      LYS  69  -7.155   1.557  -8.583
  562    HE3  LYS  69           HE3      LYS  69  -6.799   3.269  -8.366
  563    HZ1  LYS  69           HZ1      LYS  69  -6.294   3.436 -10.714
  564    HZ2  LYS  69           HZ2      LYS  69  -7.854   2.828 -10.501
  565    HZ3  LYS  69           HZ3      LYS  69  -6.595   1.789 -10.933
  566    H    GLY  70           H        GLY  70  -3.690  -2.586 -11.550
  567    HA2  GLY  70           HA2      GLY  70  -1.355  -3.547 -10.651
  568    HA3  GLY  70           HA3      GLY  70  -1.440  -2.588 -12.119
  569    H    THR  71           H        THR  71   0.101  -2.907  -9.283
  570    HA   THR  71           HA       THR  71  -0.018  -0.401  -8.093
  571    HB   THR  71           HB       THR  71   2.261  -1.076  -7.105
  572    HG1  THR  71           HG1      THR  71   2.232  -2.813  -8.972
  573   HG21  THR  71          HG21      THR  71   1.138  -2.699  -5.604
  574   HG22  THR  71          HG22      THR  71  -0.241  -2.714  -6.707
  575   HG23  THR  71          HG23      THR  71   0.203  -1.227  -5.870
  576    H    HIS  72           H        HIS  72   1.098   1.408  -8.180
  577    HA   HIS  72           HA       HIS  72   2.864   2.159 -10.176
  578    HB2  HIS  72           HB2      HIS  72   3.588   3.920  -8.681
  579    HB3  HIS  72           HB3      HIS  72   1.867   3.686  -8.409
  580    HD1  HIS  72           HD1      HIS  72   1.415   1.940  -6.268
  581    HD2  HIS  72           HD2      HIS  72   5.033   3.963  -6.413
  582    HE1  HIS  72           HE1      HIS  72   2.448   1.634  -4.014
  583    HE2  HIS  72           HE2      HIS  72   4.414   3.210  -4.010
  584    H    ILE  73           H        ILE  73   4.643   1.077 -10.728
  585    HA   ILE  73           HA       ILE  73   6.326   0.107  -8.537
  586    HB   ILE  73           HB       ILE  73   5.394  -1.344 -10.924
  587   HG12  ILE  73          HG12      ILE  73   4.901  -1.767  -8.436
  588   HG13  ILE  73          HG13      ILE  73   5.295  -3.159  -9.452
  589   HG21  ILE  73          HG21      ILE  73   7.627  -1.247 -11.660
  590   HG22  ILE  73          HG22      ILE  73   7.485  -2.802 -10.835
  591   HG23  ILE  73          HG23      ILE  73   8.250  -1.436 -10.024
  592   HD11  ILE  73          HD11      ILE  73   6.404  -3.237  -7.270
  593   HD12  ILE  73          HD12      ILE  73   7.224  -1.720  -7.639
  594   HD13  ILE  73          HD13      ILE  73   7.564  -3.161  -8.596
  595    H    VAL  74           H        VAL  74   7.965   1.323  -8.385
  596    HA   VAL  74           HA       VAL  74   9.017   2.922 -10.430
  597    HB   VAL  74           HB       VAL  74  10.802   3.440  -8.935
  598   HG11  VAL  74          HG11      VAL  74   8.630   4.334  -8.306
  599   HG12  VAL  74          HG12      VAL  74   9.587   3.992  -6.867
  600   HG13  VAL  74          HG13      VAL  74   8.288   2.893  -7.345
  601   HG21  VAL  74          HG21      VAL  74  11.307   2.208  -6.918
  602   HG22  VAL  74          HG22      VAL  74  11.441   1.148  -8.321
  603   HG23  VAL  74          HG23      VAL  74  10.025   1.050  -7.274
  604    H    LEU  75           H        LEU  75  10.543   2.505 -11.926
  605    HA   LEU  75           HA       LEU  75  10.400   0.063 -13.134
  606    HB2  LEU  75           HB2      LEU  75  12.474   0.879 -14.408
  607    HB3  LEU  75           HB3      LEU  75  11.012   1.854 -14.468
  608    HG   LEU  75           HG       LEU  75  12.647   2.652 -12.234
  609   HD11  LEU  75          HD11      LEU  75  14.501   1.811 -13.546
  610   HD12  LEU  75          HD12      LEU  75  14.526   3.573 -13.487
  611   HD13  LEU  75          HD13      LEU  75  13.964   2.746 -14.941
  612   HD21  LEU  75          HD21      LEU  75  11.795   4.083 -14.753
  613   HD22  LEU  75          HD22      LEU  75  12.438   4.846 -13.298
  614   HD23  LEU  75          HD23      LEU  75  10.885   4.008 -13.243
  615    H    TRP  76           H        TRP  76  10.863  -1.656 -11.748
  616    HA   TRP  76           HA       TRP  76  13.479  -1.853 -10.545
  617    HB2  TRP  76           HB2      TRP  76  11.044  -3.614 -10.520
  618    HB3  TRP  76           HB3      TRP  76  12.578  -4.161  -9.851
  619    HD1  TRP  76           HD1      TRP  76   9.486  -2.464  -8.873
  620    HE1  TRP  76           HE1      TRP  76   9.713  -1.365  -6.563
  621    HE3  TRP  76           HE3      TRP  76  14.555  -2.710  -8.383
  622    HZ2  TRP  76           HZ2      TRP  76  11.784  -0.682  -4.771
  623    HZ3  TRP  76           HZ3      TRP  76  15.584  -1.810  -6.340
  624    HH2  TRP  76           HH2      TRP  76  14.228  -0.813  -4.575
  625    H    THR  77           H        THR  77  15.073  -2.267 -11.833
  626    HA   THR  77           HA       THR  77  14.844  -4.476 -13.762
  627    HB   THR  77           HB       THR  77  16.812  -3.410 -14.891
  628    HG1  THR  77           HG1      THR  77  17.036  -1.071 -14.220
  629   HG21  THR  77          HG21      THR  77  14.383  -1.630 -14.598
  630   HG22  THR  77          HG22      THR  77  14.563  -2.964 -15.739
  631   HG23  THR  77          HG23      THR  77  15.576  -1.529 -15.894
  632    H    GLY  78           H        GLY  78  17.191  -5.474 -14.090
  633    HA2  GLY  78           HA2      GLY  78  18.167  -6.542 -11.702
  634    HA3  GLY  78           HA3      GLY  78  19.078  -6.454 -13.205
  635    H    ASP  79           H        ASP  79  18.965  -3.602 -13.398
  636    HA   ASP  79           HA       ASP  79  21.231  -2.818 -11.946
  637    HB2  ASP  79           HB2      ASP  79  19.090  -1.144 -13.275
  638    HB3  ASP  79           HB3      ASP  79  20.606  -0.506 -12.660
  639    H    GLN  80           H        GLN  80  17.840  -1.695 -11.534
  640    HA   GLN  80           HA       GLN  80  18.430  -0.283  -9.154
  641    HB2  GLN  80           HB2      GLN  80  16.368   0.022 -10.687
  642    HB3  GLN  80           HB3      GLN  80  15.671  -1.318  -9.784
  643    HG2  GLN  80           HG2      GLN  80  15.881  -0.113  -7.719
  644    HG3  GLN  80           HG3      GLN  80  16.720   1.202  -8.525
  645   HE21  GLN  80          HE21      GLN  80  13.869  -0.480  -9.702
  646   HE22  GLN  80          HE22      GLN  80  12.819   0.880  -9.626
  647    H    GLU  81           H        GLU  81  17.579  -3.576  -9.788
  648    HA   GLU  81           HA       GLU  81  16.691  -4.382  -7.263
  649    HB2  GLU  81           HB2      GLU  81  16.535  -5.726  -9.344
  650    HB3  GLU  81           HB3      GLU  81  18.270  -5.994  -9.279
  651    HG2  GLU  81           HG2      GLU  81  18.084  -7.303  -7.318
  652    HG3  GLU  81           HG3      GLU  81  16.405  -6.824  -7.082
  653    H    LEU  82           H        LEU  82  19.991  -4.376  -8.633
  654    HA   LEU  82           HA       LEU  82  21.102  -5.248  -6.141
  655    HB2  LEU  82           HB2      LEU  82  23.292  -4.922  -7.200
  656    HB3  LEU  82           HB3      LEU  82  22.218  -5.921  -8.152
  657    HG   LEU  82           HG       LEU  82  21.742  -3.721  -9.466
  658   HD11  LEU  82          HD11      LEU  82  24.400  -3.089  -8.187
  659   HD12  LEU  82          HD12      LEU  82  22.892  -2.202  -7.962
  660   HD13  LEU  82          HD13      LEU  82  23.679  -2.215  -9.540
  661   HD21  LEU  82          HD21      LEU  82  22.857  -5.708 -10.361
  662   HD22  LEU  82          HD22      LEU  82  24.388  -5.152  -9.684
  663   HD23  LEU  82          HD23      LEU  82  23.600  -4.224 -10.961
  664    H    GLU  83           H        GLU  83  20.445  -2.160  -7.629
  665    HA   GLU  83           HA       GLU  83  22.083  -0.547  -6.010
  666    HB2  GLU  83           HB2      GLU  83  19.371   0.067  -7.202
  667    HB3  GLU  83           HB3      GLU  83  20.405   1.260  -6.430
  668    HG2  GLU  83           HG2      GLU  83  22.156   0.734  -8.124
  669    HG3  GLU  83           HG3      GLU  83  20.978  -0.291  -8.940
  670    H    LEU  84           H        LEU  84  18.777  -1.737  -5.542
  671    HA   LEU  84           HA       LEU  84  18.394  -0.580  -2.996
  672    HB2  LEU  84           HB2      LEU  84  16.490  -1.381  -4.210
  673    HB3  LEU  84           HB3      LEU  84  17.156  -3.002  -4.295
  674    HG   LEU  84           HG       LEU  84  16.879  -3.266  -1.878
  675   HD11  LEU  84          HD11      LEU  84  15.752  -1.608  -0.545
  676   HD12  LEU  84          HD12      LEU  84  15.594  -0.545  -1.943
  677   HD13  LEU  84          HD13      LEU  84  17.189  -0.900  -1.280
  678   HD21  LEU  84          HD21      LEU  84  14.365  -2.300  -3.229
  679   HD22  LEU  84          HD22      LEU  84  14.448  -3.332  -1.802
  680   HD23  LEU  84          HD23      LEU  84  15.045  -3.922  -3.355
  681    H    GLN  85           H        GLN  85  19.553  -3.761  -4.020
  682    HA   GLN  85           HA       GLN  85  19.818  -4.987  -1.558
  683    HB2  GLN  85           HB2      GLN  85  20.071  -6.140  -3.688
  684    HB3  GLN  85           HB3      GLN  85  21.540  -5.237  -4.024
  685    HG2  GLN  85           HG2      GLN  85  22.465  -6.287  -1.894
  686    HG3  GLN  85           HG3      GLN  85  21.100  -7.393  -2.007
  687   HE21  GLN  85          HE21      GLN  85  24.063  -6.374  -3.402
  688   HE22  GLN  85          HE22      GLN  85  24.225  -7.682  -4.514
  689    H    ARG  86           H        ARG  86  22.246  -3.099  -3.345
  690    HA   ARG  86           HA       ARG  86  24.303  -3.355  -1.471
  691    HB2  ARG  86           HB2      ARG  86  23.771  -1.184  -3.493
  692    HB3  ARG  86           HB3      ARG  86  25.242  -1.284  -2.537
  693    HG2  ARG  86           HG2      ARG  86  25.551  -3.601  -3.502
  694    HG3  ARG  86           HG3      ARG  86  24.260  -3.194  -4.633
  695    HD2  ARG  86           HD2      ARG  86  26.771  -1.565  -4.271
  696    HD3  ARG  86           HD3      ARG  86  26.568  -2.799  -5.510
  697    HE   ARG  86           HE       ARG  86  25.028  -1.413  -6.616
  698   HH11  ARG  86          HH11      ARG  86  26.308   0.107  -3.731
  699   HH12  ARG  86          HH12      ARG  86  25.890   1.710  -4.236
  700   HH21  ARG  86          HH21      ARG  86  24.496   0.706  -7.298
  701   HH22  ARG  86          HH22      ARG  86  24.864   2.056  -6.270
  702    H    LEU  87           H        LEU  87  21.958  -0.696  -1.887
  703    HA   LEU  87           HA       LEU  87  22.967   0.862   0.232
  704    HB2  LEU  87           HB2      LEU  87  20.177   0.813  -0.903
  705    HB3  LEU  87           HB3      LEU  87  20.825   2.062   0.143
  706    HG   LEU  87           HG       LEU  87  21.635   1.435  -2.688
  707   HD11  LEU  87          HD11      LEU  87  20.967   3.752  -3.058
  708   HD12  LEU  87          HD12      LEU  87  20.510   3.886  -1.359
  709   HD13  LEU  87          HD13      LEU  87  19.640   2.780  -2.422
  710   HD21  LEU  87          HD21      LEU  87  23.668   1.878  -1.453
  711   HD22  LEU  87          HD22      LEU  87  22.947   3.313  -0.727
  712   HD23  LEU  87          HD23      LEU  87  23.267   3.269  -2.460
  713    H    PHE  88           H        PHE  88  20.474  -1.611   0.114
  714    HA   PHE  88           HA       PHE  88  19.439  -1.440   2.664
  715    HB2  PHE  88           HB2      PHE  88  18.409  -2.967   1.200
  716    HB3  PHE  88           HB3      PHE  88  19.931  -3.758   0.815
  717    HD1  PHE  88           HD1      PHE  88  17.405  -3.321   3.493
  718    HD2  PHE  88           HD2      PHE  88  20.661  -5.623   2.012
  719    HE1  PHE  88           HE1      PHE  88  16.943  -5.056   5.177
  720    HE2  PHE  88           HE2      PHE  88  20.208  -7.357   3.693
  721    HZ   PHE  88           HZ       PHE  88  18.352  -7.073   5.275
  722    H    GLU  89           H        GLU  89  22.345  -3.138   1.568
  723    HA   GLU  89           HA       GLU  89  22.993  -4.015   4.232
  724    HB2  GLU  89           HB2      GLU  89  24.658  -4.070   1.720
  725    HB3  GLU  89           HB3      GLU  89  24.973  -4.975   3.195
  726    HG2  GLU  89           HG2      GLU  89  22.817  -6.152   2.866
  727    HG3  GLU  89           HG3      GLU  89  22.638  -5.306   1.331
  728    H    GLU  90           H        GLU  90  23.837  -1.352   2.142
  729    HA   GLU  90           HA       GLU  90  26.283  -0.694   3.446
  730    HB2  GLU  90           HB2      GLU  90  24.561   0.532   1.367
  731    HB3  GLU  90           HB3      GLU  90  25.743   1.567   2.160
  732    HG2  GLU  90           HG2      GLU  90  27.489  -0.107   1.533
  733    HG3  GLU  90           HG3      GLU  90  26.257  -0.946   0.592
  734    H    PHE  91           H        PHE  91  22.946   0.353   3.858
  735    HA   PHE  91           HA       PHE  91  23.860   2.114   6.044
  736    HB2  PHE  91           HB2      PHE  91  21.285   2.222   4.460
  737    HB3  PHE  91           HB3      PHE  91  21.698   3.294   5.792
  738    HD1  PHE  91           HD1      PHE  91  24.092   4.464   5.473
  739    HD2  PHE  91           HD2      PHE  91  21.593   3.022   2.343
  740    HE1  PHE  91           HE1      PHE  91  25.183   6.003   3.896
  741    HE2  PHE  91           HE2      PHE  91  22.682   4.560   0.763
  742    HZ   PHE  91           HZ       PHE  91  24.478   6.050   1.537
  743    H    ARG  92           H        ARG  92  23.175  -0.853   5.889
  744    HA   ARG  92           HA       ARG  92  20.720  -1.335   7.191
  745    HB2  ARG  92           HB2      ARG  92  22.027  -2.991   5.861
  746    HB3  ARG  92           HB3      ARG  92  23.185  -3.072   7.178
  747    HG2  ARG  92           HG2      ARG  92  21.290  -3.807   8.655
  748    HG3  ARG  92           HG3      ARG  92  20.316  -3.948   7.192
  749    HD2  ARG  92           HD2      ARG  92  21.565  -5.684   6.351
  750    HD3  ARG  92           HD3      ARG  92  22.989  -5.257   7.287
  751    HE   ARG  92           HE       ARG  92  20.868  -6.072   8.984
  752   HH11  ARG  92          HH11      ARG  92  23.238  -7.343   6.746
  753   HH12  ARG  92          HH12      ARG  92  23.440  -8.838   7.602
  754   HH21  ARG  92          HH21      ARG  92  21.154  -8.051  10.135
  755   HH22  ARG  92          HH22      ARG  92  22.266  -9.234   9.526
  756    H    ASP  93           H        ASP  93  23.813  -0.396   8.384
  757    HA   ASP  93           HA       ASP  93  23.437  -1.369  11.046
  758    HB2  ASP  93           HB2      ASP  93  25.449  -0.101  11.606
  759    HB3  ASP  93           HB3      ASP  93  25.687  -1.030  10.131
  760    H    SER  94           H        SER  94  21.859   0.973   9.456
  761    HA   SER  94           HA       SER  94  21.520   2.668  11.831
  762    HB2  SER  94           HB2      SER  94  22.099   3.728   9.589
  763    HB3  SER  94           HB3      SER  94  20.511   3.208   9.028
  764    HG   SER  94           HG       SER  94  20.662   4.657  11.418
  765    H    ASP  95           H        ASP  95  19.387   3.052  12.613
  766    HA   ASP  95           HA       ASP  95  17.852   0.713  12.792
  767    HB2  ASP  95           HB2      ASP  95  17.937   2.467  14.530
  768    HB3  ASP  95           HB3      ASP  95  17.005   3.532  13.481
  769    H    ASP  96           H        ASP  96  17.218   3.712  10.998
  770    HA   ASP  96           HA       ASP  96  15.144   2.256   9.510
  771    HB2  ASP  96           HB2      ASP  96  14.435   4.401  10.584
  772    HB3  ASP  96           HB3      ASP  96  15.615   5.248   9.592
  773    H    VAL  97           H        VAL  97  16.827   1.134   8.365
  774    HA   VAL  97           HA       VAL  97  18.757   2.472   6.816
  775    HB   VAL  97           HB       VAL  97  19.202   0.200   7.256
  776   HG11  VAL  97          HG11      VAL  97  16.683  -0.615   5.828
  777   HG12  VAL  97          HG12      VAL  97  16.844  -0.515   7.582
  778   HG13  VAL  97          HG13      VAL  97  17.829  -1.663   6.669
  779   HG21  VAL  97          HG21      VAL  97  19.957   0.911   5.068
  780   HG22  VAL  97          HG22      VAL  97  18.420   0.419   4.357
  781   HG23  VAL  97          HG23      VAL  97  19.505  -0.793   5.037
  782    H    LEU  98           H        LEU  98  15.426   1.576   6.147
  783    HA   LEU  98           HA       LEU  98  15.460   1.972   3.367
  784    HB2  LEU  98           HB2      LEU  98  13.293   2.106   5.421
  785    HB3  LEU  98           HB3      LEU  98  12.969   2.594   3.768
  786    HG   LEU  98           HG       LEU  98  14.007   0.246   3.208
  787   HD11  LEU  98          HD11      LEU  98  14.643  -0.298   5.488
  788   HD12  LEU  98          HD12      LEU  98  13.432  -1.425   4.874
  789   HD13  LEU  98          HD13      LEU  98  12.960  -0.152   6.000
  790   HD21  LEU  98          HD21      LEU  98  11.755   0.996   2.664
  791   HD22  LEU  98          HD22      LEU  98  11.226   0.606   4.300
  792   HD23  LEU  98          HD23      LEU  98  11.763  -0.678   3.217
  793    H    GLY  99           H        GLY  99  14.949   4.223   6.030
  794    HA2  GLY  99           HA2      GLY  99  14.218   6.492   4.598
  795    HA3  GLY  99           HA3      GLY  99  15.149   6.514   6.095
  796    H    HIS 100           H        HIS 100  17.420   5.142   5.156
  797    HA   HIS 100           HA       HIS 100  18.746   7.351   3.867
  798    HB2  HIS 100           HB2      HIS 100  19.858   4.643   4.644
  799    HB3  HIS 100           HB3      HIS 100  20.797   6.059   4.183
  800    HD1  HIS 100           HD1      HIS 100  20.389   8.205   5.884
  801    HD2  HIS 100           HD2      HIS 100  19.510   4.405   7.311
  802    HE1  HIS 100           HE1      HIS 100  20.301   8.428   8.386
  803    HE2  HIS 100           HE2      HIS 100  19.967   6.072   9.231
  804    H    ILE 101           H        ILE 101  17.678   4.121   3.024
  805    HA   ILE 101           HA       ILE 101  18.923   3.798   0.552
  806    HB   ILE 101           HB       ILE 101  16.153   2.893   1.384
  807   HG12  ILE 101          HG12      ILE 101  18.822   1.449   1.378
  808   HG13  ILE 101          HG13      ILE 101  17.952   2.005   2.804
  809   HG21  ILE 101          HG21      ILE 101  16.349   1.253  -0.437
  810   HG22  ILE 101          HG22      ILE 101  17.876   1.984  -0.930
  811   HG23  ILE 101          HG23      ILE 101  16.377   2.908  -1.044
  812   HD11  ILE 101          HD11      ILE 101  16.123   0.462   2.268
  813   HD12  ILE 101          HD12      ILE 101  17.658  -0.372   2.500
  814   HD13  ILE 101          HD13      ILE 101  17.034  -0.112   0.873
  815    H    MET 102           H        MET 102  15.592   4.947   1.105
  816    HA   MET 102           HA       MET 102  15.250   5.722  -1.605
  817    HB2  MET 102           HB2      MET 102  13.150   6.812  -0.783
  818    HB3  MET 102           HB3      MET 102  13.305   5.110  -0.379
  819    HG2  MET 102           HG2      MET 102  13.891   5.637   1.881
  820    HG3  MET 102           HG3      MET 102  13.954   7.347   1.499
  821    HE1  MET 102           HE1      MET 102  10.030   4.998   1.197
  822    HE2  MET 102           HE2      MET 102  11.594   4.229   1.465
  823    HE3  MET 102           HE3      MET 102  11.269   5.063  -0.058
  824    H    LYS 103           H        LYS 103  16.762   7.273   1.015
  825    HA   LYS 103           HA       LYS 103  16.322   9.951   0.046
  826    HB2  LYS 103           HB2      LYS 103  16.716   9.391   2.455
  827    HB3  LYS 103           HB3      LYS 103  18.376   8.992   2.043
  828    HG2  LYS 103           HG2      LYS 103  18.317  11.194   2.961
  829    HG3  LYS 103           HG3      LYS 103  18.690  11.310   1.241
  830    HD2  LYS 103           HD2      LYS 103  17.085  13.026   1.896
  831    HD3  LYS 103           HD3      LYS 103  16.348  11.880   0.775
  832    HE2  LYS 103           HE2      LYS 103  15.207  10.767   2.578
  833    HE3  LYS 103           HE3      LYS 103  16.059  11.744   3.773
  834    HZ1  LYS 103           HZ1      LYS 103  13.813  12.545   3.408
  835    HZ2  LYS 103           HZ2      LYS 103  14.127  12.774   1.764
  836    HZ3  LYS 103           HZ3      LYS 103  14.940  13.706   2.916
  837    H    ASN 104           H        ASN 104  19.013   7.622   0.024
  838    HA   ASN 104           HA       ASN 104  20.670   9.590  -1.357
  839    HB2  ASN 104           HB2      ASN 104  21.322   6.967  -0.024
  840    HB3  ASN 104           HB3      ASN 104  22.500   7.872  -0.967
  841   HD21  ASN 104          HD21      ASN 104  23.830   8.215   0.789
  842   HD22  ASN 104          HD22      ASN 104  23.419   9.309   2.062
  843    H    ILE 105           H        ILE 105  18.600   7.190  -2.340
  844    HA   ILE 105           HA       ILE 105  20.286   6.338  -4.560
  845    HB   ILE 105           HB       ILE 105  18.865   4.660  -3.463
  846   HG12  ILE 105          HG12      ILE 105  17.869   3.678  -5.522
  847   HG13  ILE 105          HG13      ILE 105  18.194   5.195  -6.355
  848   HG21  ILE 105          HG21      ILE 105  16.545   6.194  -4.617
  849   HG22  ILE 105          HG22      ILE 105  16.951   6.069  -2.907
  850   HG23  ILE 105          HG23      ILE 105  16.449   4.634  -3.801
  851   HD11  ILE 105          HD11      ILE 105  20.255   3.364  -5.146
  852   HD12  ILE 105          HD12      ILE 105  20.587   4.889  -5.967
  853   HD13  ILE 105          HD13      ILE 105  19.888   3.543  -6.862
  854    H    THR 106           H        THR 106  19.521   6.486  -6.749
  855    HA   THR 106           HA       THR 106  18.988   9.159  -7.414
  856    HB   THR 106           HB       THR 106  20.385   7.585  -8.720
  857    HG1  THR 106           HG1      THR 106  18.643   9.415  -9.649
  858   HG21  THR 106          HG21      THR 106  19.281   6.086 -10.341
  859   HG22  THR 106          HG22      THR 106  17.732   6.425  -9.571
  860   HG23  THR 106          HG23      THR 106  19.006   5.601  -8.669
  861    H    ALA 107           H        ALA 107  16.913   6.305  -7.302
  862    HA   ALA 107           HA       ALA 107  14.685   7.874  -8.368
  863    HB1  ALA 107           HB1      ALA 107  14.824   4.937  -7.695
  864    HB2  ALA 107           HB2      ALA 107  15.041   5.634  -9.301
  865    HB3  ALA 107           HB3      ALA 107  13.482   5.764  -8.488
  866    H    LYS 108           H        LYS 108  13.248   8.787  -7.033
  867    HA   LYS 108           HA       LYS 108  13.415   8.264  -4.205
  868    HB2  LYS 108           HB2      LYS 108  11.931  10.196  -5.921
  869    HB3  LYS 108           HB3      LYS 108  11.267   9.838  -4.336
  870    HG2  LYS 108           HG2      LYS 108  12.717  11.855  -4.414
  871    HG3  LYS 108           HG3      LYS 108  13.226  10.641  -3.242
  872    HD2  LYS 108           HD2      LYS 108  14.450  10.298  -5.871
  873    HD3  LYS 108           HD3      LYS 108  14.839  11.846  -5.114
  874    HE2  LYS 108           HE2      LYS 108  15.095   9.204  -3.676
  875    HE3  LYS 108           HE3      LYS 108  16.416   9.924  -4.608
  876    HZ1  LYS 108           HZ1      LYS 108  16.576  10.463  -2.261
  877    HZ2  LYS 108           HZ2      LYS 108  15.048  11.185  -2.292
  878    HZ3  LYS 108           HZ3      LYS 108  16.319  11.863  -3.175
  879    H    ARG 109           H        ARG 109  12.687   6.353  -3.622
  880    HA   ARG 109           HA       ARG 109  10.201   5.353  -4.804
  881    HB2  ARG 109           HB2      ARG 109  12.077   3.833  -3.002
  882    HB3  ARG 109           HB3      ARG 109  10.840   3.180  -4.063
  883    HG2  ARG 109           HG2      ARG 109  12.145   3.896  -6.007
  884    HG3  ARG 109           HG3      ARG 109  13.394   4.516  -4.925
  885    HD2  ARG 109           HD2      ARG 109  13.432   2.153  -3.937
  886    HD3  ARG 109           HD3      ARG 109  12.544   1.674  -5.384
  887    HE   ARG 109           HE       ARG 109  14.487   2.657  -6.648
  888   HH11  ARG 109          HH11      ARG 109  14.851   1.335  -3.422
  889   HH12  ARG 109          HH12      ARG 109  16.539   1.004  -3.608
  890   HH21  ARG 109          HH21      ARG 109  16.726   2.239  -6.890
  891   HH22  ARG 109          HH22      ARG 109  17.608   1.513  -5.583
  892    H    SER 110           H        SER 110   8.728   4.250  -3.349
  893    HA   SER 110           HA       SER 110   8.510   5.636  -0.786
  894    HB2  SER 110           HB2      SER 110   6.165   4.465  -0.887
  895    HB3  SER 110           HB3      SER 110   6.473   5.866  -1.911
  896    HG   SER 110           HG       SER 110   6.142   4.653  -3.568
  897    H    ARG 111           H        ARG 111   7.501   4.195   0.991
  898    HA   ARG 111           HA       ARG 111   9.484   2.275   1.602
  899    HB2  ARG 111           HB2      ARG 111   6.870   2.965   2.943
  900    HB3  ARG 111           HB3      ARG 111   8.022   1.812   3.606
  901    HG2  ARG 111           HG2      ARG 111   8.697   4.675   2.975
  902    HG3  ARG 111           HG3      ARG 111   8.172   4.112   4.561
  903    HD2  ARG 111           HD2      ARG 111  10.080   2.659   4.736
  904    HD3  ARG 111           HD3      ARG 111  10.560   3.024   3.082
  905    HE   ARG 111           HE       ARG 111  11.073   5.280   3.821
  906   HH11  ARG 111          HH11      ARG 111  10.685   2.842   6.311
  907   HH12  ARG 111          HH12      ARG 111  11.661   3.695   7.463
  908   HH21  ARG 111          HH21      ARG 111  12.285   6.429   5.383
  909   HH22  ARG 111          HH22      ARG 111  12.544   5.726   6.954
  910    H    ALA 112           H        ALA 112   6.098   1.995   0.629
  911    HA   ALA 112           HA       ALA 112   5.837  -0.776   0.882
  912    HB1  ALA 112           HB1      ALA 112   3.954   0.753   0.528
  913    HB2  ALA 112           HB2      ALA 112   3.949  -0.578  -0.629
  914    HB3  ALA 112           HB3      ALA 112   4.495   1.022  -1.126
  915    H    ARG 113           H        ARG 113   7.436   1.132  -1.535
  916    HA   ARG 113           HA       ARG 113   7.542  -1.014  -3.468
  917    HB2  ARG 113           HB2      ARG 113   8.761   1.739  -3.399
  918    HB3  ARG 113           HB3      ARG 113   9.049   0.595  -4.705
  919    HG2  ARG 113           HG2      ARG 113   6.378   1.706  -3.874
  920    HG3  ARG 113           HG3      ARG 113   7.307   2.166  -5.304
  921    HD2  ARG 113           HD2      ARG 113   5.702   0.628  -6.085
  922    HD3  ARG 113           HD3      ARG 113   7.222  -0.275  -5.961
  923    HE   ARG 113           HE       ARG 113   6.034  -0.743  -3.573
  924   HH11  ARG 113          HH11      ARG 113   4.699  -0.956  -6.788
  925   HH12  ARG 113          HH12      ARG 113   3.831  -2.426  -6.465
  926   HH21  ARG 113          HH21      ARG 113   4.859  -2.650  -3.126
  927   HH22  ARG 113          HH22      ARG 113   3.914  -3.378  -4.385
  928    H    ILE 114           H        ILE 114   9.578   0.345  -1.007
  929    HA   ILE 114           HA       ILE 114  11.879  -1.077  -1.982
  930    HB   ILE 114           HB       ILE 114  11.463   0.597   0.493
  931   HG12  ILE 114          HG12      ILE 114  13.006   1.049  -2.070
  932   HG13  ILE 114          HG13      ILE 114  11.471   1.796  -1.647
  933   HG21  ILE 114          HG21      ILE 114  13.996  -0.712  -0.485
  934   HG22  ILE 114          HG22      ILE 114  13.125  -1.112   0.994
  935   HG23  ILE 114          HG23      ILE 114  13.899   0.467   0.822
  936   HD11  ILE 114          HD11      ILE 114  13.337   3.332  -1.317
  937   HD12  ILE 114          HD12      ILE 114  14.080   2.202  -0.187
  938   HD13  ILE 114          HD13      ILE 114  12.542   2.966   0.213
  939    H    VAL 115           H        VAL 115   9.640  -1.329   0.767
  940    HA   VAL 115           HA       VAL 115  10.957  -3.490   2.015
  941    HB   VAL 115           HB       VAL 115   8.921  -3.886   3.271
  942   HG11  VAL 115          HG11      VAL 115  10.334  -2.002   3.932
  943   HG12  VAL 115          HG12      VAL 115   8.634  -1.706   4.302
  944   HG13  VAL 115          HG13      VAL 115   9.380  -0.934   2.903
  945   HG21  VAL 115          HG21      VAL 115   7.255  -3.680   1.526
  946   HG22  VAL 115          HG22      VAL 115   7.592  -1.956   1.375
  947   HG23  VAL 115          HG23      VAL 115   6.868  -2.585   2.855
  948    H    ASP 116           H        ASP 116   8.466  -3.335  -0.466
  949    HA   ASP 116           HA       ASP 116   7.812  -6.083  -0.449
  950    HB2  ASP 116           HB2      ASP 116   6.229  -4.655  -1.361
  951    HB3  ASP 116           HB3      ASP 116   7.398  -3.836  -2.393
  952    H    LYS 117           H        LYS 117  10.067  -4.188  -2.427
  953    HA   LYS 117           HA       LYS 117  10.820  -6.365  -4.084
  954    HB2  LYS 117           HB2      LYS 117  11.173  -3.977  -4.679
  955    HB3  LYS 117           HB3      LYS 117  12.395  -3.869  -3.422
  956    HG2  LYS 117           HG2      LYS 117  13.444  -4.120  -5.574
  957    HG3  LYS 117           HG3      LYS 117  13.732  -5.562  -4.598
  958    HD2  LYS 117           HD2      LYS 117  11.968  -6.741  -5.794
  959    HD3  LYS 117           HD3      LYS 117  11.619  -5.289  -6.738
  960    HE2  LYS 117           HE2      LYS 117  13.830  -5.363  -7.722
  961    HE3  LYS 117           HE3      LYS 117  14.258  -6.745  -6.718
  962    HZ1  LYS 117           HZ1      LYS 117  13.686  -7.465  -8.926
  963    HZ2  LYS 117           HZ2      LYS 117  12.178  -6.700  -8.838
  964    HZ3  LYS 117           HZ3      LYS 117  12.517  -8.021  -7.838
  965    H    LEU 118           H        LEU 118  11.868  -5.172  -0.986
  966    HA   LEU 118           HA       LEU 118  14.276  -6.623  -0.755
  967    HB2  LEU 118           HB2      LEU 118  12.974  -4.772   0.770
  968    HB3  LEU 118           HB3      LEU 118  12.721  -6.238   1.702
  969    HG   LEU 118           HG       LEU 118  15.209  -6.594   1.653
  970   HD11  LEU 118          HD11      LEU 118  15.719  -5.179  -0.271
  971   HD12  LEU 118          HD12      LEU 118  16.619  -4.664   1.155
  972   HD13  LEU 118          HD13      LEU 118  15.201  -3.756   0.633
  973   HD21  LEU 118          HD21      LEU 118  14.066  -5.722   3.603
  974   HD22  LEU 118          HD22      LEU 118  14.170  -4.082   2.953
  975   HD23  LEU 118          HD23      LEU 118  15.639  -4.949   3.409
  976    H    LEU 119           H        LEU 119  10.919  -7.384   0.091
  977    HA   LEU 119           HA       LEU 119  11.496  -9.859   1.361
  978    HB2  LEU 119           HB2      LEU 119   8.918  -9.232  -0.069
  979    HB3  LEU 119           HB3      LEU 119   9.162 -10.352   1.252
  980    HG   LEU 119           HG       LEU 119   8.751  -7.415   1.305
  981   HD11  LEU 119          HD11      LEU 119   7.416  -7.982   3.241
  982   HD12  LEU 119          HD12      LEU 119   7.971  -9.652   3.141
  983   HD13  LEU 119          HD13      LEU 119   6.972  -8.976   1.851
  984   HD21  LEU 119          HD21      LEU 119  10.269  -8.801   3.489
  985   HD22  LEU 119          HD22      LEU 119   9.716  -7.123   3.462
  986   HD23  LEU 119          HD23      LEU 119  10.963  -7.659   2.338
  987    H    ALA 120           H        ALA 120  11.292  -8.843  -1.894
  988    HA   ALA 120           HA       ALA 120  10.664 -11.404  -3.038
  989    HB1  ALA 120           HB1      ALA 120  10.022  -9.306  -4.141
  990    HB2  ALA 120           HB2      ALA 120  11.018 -10.325  -5.180
  991    HB3  ALA 120           HB3      ALA 120  11.727  -8.922  -4.380
  992    H    LEU 121           H        LEU 121  13.568  -9.366  -2.827
  993    HA   LEU 121           HA       LEU 121  15.402 -11.268  -3.812
  994    HB2  LEU 121           HB2      LEU 121  15.625  -8.918  -1.966
  995    HB3  LEU 121           HB3      LEU 121  16.993  -9.987  -2.183
  996    HG   LEU 121           HG       LEU 121  17.017  -9.469  -4.585
  997   HD11  LEU 121          HD11      LEU 121  15.662  -7.669  -5.476
  998   HD12  LEU 121          HD12      LEU 121  14.842  -7.491  -3.929
  999   HD13  LEU 121          HD13      LEU 121  14.633  -8.965  -4.874
 1000   HD21  LEU 121          HD21      LEU 121  17.050  -7.064  -2.770
 1001   HD22  LEU 121          HD22      LEU 121  17.810  -7.162  -4.360
 1002   HD23  LEU 121          HD23      LEU 121  18.388  -8.182  -3.041
 1003    H    GLY 122           H        GLY 122  13.674 -10.968  -0.883
 1004    HA2  GLY 122           HA2      GLY 122  13.550 -12.247   0.995
 1005    HA3  GLY 122           HA3      GLY 122  14.516 -13.467   0.156
 1006    H    LEU 123           H        LEU 123  15.504 -10.170   0.619
 1007    HA   LEU 123           HA       LEU 123  17.851 -10.819   2.091
 1008    HB2  LEU 123           HB2      LEU 123  16.358  -8.253   1.550
 1009    HB3  LEU 123           HB3      LEU 123  17.836  -8.292   2.507
 1010    HG   LEU 123           HG       LEU 123  17.593  -9.153  -0.381
 1011   HD11  LEU 123          HD11      LEU 123  18.817  -6.681   0.830
 1012   HD12  LEU 123          HD12      LEU 123  17.339  -6.750  -0.130
 1013   HD13  LEU 123          HD13      LEU 123  18.891  -7.142  -0.872
 1014   HD21  LEU 123          HD21      LEU 123  20.065  -9.198  -0.302
 1015   HD22  LEU 123          HD22      LEU 123  19.324 -10.403   0.750
 1016   HD23  LEU 123          HD23      LEU 123  19.990  -8.922   1.438
 1017    H    VAL 124           H        VAL 124  14.594 -10.235   2.765
 1018    HA   VAL 124           HA       VAL 124  15.004 -10.765   5.616
 1019    HB   VAL 124           HB       VAL 124  13.122  -9.211   6.128
 1020   HG11  VAL 124          HG11      VAL 124  15.514  -7.895   4.835
 1021   HG12  VAL 124          HG12      VAL 124  15.456  -8.527   6.479
 1022   HG13  VAL 124          HG13      VAL 124  14.441  -7.161   6.026
 1023   HG21  VAL 124          HG21      VAL 124  12.425  -7.582   4.486
 1024   HG22  VAL 124          HG22      VAL 124  12.191  -9.200   3.834
 1025   HG23  VAL 124          HG23      VAL 124  13.569  -8.227   3.312
 1026    H    ALA 125           H        ALA 125  12.879 -11.428   6.612
 1027    HA   ALA 125           HA       ALA 125  11.404 -13.126   4.706
 1028    HB1  ALA 125           HB1      ALA 125  10.784 -14.473   6.648
 1029    HB2  ALA 125           HB2      ALA 125  11.641 -13.353   7.706
 1030    HB3  ALA 125           HB3      ALA 125  12.535 -14.311   6.524
 1031    H    GLU 126           H        GLU 126  11.154 -10.232   6.226
 1032    HA   GLU 126           HA       GLU 126   8.370  -9.924   5.887
 1033    HB2  GLU 126           HB2      GLU 126   7.617  -9.792   8.145
 1034    HB3  GLU 126           HB3      GLU 126   8.455 -11.327   7.998
 1035    HG2  GLU 126           HG2      GLU 126  10.354 -10.505   9.146
 1036    HG3  GLU 126           HG3      GLU 126   9.770  -8.848   9.065
 1037    H    ARG 127           H        ARG 127   7.710  -7.771   7.068
 1038    HA   ARG 127           HA       ARG 127   9.646  -5.839   6.199
 1039    HB2  ARG 127           HB2      ARG 127   6.833  -5.686   7.205
 1040    HB3  ARG 127           HB3      ARG 127   7.795  -4.229   6.978
 1041    HG2  ARG 127           HG2      ARG 127   7.862  -4.454   4.709
 1042    HG3  ARG 127           HG3      ARG 127   7.645  -6.202   4.761
 1043    HD2  ARG 127           HD2      ARG 127   5.671  -5.155   3.871
 1044    HD3  ARG 127           HD3      ARG 127   5.315  -5.867   5.440
 1045    HE   ARG 127           HE       ARG 127   5.939  -3.268   6.001
 1046   HH11  ARG 127          HH11      ARG 127   3.615  -4.850   3.922
 1047   HH12  ARG 127          HH12      ARG 127   2.440  -3.584   4.049
 1048   HH21  ARG 127          HH21      ARG 127   4.393  -1.587   6.167
 1049   HH22  ARG 127          HH22      ARG 127   2.886  -1.718   5.314
 1050    H    ARG 128           H        ARG 128   8.800  -7.233   9.198
 1051    HA   ARG 128           HA       ARG 128   9.351  -5.085  10.935
 1052    HB2  ARG 128           HB2      ARG 128   8.102  -7.106  11.543
 1053    HB3  ARG 128           HB3      ARG 128   9.578  -8.050  11.425
 1054    HG2  ARG 128           HG2      ARG 128  10.532  -6.621  13.243
 1055    HG3  ARG 128           HG3      ARG 128   8.921  -5.916  13.435
 1056    HD2  ARG 128           HD2      ARG 128   9.922  -8.605  14.151
 1057    HD3  ARG 128           HD3      ARG 128   8.721  -7.594  14.956
 1058    HE   ARG 128           HE       ARG 128   8.207  -9.208  12.533
 1059   HH11  ARG 128          HH11      ARG 128   7.105  -7.783  15.552
 1060   HH12  ARG 128          HH12      ARG 128   5.519  -8.470  15.430
 1061   HH21  ARG 128          HH21      ARG 128   6.136 -10.078  12.374
 1062   HH22  ARG 128          HH22      ARG 128   4.965  -9.777  13.623
 1063    H    GLU 129           H        GLU 129  11.478  -7.457   9.435
 1064    HA   GLU 129           HA       GLU 129  13.629  -7.189  11.261
 1065    HB2  GLU 129           HB2      GLU 129  13.766  -8.051   8.374
 1066    HB3  GLU 129           HB3      GLU 129  14.974  -8.352   9.609
 1067    HG2  GLU 129           HG2      GLU 129  13.219  -9.671  10.842
 1068    HG3  GLU 129           HG3      GLU 129  12.228  -9.534   9.389
 1069    H    LEU 130           H        LEU 130  12.734  -5.447   8.366
 1070    HA   LEU 130           HA       LEU 130  15.347  -4.272   8.062
 1071    HB2  LEU 130           HB2      LEU 130  14.019  -2.904   6.275
 1072    HB3  LEU 130           HB3      LEU 130  14.459  -4.575   5.990
 1073    HG   LEU 130           HG       LEU 130  11.798  -4.122   7.217
 1074   HD11  LEU 130          HD11      LEU 130  10.794  -3.674   5.021
 1075   HD12  LEU 130          HD12      LEU 130  12.409  -3.443   4.350
 1076   HD13  LEU 130          HD13      LEU 130  11.801  -2.344   5.589
 1077   HD21  LEU 130          HD21      LEU 130  11.273  -5.844   5.395
 1078   HD22  LEU 130          HD22      LEU 130  12.288  -6.360   6.742
 1079   HD23  LEU 130          HD23      LEU 130  13.021  -5.958   5.187
 1080    H    TYR 131           H        TYR 131  13.347  -3.696  10.373
 1081    HA   TYR 131           HA       TYR 131  13.969  -0.820  10.398
 1082    HB2  TYR 131           HB2      TYR 131  11.456  -2.157  11.430
 1083    HB3  TYR 131           HB3      TYR 131  11.895  -0.486  11.769
 1084    HD1  TYR 131           HD1      TYR 131  12.191   1.079   9.750
 1085    HD2  TYR 131           HD2      TYR 131  10.236  -2.689   9.509
 1086    HE1  TYR 131           HE1      TYR 131  11.067   1.799   7.690
 1087    HE2  TYR 131           HE2      TYR 131   9.109  -1.982   7.446
 1088    HH   TYR 131           HH       TYR 131   8.484   0.029   6.285
 1089    H    LYS 132           H        LYS 132  15.723  -2.641  11.324
 1090    HA   LYS 132           HA       LYS 132  15.541  -2.323  14.231
 1091    HB2  LYS 132           HB2      LYS 132  16.308  -4.808  12.711
 1092    HB3  LYS 132           HB3      LYS 132  16.716  -4.574  14.406
 1093    HG2  LYS 132           HG2      LYS 132  13.910  -4.504  13.320
 1094    HG3  LYS 132           HG3      LYS 132  14.677  -5.938  14.009
 1095    HD2  LYS 132           HD2      LYS 132  14.833  -4.943  16.150
 1096    HD3  LYS 132           HD3      LYS 132  14.450  -3.343  15.517
 1097    HE2  LYS 132           HE2      LYS 132  12.575  -5.701  15.559
 1098    HE3  LYS 132           HE3      LYS 132  12.552  -4.356  16.701
 1099    HZ1  LYS 132           HZ1      LYS 132  12.128  -2.855  14.836
 1100    HZ2  LYS 132           HZ2      LYS 132  10.916  -4.020  14.989
 1101    HZ3  LYS 132           HZ3      LYS 132  12.082  -4.172  13.775
 1102    H    LYS 133           H        LYS 133  17.825  -3.035  15.161
 1103    HA   LYS 133           HA       LYS 133  19.768  -1.290  13.906
 1104    HB2  LYS 133           HB2      LYS 133  20.018  -2.935  16.428
 1105    HB3  LYS 133           HB3      LYS 133  21.111  -1.668  15.902
 1106    HG2  LYS 133           HG2      LYS 133  18.233  -1.273  16.683
 1107    HG3  LYS 133           HG3      LYS 133  19.637  -0.907  17.684
 1108    HD2  LYS 133           HD2      LYS 133  20.398   0.639  15.840
 1109    HD3  LYS 133           HD3      LYS 133  18.814   0.402  15.102
 1110    HE2  LYS 133           HE2      LYS 133  19.343   1.509  17.854
 1111    HE3  LYS 133           HE3      LYS 133  18.865   2.443  16.438
 1112    HZ1  LYS 133           HZ1      LYS 133  16.957   2.035  17.794
 1113    HZ2  LYS 133           HZ2      LYS 133  17.256   0.373  17.827
 1114    HZ3  LYS 133           HZ3      LYS 133  16.796   1.117  16.376
 1115    H    ARG 134           H        ARG 134  22.108  -2.151  13.931
 1116    HA   ARG 134           HA       ARG 134  22.319  -4.358  12.225
 1117    HB2  ARG 134           HB2      ARG 134  24.699  -4.127  12.351
 1118    HB3  ARG 134           HB3      ARG 134  23.994  -2.528  12.321
 1119    HG2  ARG 134           HG2      ARG 134  24.953  -3.891  14.821
 1120    HG3  ARG 134           HG3      ARG 134  25.942  -2.802  13.850
 1121    HD2  ARG 134           HD2      ARG 134  24.192  -1.042  14.222
 1122    HD3  ARG 134           HD3      ARG 134  23.414  -2.152  15.353
 1123    HE   ARG 134           HE       ARG 134  26.176  -1.715  15.958
 1124   HH11  ARG 134          HH11      ARG 134  22.945  -0.433  16.349
 1125   HH12  ARG 134          HH12      ARG 134  23.336   0.478  17.767
 1126   HH21  ARG 134          HH21      ARG 134  26.690  -0.530  17.844
 1127   HH22  ARG 134          HH22      ARG 134  25.460   0.405  18.634
 1128    H    GLN 135           H        GLN 135  21.054  -5.919  13.442
 1129    HA   GLN 135           HA       GLN 135  22.823  -7.483  15.197
 1130    HB2  GLN 135           HB2      GLN 135  20.949  -8.607  16.113
 1131    HB3  GLN 135           HB3      GLN 135  20.494  -6.910  16.069
 1132    HG2  GLN 135           HG2      GLN 135  19.748  -8.617  13.760
 1133    HG3  GLN 135           HG3      GLN 135  18.864  -8.824  15.270
 1134   HE21  GLN 135          HE21      GLN 135  18.032  -7.783  12.640
 1135   HE22  GLN 135          HE22      GLN 135  17.394  -6.209  12.948
 1136    H    LYS 136           H        LYS 136  22.510  -9.918  14.882
 1137    HA   LYS 136           HA       LYS 136  23.390 -10.834  12.464
 1138    HB2  LYS 136           HB2      LYS 136  21.504 -12.321  14.297
 1139    HB3  LYS 136           HB3      LYS 136  22.552 -13.049  13.094
 1140    HG2  LYS 136           HG2      LYS 136  24.511 -12.298  14.348
 1141    HG3  LYS 136           HG3      LYS 136  23.453 -11.569  15.557
 1142    HD2  LYS 136           HD2      LYS 136  23.528 -14.499  14.837
 1143    HD3  LYS 136           HD3      LYS 136  24.288 -13.780  16.256
 1144    HE2  LYS 136           HE2      LYS 136  22.110 -13.062  17.080
 1145    HE3  LYS 136           HE3      LYS 136  21.332 -13.715  15.641
 1146    HZ1  LYS 136           HZ1      LYS 136  22.818 -15.301  17.659
 1147    HZ2  LYS 136           HZ2      LYS 136  22.025 -15.919  16.297
 1148    HZ3  LYS 136           HZ3      LYS 136  21.135 -15.196  17.536
 1149    H    LYS 137           H        LYS 137  22.492 -11.594  10.556
 1150    HA   LYS 137           HA       LYS 137  19.822 -10.805   9.881
 1151    HB2  LYS 137           HB2      LYS 137  21.974 -11.304   8.358
 1152    HB3  LYS 137           HB3      LYS 137  21.250 -12.900   8.301
 1153    HG2  LYS 137           HG2      LYS 137  19.863 -10.352   7.481
 1154    HG3  LYS 137           HG3      LYS 137  20.653 -11.473   6.378
 1155    HD2  LYS 137           HD2      LYS 137  18.580 -12.345   6.183
 1156    HD3  LYS 137           HD3      LYS 137  18.990 -13.160   7.693
 1157    HE2  LYS 137           HE2      LYS 137  17.934 -11.317   8.943
 1158    HE3  LYS 137           HE3      LYS 137  17.481 -10.561   7.417
 1159    HZ1  LYS 137           HZ1      LYS 137  16.608 -13.271   8.265
 1160    HZ2  LYS 137           HZ2      LYS 137  16.078 -12.412   6.905
 1161    HZ3  LYS 137           HZ3      LYS 137  15.676 -11.866   8.461
 1162    H    LEU 138           H        LEU 138  18.310 -11.752  11.099
 1163    HA   LEU 138           HA       LEU 138  18.478 -14.309  12.242
 1164    HB2  LEU 138           HB2      LEU 138  16.013 -12.650  11.710
 1165    HB3  LEU 138           HB3      LEU 138  16.133 -13.976  12.846
 1166    HG   LEU 138           HG       LEU 138  17.658 -11.379  13.065
 1167   HD11  LEU 138          HD11      LEU 138  15.268 -11.047  13.391
 1168   HD12  LEU 138          HD12      LEU 138  16.142 -10.878  14.913
 1169   HD13  LEU 138          HD13      LEU 138  15.240 -12.354  14.575
 1170   HD21  LEU 138          HD21      LEU 138  17.382 -13.678  14.998
 1171   HD22  LEU 138          HD22      LEU 138  18.216 -12.157  15.312
 1172   HD23  LEU 138          HD23      LEU 138  18.831 -13.264  14.084
 1173    H    ALA 139           H        ALA 139  16.827 -16.031  11.911
 1174    HA   ALA 139           HA       ALA 139  16.722 -16.892   9.193
 1175    HB1  ALA 139           HB1      ALA 139  16.907 -18.396  11.183
 1176    HB2  ALA 139           HB2      ALA 139  15.632 -18.848  10.057
 1177    HB3  ALA 139           HB3      ALA 139  15.227 -18.020  11.561
 1178    H    SER 140           H        SER 140  14.006 -18.013   9.261
 1179    HA   SER 140           HA       SER 140  12.534 -15.872   8.188
 1180    HB2  SER 140           HB2      SER 140  12.120 -18.298   7.705
 1181    HB3  SER 140           HB3      SER 140  11.430 -18.458   9.318
 1182    HG   SER 140           HG       SER 140   9.734 -17.215   8.739
 1183    H    SER 141           H        SER 141  12.196 -14.120   9.462
 1184    HA   SER 141           HA       SER 141  11.483 -14.386  12.226
 1185    HB2  SER 141           HB2      SER 141  12.868 -12.507  11.313
 1186    HB3  SER 141           HB3      SER 141  11.437 -11.916  10.472
 1187    HG   SER 141           HG       SER 141  10.647 -11.177  12.281
  Start of MODEL   11
    1    H1   ASP   1           HT1      ASP   1 -26.882   1.527  -9.593
    2    H2   ASP   1           HT2      ASP   1 -26.977  -0.122  -9.944
    3    H3   ASP   1           HT3      ASP   1 -25.835   0.437  -8.837
    4    HA   ASP   1           HA       ASP   1 -28.760   0.598  -8.508
    5    HB2  ASP   1           HB2      ASP   1 -26.752  -1.378  -7.456
    6    HB3  ASP   1           HB3      ASP   1 -28.267  -1.078  -6.608
    7    HA   PRO   2           HA       PRO   2 -26.991   2.212  -4.455
    8    HB2  PRO   2           HB2      PRO   2 -24.409   2.191  -3.830
    9    HB3  PRO   2           HB3      PRO   2 -25.357   0.699  -3.787
   10    HG2  PRO   2           HG2      PRO   2 -23.475   1.685  -5.902
   11    HG3  PRO   2           HG3      PRO   2 -23.632   0.057  -5.216
   12    HD2  PRO   2           HD2      PRO   2 -24.764   0.853  -7.594
   13    HD3  PRO   2           HD3      PRO   2 -25.368  -0.483  -6.595
   14    H    SER   3           H        SER   3 -26.554   3.479  -7.259
   15    HA   SER   3           HA       SER   3 -24.844   5.732  -6.496
   16    HB2  SER   3           HB2      SER   3 -25.912   4.975  -9.223
   17    HB3  SER   3           HB3      SER   3 -24.711   6.219  -8.882
   18    HG   SER   3           HG       SER   3 -23.483   4.393  -7.887
   19    H    ARG   4           H        ARG   4 -27.791   5.181  -5.803
   20    HA   ARG   4           HA       ARG   4 -29.087   7.474  -7.040
   21    HB2  ARG   4           HB2      ARG   4 -30.108   5.535  -4.958
   22    HB3  ARG   4           HB3      ARG   4 -31.061   6.797  -5.721
   23    HG2  ARG   4           HG2      ARG   4 -30.599   5.684  -7.918
   24    HG3  ARG   4           HG3      ARG   4 -29.889   4.348  -7.007
   25    HD2  ARG   4           HD2      ARG   4 -32.185   3.824  -7.526
   26    HD3  ARG   4           HD3      ARG   4 -32.029   4.099  -5.793
   27    HE   ARG   4           HE       ARG   4 -33.128   6.082  -7.685
   28   HH11  ARG   4          HH11      ARG   4 -33.046   4.589  -4.517
   29   HH12  ARG   4          HH12      ARG   4 -34.379   5.513  -3.906
   30   HH21  ARG   4          HH21      ARG   4 -34.890   7.293  -6.883
   31   HH22  ARG   4          HH22      ARG   4 -35.438   7.047  -5.256
   32    H    ARG   5           H        ARG   5 -30.471   8.808  -5.335
   33    HA   ARG   5           HA       ARG   5 -28.623  10.184  -3.682
   34    HB2  ARG   5           HB2      ARG   5 -30.804  11.083  -4.746
   35    HB3  ARG   5           HB3      ARG   5 -31.614  10.363  -3.365
   36    HG2  ARG   5           HG2      ARG   5 -29.471  12.479  -3.232
   37    HG3  ARG   5           HG3      ARG   5 -31.201  12.757  -3.056
   38    HD2  ARG   5           HD2      ARG   5 -31.171  11.242  -1.069
   39    HD3  ARG   5           HD3      ARG   5 -29.416  11.150  -1.220
   40    HE   ARG   5           HE       ARG   5 -30.655  13.792  -0.936
   41   HH11  ARG   5          HH11      ARG   5 -28.740  11.222   0.475
   42   HH12  ARG   5          HH12      ARG   5 -28.190  12.192   1.801
   43   HH21  ARG   5          HH21      ARG   5 -29.920  15.067   0.808
   44   HH22  ARG   5          HH22      ARG   5 -28.856  14.378   1.990
   45    H    ALA   6           H        ALA   6 -27.723   8.857  -2.210
   46    HA   ALA   6           HA       ALA   6 -29.523   7.674  -0.212
   47    HB1  ALA   6           HB1      ALA   6 -26.683   6.889  -0.911
   48    HB2  ALA   6           HB2      ALA   6 -28.149   6.040  -1.408
   49    HB3  ALA   6           HB3      ALA   6 -27.713   6.116   0.296
   50    HA   PRO   7           HA       PRO   7 -27.937  10.469   2.896
   51    HB2  PRO   7           HB2      PRO   7 -27.790   8.081   4.654
   52    HB3  PRO   7           HB3      PRO   7 -28.614   9.623   4.912
   53    HG2  PRO   7           HG2      PRO   7 -29.997   7.435   4.308
   54    HG3  PRO   7           HG3      PRO   7 -30.446   9.008   3.622
   55    HD2  PRO   7           HD2      PRO   7 -28.982   6.728   2.351
   56    HD3  PRO   7           HD3      PRO   7 -30.216   7.800   1.660
   57    H    THR   8           H        THR   8 -26.177  10.471   4.669
   58    HA   THR   8           HA       THR   8 -23.693   9.700   3.380
   59    HB   THR   8           HB       THR   8 -23.933  11.986   4.197
   60    HG1  THR   8           HG1      THR   8 -21.996  10.952   5.912
   61   HG21  THR   8          HG21      THR   8 -24.005  10.777   6.954
   62   HG22  THR   8          HG22      THR   8 -25.362  11.562   6.145
   63   HG23  THR   8          HG23      THR   8 -23.933  12.498   6.580
   64    H    TRP   9           H        TRP   9 -21.919   8.809   4.656
   65    HA   TRP   9           HA       TRP   9 -22.628   6.459   5.961
   66    HB2  TRP   9           HB2      TRP   9 -20.039   7.994   6.102
   67    HB3  TRP   9           HB3      TRP   9 -20.259   6.384   6.762
   68    HD1  TRP   9           HD1      TRP   9 -19.553   8.234   3.575
   69    HE1  TRP   9           HE1      TRP   9 -19.035   6.540   1.714
   70    HE3  TRP   9           HE3      TRP   9 -21.003   3.917   5.941
   71    HZ2  TRP   9           HZ2      TRP   9 -19.174   3.768   1.319
   72    HZ3  TRP   9           HZ3      TRP   9 -20.783   1.777   4.707
   73    HH2  TRP   9           HH2      TRP   9 -19.881   1.731   2.456
   74    H    SER  10           H        SER  10 -23.809   6.485   7.792
   75    HA   SER  10           HA       SER  10 -23.146   8.162  10.028
   76    HB2  SER  10           HB2      SER  10 -25.426   7.272   9.756
   77    HB3  SER  10           HB3      SER  10 -24.810   5.624   9.826
   78    HG   SER  10           HG       SER  10 -25.218   7.469  11.865
   79    HA   PRO  11           HA       PRO  11 -19.662   5.890  11.712
   80    HB2  PRO  11           HB2      PRO  11 -21.279   5.783  14.226
   81    HB3  PRO  11           HB3      PRO  11 -19.589   6.251  13.996
   82    HG2  PRO  11           HG2      PRO  11 -21.443   8.111  14.357
   83    HG3  PRO  11           HG3      PRO  11 -20.145   8.355  13.177
   84    HD2  PRO  11           HD2      PRO  11 -23.013   7.677  12.724
   85    HD3  PRO  11           HD3      PRO  11 -21.919   8.675  11.745
   86    H    GLU  12           H        GLU  12 -22.922   4.745  12.424
   87    HA   GLU  12           HA       GLU  12 -22.129   2.045  12.956
   88    HB2  GLU  12           HB2      GLU  12 -24.837   3.226  12.329
   89    HB3  GLU  12           HB3      GLU  12 -24.554   1.583  12.896
   90    HG2  GLU  12           HG2      GLU  12 -23.652   2.426  14.974
   91    HG3  GLU  12           HG3      GLU  12 -23.833   4.084  14.403
   92    H    GLU  13           H        GLU  13 -22.859   3.883  10.127
   93    HA   GLU  13           HA       GLU  13 -23.564   1.677   8.453
   94    HB2  GLU  13           HB2      GLU  13 -24.066   4.190   8.080
   95    HB3  GLU  13           HB3      GLU  13 -22.429   4.274   7.441
   96    HG2  GLU  13           HG2      GLU  13 -24.115   3.983   5.685
   97    HG3  GLU  13           HG3      GLU  13 -22.966   2.642   5.742
   98    H    GLU  14           H        GLU  14 -20.622   3.303   9.377
   99    HA   GLU  14           HA       GLU  14 -18.887   2.047   7.516
  100    HB2  GLU  14           HB2      GLU  14 -18.286   3.088  10.298
  101    HB3  GLU  14           HB3      GLU  14 -17.097   2.725   9.052
  102    HG2  GLU  14           HG2      GLU  14 -17.942   4.486   7.656
  103    HG3  GLU  14           HG3      GLU  14 -19.260   4.798   8.784
  104    H    ALA  15           H        ALA  15 -20.055   1.221  10.745
  105    HA   ALA  15           HA       ALA  15 -18.572  -1.193  11.005
  106    HB1  ALA  15           HB1      ALA  15 -20.129  -1.728  12.820
  107    HB2  ALA  15           HB2      ALA  15 -21.161  -0.382  12.331
  108    HB3  ALA  15           HB3      ALA  15 -19.536  -0.072  12.944
  109    H    HIS  16           H        HIS  16 -21.662  -0.381   9.609
  110    HA   HIS  16           HA       HIS  16 -22.452  -3.046   9.003
  111    HB2  HIS  16           HB2      HIS  16 -24.096  -1.221   9.252
  112    HB3  HIS  16           HB3      HIS  16 -23.418  -0.424   7.837
  113    HD1  HIS  16           HD1      HIS  16 -25.290  -0.583   6.217
  114    HD2  HIS  16           HD2      HIS  16 -24.452  -4.229   8.004
  115    HE1  HIS  16           HE1      HIS  16 -26.716  -2.288   5.013
  116    HE2  HIS  16           HE2      HIS  16 -26.371  -4.422   6.292
  117    H    LEU  17           H        LEU  17 -20.333  -0.760   7.622
  118    HA   LEU  17           HA       LEU  17 -20.425  -1.721   4.935
  119    HB2  LEU  17           HB2      LEU  17 -19.652   0.571   5.764
  120    HB3  LEU  17           HB3      LEU  17 -18.170  -0.212   6.260
  121    HG   LEU  17           HG       LEU  17 -18.330   1.046   3.964
  122   HD11  LEU  17          HD11      LEU  17 -16.354  -0.126   4.774
  123   HD12  LEU  17          HD12      LEU  17 -16.608  -0.405   3.050
  124   HD13  LEU  17          HD13      LEU  17 -17.032  -1.658   4.219
  125   HD21  LEU  17          HD21      LEU  17 -18.900  -0.405   2.114
  126   HD22  LEU  17          HD22      LEU  17 -20.288  -0.211   3.183
  127   HD23  LEU  17          HD23      LEU  17 -19.337  -1.695   3.230
  128    H    ARG  18           H        ARG  18 -18.180  -2.118   7.671
  129    HA   ARG  18           HA       ARG  18 -16.694  -4.213   6.457
  130    HB2  ARG  18           HB2      ARG  18 -15.745  -4.587   8.654
  131    HB3  ARG  18           HB3      ARG  18 -15.873  -2.852   8.398
  132    HG2  ARG  18           HG2      ARG  18 -17.869  -2.767   9.756
  133    HG3  ARG  18           HG3      ARG  18 -17.827  -4.515   9.962
  134    HD2  ARG  18           HD2      ARG  18 -15.647  -4.283  11.107
  135    HD3  ARG  18           HD3      ARG  18 -15.796  -2.529  10.970
  136    HE   ARG  18           HE       ARG  18 -18.070  -3.752  12.208
  137   HH11  ARG  18          HH11      ARG  18 -14.818  -2.618  12.829
  138   HH12  ARG  18          HH12      ARG  18 -15.134  -2.238  14.492
  139   HH21  ARG  18          HH21      ARG  18 -18.486  -3.283  14.389
  140   HH22  ARG  18          HH22      ARG  18 -17.229  -2.623  15.385
  141    H    GLU  19           H        GLU  19 -19.655  -3.954   8.225
  142    HA   GLU  19           HA       GLU  19 -20.033  -6.488   9.210
  143    HB2  GLU  19           HB2      GLU  19 -21.505  -4.571   9.662
  144    HB3  GLU  19           HB3      GLU  19 -22.139  -4.687   8.026
  145    HG2  GLU  19           HG2      GLU  19 -23.702  -5.670   9.526
  146    HG3  GLU  19           HG3      GLU  19 -22.967  -6.949   8.563
  147    H    LEU  20           H        LEU  20 -20.877  -5.206   6.033
  148    HA   LEU  20           HA       LEU  20 -21.910  -7.691   5.056
  149    HB2  LEU  20           HB2      LEU  20 -22.015  -4.999   4.309
  150    HB3  LEU  20           HB3      LEU  20 -21.145  -5.788   3.009
  151    HG   LEU  20           HG       LEU  20 -23.801  -6.815   3.991
  152   HD11  LEU  20          HD11      LEU  20 -24.849  -5.576   2.180
  153   HD12  LEU  20          HD12      LEU  20 -23.300  -4.846   1.764
  154   HD13  LEU  20          HD13      LEU  20 -24.062  -4.475   3.309
  155   HD21  LEU  20          HD21      LEU  20 -22.397  -8.321   2.643
  156   HD22  LEU  20          HD22      LEU  20 -22.348  -7.107   1.365
  157   HD23  LEU  20          HD23      LEU  20 -23.881  -7.860   1.807
  158    H    TYR  21           H        TYR  21 -18.826  -6.073   5.053
  159    HA   TYR  21           HA       TYR  21 -17.625  -7.574   2.954
  160    HB2  TYR  21           HB2      TYR  21 -16.624  -5.472   3.559
  161    HB3  TYR  21           HB3      TYR  21 -16.452  -5.975   5.236
  162    HD1  TYR  21           HD1      TYR  21 -14.472  -6.967   5.969
  163    HD2  TYR  21           HD2      TYR  21 -15.258  -6.776   1.791
  164    HE1  TYR  21           HE1      TYR  21 -12.199  -7.785   5.507
  165    HE2  TYR  21           HE2      TYR  21 -12.990  -7.590   1.319
  166    HH   TYR  21           HH       TYR  21 -10.800  -7.674   2.413
  167    H    LEU  22           H        LEU  22 -17.482  -7.758   6.481
  168    HA   LEU  22           HA       LEU  22 -15.784  -9.977   6.655
  169    HB2  LEU  22           HB2      LEU  22 -17.936  -9.201   8.621
  170    HB3  LEU  22           HB3      LEU  22 -16.489 -10.124   8.954
  171    HG   LEU  22           HG       LEU  22 -16.543  -7.220   8.143
  172   HD11  LEU  22          HD11      LEU  22 -16.027  -8.479  10.827
  173   HD12  LEU  22          HD12      LEU  22 -17.449  -7.541  10.367
  174   HD13  LEU  22          HD13      LEU  22 -15.867  -6.767  10.437
  175   HD21  LEU  22          HD21      LEU  22 -14.511  -8.394   7.425
  176   HD22  LEU  22          HD22      LEU  22 -14.237  -8.913   9.087
  177   HD23  LEU  22          HD23      LEU  22 -14.189  -7.197   8.677
  178    H    ALA  23           H        ALA  23 -19.216  -9.723   6.164
  179    HA   ALA  23           HA       ALA  23 -19.793 -12.458   6.790
  180    HB1  ALA  23           HB1      ALA  23 -21.488 -10.424   5.346
  181    HB2  ALA  23           HB2      ALA  23 -21.448 -10.673   7.092
  182    HB3  ALA  23           HB3      ALA  23 -22.041 -11.952   6.032
  183    H    ASN  24           H        ASN  24 -18.745 -10.780   3.918
  184    HA   ASN  24           HA       ASN  24 -19.309 -13.214   2.351
  185    HB2  ASN  24           HB2      ASN  24 -19.381 -10.342   1.418
  186    HB3  ASN  24           HB3      ASN  24 -19.522 -11.741   0.359
  187   HD21  ASN  24          HD21      ASN  24 -21.052  -9.859   2.840
  188   HD22  ASN  24          HD22      ASN  24 -22.647 -10.502   2.626
  189    H    LYS  25           H        LYS  25 -16.843 -12.058   3.834
  190    HA   LYS  25           HA       LYS  25 -14.970 -11.725   1.644
  191    HB2  LYS  25           HB2      LYS  25 -13.296 -11.343   3.337
  192    HB3  LYS  25           HB3      LYS  25 -14.739 -10.422   3.744
  193    HG2  LYS  25           HG2      LYS  25 -15.364 -12.098   5.394
  194    HG3  LYS  25           HG3      LYS  25 -13.946 -13.060   4.966
  195    HD2  LYS  25           HD2      LYS  25 -12.504 -11.180   5.650
  196    HD3  LYS  25           HD3      LYS  25 -13.939 -10.280   6.143
  197    HE2  LYS  25           HE2      LYS  25 -12.912 -11.318   8.072
  198    HE3  LYS  25           HE3      LYS  25 -14.477 -12.060   7.751
  199    HZ1  LYS  25           HZ1      LYS  25 -12.763 -13.696   8.280
  200    HZ2  LYS  25           HZ2      LYS  25 -11.856 -13.197   6.948
  201    HZ3  LYS  25           HZ3      LYS  25 -13.370 -13.930   6.715
  202    H    ASP  26           H        ASP  26 -16.324 -14.304   3.288
  203    HA   ASP  26           HA       ASP  26 -13.925 -15.974   3.046
  204    HB2  ASP  26           HB2      ASP  26 -16.295 -16.036   4.831
  205    HB3  ASP  26           HB3      ASP  26 -15.616 -17.589   4.360
  206    H    VAL  27           H        VAL  27 -16.609 -15.253   1.279
  207    HA   VAL  27           HA       VAL  27 -16.948 -17.946   0.242
  208    HB   VAL  27           HB       VAL  27 -19.006 -16.754   0.413
  209   HG11  VAL  27          HG11      VAL  27 -19.427 -14.654  -0.743
  210   HG12  VAL  27          HG12      VAL  27 -17.724 -14.592  -1.199
  211   HG13  VAL  27          HG13      VAL  27 -18.184 -14.517   0.501
  212   HG21  VAL  27          HG21      VAL  27 -18.110 -16.872  -2.457
  213   HG22  VAL  27          HG22      VAL  27 -19.784 -16.726  -1.929
  214   HG23  VAL  27          HG23      VAL  27 -18.856 -18.173  -1.531
  215    H    GLU  28           H        GLU  28 -15.474 -18.666  -1.088
  216    HA   GLU  28           HA       GLU  28 -13.922 -16.815  -2.694
  217    HB2  GLU  28           HB2      GLU  28 -13.672 -19.797  -2.302
  218    HB3  GLU  28           HB3      GLU  28 -12.542 -18.794  -3.202
  219    HG2  GLU  28           HG2      GLU  28 -12.017 -17.547  -1.181
  220    HG3  GLU  28           HG3      GLU  28 -13.171 -18.523  -0.272
  221    H    GLY  29           H        GLY  29 -13.666 -17.015  -4.935
  222    HA2  GLY  29           HA2      GLY  29 -14.359 -17.543  -7.107
  223    HA3  GLY  29           HA3      GLY  29 -15.591 -18.605  -6.432
  224    H    GLN  30           H        GLN  30 -15.531 -15.693  -4.856
  225    HA   GLN  30           HA       GLN  30 -17.731 -14.607  -6.478
  226    HB2  GLN  30           HB2      GLN  30 -18.808 -15.453  -4.598
  227    HB3  GLN  30           HB3      GLN  30 -17.454 -15.114  -3.541
  228    HG2  GLN  30           HG2      GLN  30 -18.902 -12.795  -4.678
  229    HG3  GLN  30           HG3      GLN  30 -19.725 -13.754  -3.451
  230   HE21  GLN  30          HE21      GLN  30 -19.667 -12.162  -1.918
  231   HE22  GLN  30          HE22      GLN  30 -18.215 -11.655  -1.131
  232    H    ASP  31           H        ASP  31 -17.986 -12.277  -6.357
  233    HA   ASP  31           HA       ASP  31 -15.486 -10.846  -5.870
  234    HB2  ASP  31           HB2      ASP  31 -16.911 -10.484  -7.948
  235    HB3  ASP  31           HB3      ASP  31 -18.092  -9.727  -6.883
  236    H    VAL  32           H        VAL  32 -15.159  -9.995  -3.886
  237    HA   VAL  32           HA       VAL  32 -17.234 -10.071  -1.942
  238    HB   VAL  32           HB       VAL  32 -14.779 -10.454  -1.481
  239   HG11  VAL  32          HG11      VAL  32 -13.807  -8.584  -2.634
  240   HG12  VAL  32          HG12      VAL  32 -13.440  -8.444  -0.914
  241   HG13  VAL  32          HG13      VAL  32 -14.707  -7.443  -1.631
  242   HG21  VAL  32          HG21      VAL  32 -16.360 -10.252   0.324
  243   HG22  VAL  32          HG22      VAL  32 -16.286  -8.491   0.239
  244   HG23  VAL  32          HG23      VAL  32 -14.871  -9.409   0.757
  245    H    VAL  33           H        VAL  33 -15.828  -7.524  -3.917
  246    HA   VAL  33           HA       VAL  33 -16.947  -5.422  -2.320
  247    HB   VAL  33           HB       VAL  33 -15.891  -3.909  -3.701
  248   HG11  VAL  33          HG11      VAL  33 -13.685  -4.825  -4.263
  249   HG12  VAL  33          HG12      VAL  33 -14.331  -6.451  -4.042
  250   HG13  VAL  33          HG13      VAL  33 -14.256  -5.341  -2.675
  251   HG21  VAL  33          HG21      VAL  33 -15.230  -4.289  -6.032
  252   HG22  VAL  33          HG22      VAL  33 -16.969  -4.459  -5.805
  253   HG23  VAL  33          HG23      VAL  33 -15.959  -5.894  -5.969
  254    H    GLU  34           H        GLU  34 -17.742  -7.115  -5.290
  255    HA   GLU  34           HA       GLU  34 -19.978  -5.596  -6.060
  256    HB2  GLU  34           HB2      GLU  34 -18.774  -7.405  -7.374
  257    HB3  GLU  34           HB3      GLU  34 -19.650  -8.576  -6.404
  258    HG2  GLU  34           HG2      GLU  34 -20.764  -8.321  -8.492
  259    HG3  GLU  34           HG3      GLU  34 -21.768  -7.610  -7.230
  260    H    ALA  35           H        ALA  35 -19.495  -8.003  -3.603
  261    HA   ALA  35           HA       ALA  35 -22.236  -8.589  -3.095
  262    HB1  ALA  35           HB1      ALA  35 -20.429 -10.068  -2.349
  263    HB2  ALA  35           HB2      ALA  35 -21.431  -9.549  -0.995
  264    HB3  ALA  35           HB3      ALA  35 -19.852  -8.811  -1.253
  265    H    ILE  36           H        ILE  36 -19.870  -6.447  -1.547
  266    HA   ILE  36           HA       ILE  36 -21.705  -5.354   0.313
  267    HB   ILE  36           HB       ILE  36 -19.191  -4.032  -0.697
  268   HG12  ILE  36          HG12      ILE  36 -19.394  -5.917   1.652
  269   HG13  ILE  36          HG13      ILE  36 -18.946  -6.476   0.044
  270   HG21  ILE  36          HG21      ILE  36 -20.633  -3.895   1.948
  271   HG22  ILE  36          HG22      ILE  36 -20.678  -2.663   0.689
  272   HG23  ILE  36          HG23      ILE  36 -19.164  -3.019   1.521
  273   HD11  ILE  36          HD11      ILE  36 -16.997  -6.099   1.420
  274   HD12  ILE  36          HD12      ILE  36 -17.480  -4.424   1.674
  275   HD13  ILE  36          HD13      ILE  36 -17.028  -4.978   0.062
  276    H    LEU  37           H        LEU  37 -20.289  -4.048  -2.670
  277    HA   LEU  37           HA       LEU  37 -21.440  -1.582  -2.858
  278    HB2  LEU  37           HB2      LEU  37 -20.904  -3.640  -4.985
  279    HB3  LEU  37           HB3      LEU  37 -21.497  -2.042  -5.385
  280    HG   LEU  37           HG       LEU  37 -18.927  -2.413  -3.828
  281   HD11  LEU  37          HD11      LEU  37 -17.734  -2.312  -5.934
  282   HD12  LEU  37          HD12      LEU  37 -19.251  -2.266  -6.830
  283   HD13  LEU  37          HD13      LEU  37 -18.802  -3.715  -5.930
  284   HD21  LEU  37          HD21      LEU  37 -20.178  -0.187  -4.037
  285   HD22  LEU  37          HD22      LEU  37 -19.749  -0.242  -5.746
  286   HD23  LEU  37          HD23      LEU  37 -18.483  -0.206  -4.518
  287    H    ALA  38           H        ALA  38 -22.985  -4.647  -3.625
  288    HA   ALA  38           HA       ALA  38 -25.222  -3.310  -4.885
  289    HB1  ALA  38           HB1      ALA  38 -24.660  -6.228  -4.501
  290    HB2  ALA  38           HB2      ALA  38 -24.186  -5.263  -5.898
  291    HB3  ALA  38           HB3      ALA  38 -25.895  -5.531  -5.549
  292    H    HIS  39           H        HIS  39 -24.594  -4.829  -1.778
  293    HA   HIS  39           HA       HIS  39 -27.395  -5.537  -1.493
  294    HB2  HIS  39           HB2      HIS  39 -24.969  -6.138   0.152
  295    HB3  HIS  39           HB3      HIS  39 -26.581  -6.359   0.822
  296    HD1  HIS  39           HD1      HIS  39 -28.109  -8.175  -0.344
  297    HD2  HIS  39           HD2      HIS  39 -24.149  -8.120  -1.609
  298    HE1  HIS  39           HE1      HIS  39 -27.746 -10.363  -1.526
  299    HE2  HIS  39           HE2      HIS  39 -25.302 -10.379  -2.121
  300    H    LEU  40           H        LEU  40 -25.255  -3.023  -0.322
  301    HA   LEU  40           HA       LEU  40 -27.518  -2.155   1.332
  302    HB2  LEU  40           HB2      LEU  40 -26.222  -1.597   3.117
  303    HB3  LEU  40           HB3      LEU  40 -25.374  -2.990   2.518
  304    HG   LEU  40           HG       LEU  40 -24.522  -0.144   2.024
  305   HD11  LEU  40          HD11      LEU  40 -24.410  -0.685   4.391
  306   HD12  LEU  40          HD12      LEU  40 -22.792  -0.584   3.696
  307   HD13  LEU  40          HD13      LEU  40 -23.516  -2.160   4.023
  308   HD21  LEU  40          HD21      LEU  40 -22.382  -1.119   1.422
  309   HD22  LEU  40          HD22      LEU  40 -23.673  -1.673   0.341
  310   HD23  LEU  40          HD23      LEU  40 -23.062  -2.740   1.609
  311    H    ASN  41           H        ASN  41 -28.494  -0.741   0.079
  312    HA   ASN  41           HA       ASN  41 -26.990   1.265  -1.410
  313    HB2  ASN  41           HB2      ASN  41 -29.948   0.624  -1.296
  314    HB3  ASN  41           HB3      ASN  41 -29.247   1.879  -2.311
  315   HD21  ASN  41          HD21      ASN  41 -29.688  -1.520  -1.858
  316   HD22  ASN  41          HD22      ASN  41 -29.055  -2.015  -3.387
  317    H    THR  42           H        THR  42 -26.731   1.532   1.291
  318    HA   THR  42           HA       THR  42 -28.654   3.350   2.403
  319    HB   THR  42           HB       THR  42 -27.728   1.815   3.921
  320    HG1  THR  42           HG1      THR  42 -26.613   3.212   5.426
  321   HG21  THR  42          HG21      THR  42 -25.022   2.671   2.881
  322   HG22  THR  42          HG22      THR  42 -25.776   1.078   2.757
  323   HG23  THR  42          HG23      THR  42 -25.247   1.679   4.326
  324    H    VAL  43           H        VAL  43 -25.553   3.630   0.842
  325    HA   VAL  43           HA       VAL  43 -25.734   6.531   0.980
  326    HB   VAL  43           HB       VAL  43 -24.227   6.524   2.685
  327   HG11  VAL  43          HG11      VAL  43 -24.200   4.258   3.231
  328   HG12  VAL  43          HG12      VAL  43 -22.508   4.698   3.008
  329   HG13  VAL  43          HG13      VAL  43 -23.363   3.816   1.740
  330   HG21  VAL  43          HG21      VAL  43 -22.597   6.212   0.225
  331   HG22  VAL  43          HG22      VAL  43 -21.792   6.230   1.790
  332   HG23  VAL  43          HG23      VAL  43 -22.775   7.603   1.297
  333    HA   PRO  44           HA       PRO  44 -25.007   6.064  -3.300
  334    HB2  PRO  44           HB2      PRO  44 -23.775   8.362  -4.019
  335    HB3  PRO  44           HB3      PRO  44 -25.471   8.309  -3.520
  336    HG2  PRO  44           HG2      PRO  44 -23.047   9.025  -1.898
  337    HG3  PRO  44           HG3      PRO  44 -24.595   9.882  -2.017
  338    HD2  PRO  44           HD2      PRO  44 -24.052   8.259   0.043
  339    HD3  PRO  44           HD3      PRO  44 -25.682   8.362  -0.642
  340    H    ARG  45           H        ARG  45 -23.586   4.465  -3.850
  341    HA   ARG  45           HA       ARG  45 -20.762   4.918  -3.197
  342    HB2  ARG  45           HB2      ARG  45 -21.862   2.274  -4.051
  343    HB3  ARG  45           HB3      ARG  45 -20.419   2.627  -3.112
  344    HG2  ARG  45           HG2      ARG  45 -23.232   2.987  -2.146
  345    HG3  ARG  45           HG3      ARG  45 -22.212   1.591  -1.808
  346    HD2  ARG  45           HD2      ARG  45 -20.626   3.712  -1.071
  347    HD3  ARG  45           HD3      ARG  45 -22.238   4.241  -0.604
  348    HE   ARG  45           HE       ARG  45 -20.676   2.415   0.768
  349   HH11  ARG  45          HH11      ARG  45 -23.958   2.655  -0.427
  350   HH12  ARG  45          HH12      ARG  45 -24.598   1.578   0.777
  351   HH21  ARG  45          HH21      ARG  45 -21.548   1.132   2.430
  352   HH22  ARG  45          HH22      ARG  45 -23.243   0.788   2.445
  353    H    THR  46           H        THR  46 -19.363   5.277  -4.748
  354    HA   THR  46           HA       THR  46 -19.683   4.058  -7.360
  355    HB   THR  46           HB       THR  46 -17.302   4.885  -7.644
  356    HG1  THR  46           HG1      THR  46 -17.432   6.618  -5.542
  357   HG21  THR  46          HG21      THR  46 -19.369   6.917  -6.796
  358   HG22  THR  46          HG22      THR  46 -19.189   6.230  -8.412
  359   HG23  THR  46          HG23      THR  46 -17.928   7.271  -7.750
  360    H    ARG  47           H        ARG  47 -17.728   2.534  -7.973
  361    HA   ARG  47           HA       ARG  47 -17.619   0.357  -6.209
  362    HB2  ARG  47           HB2      ARG  47 -16.199   1.161  -8.675
  363    HB3  ARG  47           HB3      ARG  47 -15.332   0.028  -7.649
  364    HG2  ARG  47           HG2      ARG  47 -16.674  -1.052  -9.420
  365    HG3  ARG  47           HG3      ARG  47 -17.106  -1.568  -7.794
  366    HD2  ARG  47           HD2      ARG  47 -19.088  -1.208  -9.179
  367    HD3  ARG  47           HD3      ARG  47 -19.039  -0.092  -7.818
  368    HE   ARG  47           HE       ARG  47 -17.863   1.215  -9.972
  369   HH11  ARG  47          HH11      ARG  47 -20.991  -0.183  -9.221
  370   HH12  ARG  47          HH12      ARG  47 -21.878   0.983 -10.149
  371   HH21  ARG  47          HH21      ARG  47 -19.036   2.755 -11.193
  372   HH22  ARG  47          HH22      ARG  47 -20.772   2.657 -11.255
  373    H    LYS  48           H        LYS  48 -15.478   3.061  -6.709
  374    HA   LYS  48           HA       LYS  48 -13.376   2.409  -5.010
  375    HB2  LYS  48           HB2      LYS  48 -13.134   4.166  -6.564
  376    HB3  LYS  48           HB3      LYS  48 -14.556   5.002  -5.962
  377    HG2  LYS  48           HG2      LYS  48 -13.190   5.204  -3.765
  378    HG3  LYS  48           HG3      LYS  48 -11.809   4.867  -4.810
  379    HD2  LYS  48           HD2      LYS  48 -12.043   7.240  -4.673
  380    HD3  LYS  48           HD3      LYS  48 -12.568   6.743  -6.282
  381    HE2  LYS  48           HE2      LYS  48 -14.932   6.748  -5.398
  382    HE3  LYS  48           HE3      LYS  48 -14.300   7.488  -3.930
  383    HZ1  LYS  48           HZ1      LYS  48 -13.474   9.332  -5.276
  384    HZ2  LYS  48           HZ2      LYS  48 -15.147   9.161  -5.438
  385    HZ3  LYS  48           HZ3      LYS  48 -14.118   8.624  -6.668
  386    H    GLN  49           H        GLN  49 -16.535   3.772  -4.279
  387    HA   GLN  49           HA       GLN  49 -16.052   5.030  -1.861
  388    HB2  GLN  49           HB2      GLN  49 -18.397   4.023  -3.247
  389    HB3  GLN  49           HB3      GLN  49 -18.559   3.877  -1.505
  390    HG2  GLN  49           HG2      GLN  49 -17.501   6.462  -2.304
  391    HG3  GLN  49           HG3      GLN  49 -19.082   6.128  -3.008
  392   HE21  GLN  49          HE21      GLN  49 -20.884   6.083  -1.708
  393   HE22  GLN  49          HE22      GLN  49 -20.852   6.527  -0.035
  394    H    ILE  50           H        ILE  50 -17.299   1.674  -2.167
  395    HA   ILE  50           HA       ILE  50 -16.997   1.175   0.603
  396    HB   ILE  50           HB       ILE  50 -17.420  -0.664  -1.733
  397   HG12  ILE  50          HG12      ILE  50 -19.414  -1.117   0.048
  398   HG13  ILE  50          HG13      ILE  50 -19.044   0.567   0.399
  399   HG21  ILE  50          HG21      ILE  50 -15.990  -1.887  -0.202
  400   HG22  ILE  50          HG22      ILE  50 -17.628  -2.540  -0.171
  401   HG23  ILE  50          HG23      ILE  50 -17.067  -1.499   1.140
  402   HD11  ILE  50          HD11      ILE  50 -20.807   0.422  -1.209
  403   HD12  ILE  50          HD12      ILE  50 -19.811  -0.584  -2.257
  404   HD13  ILE  50          HD13      ILE  50 -19.368   1.100  -1.970
  405    H    ILE  51           H        ILE  51 -14.973   0.391  -2.197
  406    HA   ILE  51           HA       ILE  51 -13.078  -1.221  -1.007
  407    HB   ILE  51           HB       ILE  51 -12.620   0.885  -3.120
  408   HG12  ILE  51          HG12      ILE  51 -13.118  -2.082  -3.407
  409   HG13  ILE  51          HG13      ILE  51 -14.341  -0.844  -3.646
  410   HG21  ILE  51          HG21      ILE  51 -10.903  -1.386  -2.155
  411   HG22  ILE  51          HG22      ILE  51 -10.490   0.327  -2.268
  412   HG23  ILE  51          HG23      ILE  51 -10.689  -0.636  -3.733
  413   HD11  ILE  51          HD11      ILE  51 -13.409  -1.667  -5.751
  414   HD12  ILE  51          HD12      ILE  51 -11.811  -1.114  -5.249
  415   HD13  ILE  51          HD13      ILE  51 -13.102   0.055  -5.518
  416    H    HIS  52           H        HIS  52 -13.105   2.303  -1.223
  417    HA   HIS  52           HA       HIS  52 -10.595   2.723  -0.060
  418    HB2  HIS  52           HB2      HIS  52 -12.936   4.374  -0.735
  419    HB3  HIS  52           HB3      HIS  52 -11.889   5.022   0.526
  420    HD1  HIS  52           HD1      HIS  52 -10.674   6.812  -0.682
  421    HD2  HIS  52           HD2      HIS  52 -10.656   3.218  -2.796
  422    HE1  HIS  52           HE1      HIS  52  -9.064   7.147  -2.563
  423    HE2  HIS  52           HE2      HIS  52  -8.919   4.915  -3.711
  424    H    HIS  53           H        HIS  53 -13.837   2.807   1.441
  425    HA   HIS  53           HA       HIS  53 -12.814   3.635   3.955
  426    HB2  HIS  53           HB2      HIS  53 -15.449   2.274   3.387
  427    HB3  HIS  53           HB3      HIS  53 -15.032   3.151   4.856
  428    HD1  HIS  53           HD1      HIS  53 -13.966   5.755   3.908
  429    HD2  HIS  53           HD2      HIS  53 -17.112   3.828   2.003
  430    HE1  HIS  53           HE1      HIS  53 -15.111   7.528   2.548
  431    HE2  HIS  53           HE2      HIS  53 -16.862   6.289   1.229
  432    H    LEU  54           H        LEU  54 -12.986   0.572   2.450
  433    HA   LEU  54           HA       LEU  54 -12.949  -0.989   4.864
  434    HB2  LEU  54           HB2      LEU  54 -12.502  -1.626   1.962
  435    HB3  LEU  54           HB3      LEU  54 -12.166  -2.814   3.205
  436    HG   LEU  54           HG       LEU  54 -14.865  -1.530   2.766
  437   HD11  LEU  54          HD11      LEU  54 -13.837  -4.238   1.925
  438   HD12  LEU  54          HD12      LEU  54 -14.236  -2.894   0.854
  439   HD13  LEU  54          HD13      LEU  54 -15.505  -3.681   1.789
  440   HD21  LEU  54          HD21      LEU  54 -14.444  -2.347   5.062
  441   HD22  LEU  54          HD22      LEU  54 -14.080  -3.942   4.403
  442   HD23  LEU  54          HD23      LEU  54 -15.697  -3.265   4.232
  443    H    VAL  55           H        VAL  55 -10.551  -0.142   2.374
  444    HA   VAL  55           HA       VAL  55  -8.378  -1.333   3.773
  445    HB   VAL  55           HB       VAL  55  -6.924  -0.255   2.163
  446   HG11  VAL  55          HG11      VAL  55  -9.480  -1.203   0.877
  447   HG12  VAL  55          HG12      VAL  55  -8.149  -2.221   1.430
  448   HG13  VAL  55          HG13      VAL  55  -7.905  -1.103   0.090
  449   HG21  VAL  55          HG21      VAL  55  -7.772   1.314   0.489
  450   HG22  VAL  55          HG22      VAL  55  -7.937   1.961   2.120
  451   HG23  VAL  55          HG23      VAL  55  -9.347   1.313   1.283
  452    H    GLN  56           H        GLN  56  -9.839   1.820   3.733
  453    HA   GLN  56           HA       GLN  56  -7.828   3.126   5.269
  454    HB2  GLN  56           HB2      GLN  56 -10.672   3.780   4.547
  455    HB3  GLN  56           HB3      GLN  56  -9.735   4.819   5.599
  456    HG2  GLN  56           HG2      GLN  56  -8.050   5.033   3.774
  457    HG3  GLN  56           HG3      GLN  56  -9.134   4.112   2.731
  458   HE21  GLN  56          HE21      GLN  56  -9.477   5.726   1.285
  459   HE22  GLN  56          HE22      GLN  56 -10.353   7.172   1.660
  460    H    MET  57           H        MET  57 -10.376   0.983   6.014
  461    HA   MET  57           HA       MET  57 -10.681   1.866   8.754
  462    HB2  MET  57           HB2      MET  57 -12.404   0.664   7.085
  463    HB3  MET  57           HB3      MET  57 -11.750  -0.761   7.875
  464    HG2  MET  57           HG2      MET  57 -12.419   0.098  10.041
  465    HG3  MET  57           HG3      MET  57 -13.005   1.580   9.291
  466    HE1  MET  57           HE1      MET  57 -14.373   0.268   6.576
  467    HE2  MET  57           HE2      MET  57 -15.011   1.619   7.514
  468    HE3  MET  57           HE3      MET  57 -16.038   0.233   7.155
  469    H    GLY  58           H        GLY  58  -8.437   0.116   7.090
  470    HA2  GLY  58           HA2      GLY  58  -6.522  -0.883   7.918
  471    HA3  GLY  58           HA3      GLY  58  -7.201  -0.775   9.535
  472    H    LEU  59           H        LEU  59  -9.482  -2.176   7.603
  473    HA   LEU  59           HA       LEU  59  -8.795  -4.804   8.654
  474    HB2  LEU  59           HB2      LEU  59 -11.112  -5.411   8.003
  475    HB3  LEU  59           HB3      LEU  59 -11.014  -4.105   9.167
  476    HG   LEU  59           HG       LEU  59 -11.223  -2.579   7.040
  477   HD11  LEU  59          HD11      LEU  59 -12.618  -5.057   6.066
  478   HD12  LEU  59          HD12      LEU  59 -11.041  -4.522   5.490
  479   HD13  LEU  59          HD13      LEU  59 -12.460  -3.505   5.241
  480   HD21  LEU  59          HD21      LEU  59 -13.646  -2.578   7.299
  481   HD22  LEU  59          HD22      LEU  59 -12.835  -2.675   8.863
  482   HD23  LEU  59          HD23      LEU  59 -13.560  -4.120   8.156
  483    H    ALA  60           H        ALA  60  -8.703  -3.050   5.757
  484    HA   ALA  60           HA       ALA  60  -8.123  -5.548   4.292
  485    HB1  ALA  60           HB1      ALA  60  -8.823  -4.395   2.226
  486    HB2  ALA  60           HB2      ALA  60  -9.313  -3.005   3.192
  487    HB3  ALA  60           HB3      ALA  60 -10.134  -4.550   3.395
  488    H    ASP  61           H        ASP  61  -6.541  -5.312   2.535
  489    HA   ASP  61           HA       ASP  61  -4.203  -4.013   3.534
  490    HB2  ASP  61           HB2      ASP  61  -4.827  -5.767   1.199
  491    HB3  ASP  61           HB3      ASP  61  -3.333  -4.837   1.172
  492    H    SER  62           H        SER  62  -5.685  -3.754   0.295
  493    HA   SER  62           HA       SER  62  -5.252  -0.898   0.243
  494    HB2  SER  62           HB2      SER  62  -3.709  -2.672  -1.645
  495    HB3  SER  62           HB3      SER  62  -3.696  -0.914  -1.630
  496    HG   SER  62           HG       SER  62  -3.063  -1.729   0.811
  497    H    VAL  63           H        VAL  63  -5.965   0.073  -1.757
  498    HA   VAL  63           HA       VAL  63  -8.327  -1.056  -2.834
  499    HB   VAL  63           HB       VAL  63  -6.646   1.185  -3.973
  500   HG11  VAL  63          HG11      VAL  63  -9.613   0.763  -4.220
  501   HG12  VAL  63          HG12      VAL  63  -8.452   0.231  -5.434
  502   HG13  VAL  63          HG13      VAL  63  -8.617   1.947  -5.059
  503   HG21  VAL  63          HG21      VAL  63  -8.771   1.206  -1.839
  504   HG22  VAL  63          HG22      VAL  63  -8.191   2.654  -2.663
  505   HG23  VAL  63          HG23      VAL  63  -7.083   1.692  -1.685
  506    H    LYS  64           H        LYS  64  -5.011  -1.251  -3.614
  507    HA   LYS  64           HA       LYS  64  -4.705  -2.056  -6.164
  508    HB2  LYS  64           HB2      LYS  64  -3.430  -2.474  -3.663
  509    HB3  LYS  64           HB3      LYS  64  -3.480  -4.017  -4.500
  510    HG2  LYS  64           HG2      LYS  64  -2.394  -2.995  -6.428
  511    HG3  LYS  64           HG3      LYS  64  -2.333  -1.461  -5.555
  512    HD2  LYS  64           HD2      LYS  64  -0.195  -2.575  -5.382
  513    HD3  LYS  64           HD3      LYS  64  -0.977  -2.532  -3.804
  514    HE2  LYS  64           HE2      LYS  64  -1.374  -4.924  -5.533
  515    HE3  LYS  64           HE3      LYS  64   0.173  -4.728  -4.718
  516    HZ1  LYS  64           HZ1      LYS  64  -1.101  -4.523  -2.605
  517    HZ2  LYS  64           HZ2      LYS  64  -1.231  -6.035  -3.341
  518    HZ3  LYS  64           HZ3      LYS  64  -2.510  -4.939  -3.444
  519    H    ASP  65           H        ASP  65  -5.902  -4.059  -3.516
  520    HA   ASP  65           HA       ASP  65  -6.022  -6.367  -5.241
  521    HB2  ASP  65           HB2      ASP  65  -6.509  -6.042  -2.281
  522    HB3  ASP  65           HB3      ASP  65  -6.538  -7.584  -3.138
  523    H    PHE  66           H        PHE  66  -8.113  -3.903  -4.438
  524    HA   PHE  66           HA       PHE  66 -10.493  -5.575  -4.704
  525    HB2  PHE  66           HB2      PHE  66 -10.138  -2.620  -4.245
  526    HB3  PHE  66           HB3      PHE  66 -11.703  -3.370  -4.513
  527    HD1  PHE  66           HD1      PHE  66  -8.713  -3.859  -2.340
  528    HD2  PHE  66           HD2      PHE  66 -12.960  -3.806  -2.655
  529    HE1  PHE  66           HE1      PHE  66  -8.891  -4.256   0.074
  530    HE2  PHE  66           HE2      PHE  66 -13.137  -4.215  -0.238
  531    HZ   PHE  66           HZ       PHE  66 -11.102  -4.428   1.129
  532    H    GLN  67           H        GLN  67  -8.953  -2.787  -6.359
  533    HA   GLN  67           HA       GLN  67  -9.826  -3.843  -8.897
  534    HB2  GLN  67           HB2      GLN  67 -10.992  -1.314  -7.749
  535    HB3  GLN  67           HB3      GLN  67 -10.901  -1.582  -9.492
  536    HG2  GLN  67           HG2      GLN  67 -12.184  -3.736  -9.072
  537    HG3  GLN  67           HG3      GLN  67 -12.483  -3.111  -7.449
  538   HE21  GLN  67          HE21      GLN  67 -14.347  -3.700  -9.611
  539   HE22  GLN  67          HE22      GLN  67 -15.192  -2.227  -9.943
  540    H    ARG  68           H        ARG  68  -9.474  -0.439  -8.686
  541    HA   ARG  68           HA       ARG  68  -6.608  -0.458  -9.069
  542    HB2  ARG  68           HB2      ARG  68  -7.594  -1.042 -11.305
  543    HB3  ARG  68           HB3      ARG  68  -8.382   0.527 -11.304
  544    HG2  ARG  68           HG2      ARG  68  -6.510   0.897 -12.590
  545    HG3  ARG  68           HG3      ARG  68  -6.009   1.473 -11.000
  546    HD2  ARG  68           HD2      ARG  68  -4.770  -0.531 -10.588
  547    HD3  ARG  68           HD3      ARG  68  -5.419  -1.294 -12.039
  548    HE   ARG  68           HE       ARG  68  -4.075   1.098 -12.717
  549   HH11  ARG  68          HH11      ARG  68  -3.392  -2.188 -11.686
  550   HH12  ARG  68          HH12      ARG  68  -1.856  -2.243 -12.491
  551   HH21  ARG  68          HH21      ARG  68  -2.053   1.012 -13.746
  552   HH22  ARG  68          HH22      ARG  68  -1.074  -0.430 -13.625
  553    H    LYS  69           H        LYS  69  -6.988   0.907  -7.075
  554    HA   LYS  69           HA       LYS  69  -6.704   3.628  -7.954
  555    HB2  LYS  69           HB2      LYS  69  -9.233   2.819  -6.866
  556    HB3  LYS  69           HB3      LYS  69  -8.456   3.945  -5.758
  557    HG2  LYS  69           HG2      LYS  69  -9.020   4.416  -8.679
  558    HG3  LYS  69           HG3      LYS  69  -9.867   5.142  -7.310
  559    HD2  LYS  69           HD2      LYS  69  -7.835   6.278  -6.623
  560    HD3  LYS  69           HD3      LYS  69  -6.931   5.503  -7.920
  561    HE2  LYS  69           HE2      LYS  69  -8.374   6.633  -9.562
  562    HE3  LYS  69           HE3      LYS  69  -9.206   7.449  -8.239
  563    HZ1  LYS  69           HZ1      LYS  69  -7.096   8.472  -7.611
  564    HZ2  LYS  69           HZ2      LYS  69  -7.519   8.868  -9.200
  565    HZ3  LYS  69           HZ3      LYS  69  -6.326   7.708  -8.909
  566    H    GLY  70           H        GLY  70  -5.073   1.646  -6.748
  567    HA2  GLY  70           HA2      GLY  70  -3.842   3.203  -4.715
  568    HA3  GLY  70           HA3      GLY  70  -4.682   1.822  -4.013
  569    H    THR  71           H        THR  71  -2.755   2.401  -6.916
  570    HA   THR  71           HA       THR  71  -1.853  -0.283  -7.002
  571    HB   THR  71           HB       THR  71  -0.240   0.805  -8.770
  572    HG1  THR  71           HG1      THR  71  -2.107   2.709  -9.266
  573   HG21  THR  71          HG21      THR  71  -2.039   0.654 -10.427
  574   HG22  THR  71          HG22      THR  71  -3.231   0.647  -9.125
  575   HG23  THR  71          HG23      THR  71  -2.086  -0.686  -9.281
  576    H    HIS  72           H        HIS  72   0.366  -0.915  -7.159
  577    HA   HIS  72           HA       HIS  72   2.039   0.206  -5.075
  578    HB2  HIS  72           HB2      HIS  72   3.280  -1.759  -5.253
  579    HB3  HIS  72           HB3      HIS  72   1.687  -2.316  -5.726
  580    HD1  HIS  72           HD1      HIS  72   1.342  -2.627  -8.398
  581    HD2  HIS  72           HD2      HIS  72   5.239  -2.080  -7.096
  582    HE1  HIS  72           HE1      HIS  72   2.807  -3.269 -10.337
  583    HE2  HIS  72           HE2      HIS  72   5.127  -3.287  -9.369
  584    H    ILE  73           H        ILE  73   1.322   1.205  -7.984
  585    HA   ILE  73           HA       ILE  73   3.722   1.176  -9.442
  586    HB   ILE  73           HB       ILE  73   1.037   2.222  -9.819
  587   HG12  ILE  73          HG12      ILE  73   2.002   0.272 -10.982
  588   HG13  ILE  73          HG13      ILE  73   1.420   1.499 -12.103
  589   HG21  ILE  73          HG21      ILE  73   3.283   3.775 -11.055
  590   HG22  ILE  73          HG22      ILE  73   2.115   4.383  -9.885
  591   HG23  ILE  73          HG23      ILE  73   1.584   3.906 -11.498
  592   HD11  ILE  73          HD11      ILE  73   4.282   0.979 -11.332
  593   HD12  ILE  73          HD12      ILE  73   3.744   2.302 -12.368
  594   HD13  ILE  73          HD13      ILE  73   3.517   0.627 -12.880
  595    H    VAL  74           H        VAL  74   5.400   2.334  -9.330
  596    HA   VAL  74           HA       VAL  74   6.010   4.440  -7.643
  597    HB   VAL  74           HB       VAL  74   7.903   3.530  -8.619
  598   HG11  VAL  74          HG11      VAL  74   8.109   3.050 -11.065
  599   HG12  VAL  74          HG12      VAL  74   6.425   3.533 -11.249
  600   HG13  VAL  74          HG13      VAL  74   6.837   2.131 -10.264
  601   HG21  VAL  74          HG21      VAL  74   8.088   5.943  -8.874
  602   HG22  VAL  74          HG22      VAL  74   7.311   5.843 -10.455
  603   HG23  VAL  74          HG23      VAL  74   8.899   5.115 -10.204
  604    H    LEU  75           H        LEU  75   5.780   6.688  -7.823
  605    HA   LEU  75           HA       LEU  75   3.668   7.705  -9.305
  606    HB2  LEU  75           HB2      LEU  75   4.316   9.891  -8.628
  607    HB3  LEU  75           HB3      LEU  75   4.669   8.802  -7.306
  608    HG   LEU  75           HG       LEU  75   6.802   9.723  -9.226
  609   HD11  LEU  75          HD11      LEU  75   7.397  11.430  -7.597
  610   HD12  LEU  75          HD12      LEU  75   6.000  10.991  -6.613
  611   HD13  LEU  75          HD13      LEU  75   5.765  11.688  -8.216
  612   HD21  LEU  75          HD21      LEU  75   8.267   9.212  -7.282
  613   HD22  LEU  75          HD22      LEU  75   7.447   7.806  -7.950
  614   HD23  LEU  75          HD23      LEU  75   6.860   8.539  -6.457
  615    H    TRP  76           H        TRP  76   3.679   7.237 -11.438
  616    HA   TRP  76           HA       TRP  76   5.973   7.779 -13.088
  617    HB2  TRP  76           HB2      TRP  76   3.271   6.587 -13.513
  618    HB3  TRP  76           HB3      TRP  76   4.130   7.226 -14.917
  619    HD1  TRP  76           HD1      TRP  76   4.734   4.691 -12.057
  620    HE1  TRP  76           HE1      TRP  76   6.144   2.755 -12.979
  621    HE3  TRP  76           HE3      TRP  76   5.585   6.464 -16.779
  622    HZ2  TRP  76           HZ2      TRP  76   7.436   2.057 -15.366
  623    HZ3  TRP  76           HZ3      TRP  76   6.907   5.063 -18.325
  624    HH2  TRP  76           HH2      TRP  76   7.812   2.924 -17.632
  625    H    THR  77           H        THR  77   6.450   9.780 -13.525
  626    HA   THR  77           HA       THR  77   4.330  11.721 -14.059
  627    HB   THR  77           HB       THR  77   6.248  13.370 -13.921
  628    HG1  THR  77           HG1      THR  77   8.203  12.572 -13.795
  629   HG21  THR  77          HG21      THR  77   4.767  12.954 -12.001
  630   HG22  THR  77          HG22      THR  77   6.423  13.251 -11.472
  631   HG23  THR  77          HG23      THR  77   5.791  11.605 -11.505
  632    H    GLY  78           H        GLY  78   5.178  13.425 -15.789
  633    HA2  GLY  78           HA2      GLY  78   5.028  12.161 -18.274
  634    HA3  GLY  78           HA3      GLY  78   5.507  13.832 -18.018
  635    H    ASP  79           H        ASP  79   7.859  13.417 -16.556
  636    HA   ASP  79           HA       ASP  79   9.703  12.918 -18.648
  637    HB2  ASP  79           HB2      ASP  79  11.450  13.186 -16.923
  638    HB3  ASP  79           HB3      ASP  79  10.251  14.470 -16.847
  639    H    GLN  80           H        GLN  80   8.799  10.994 -15.778
  640    HA   GLN  80           HA       GLN  80  10.604   8.890 -16.257
  641    HB2  GLN  80           HB2      GLN  80   7.919   8.789 -14.879
  642    HB3  GLN  80           HB3      GLN  80   9.131   7.517 -14.825
  643    HG2  GLN  80           HG2      GLN  80  10.661   9.413 -13.902
  644    HG3  GLN  80           HG3      GLN  80   9.122  10.186 -13.523
  645   HE21  GLN  80          HE21      GLN  80   7.827   7.555 -13.120
  646   HE22  GLN  80          HE22      GLN  80   8.345   7.052 -11.557
  647    H    GLU  81           H        GLU  81   7.320   9.464 -17.358
  648    HA   GLU  81           HA       GLU  81   6.954   6.934 -18.537
  649    HB2  GLU  81           HB2      GLU  81   5.158   8.611 -17.929
  650    HB3  GLU  81           HB3      GLU  81   5.610   9.489 -19.383
  651    HG2  GLU  81           HG2      GLU  81   4.856   7.792 -20.788
  652    HG3  GLU  81           HG3      GLU  81   4.841   6.598 -19.490
  653    H    LEU  82           H        LEU  82   8.152  10.006 -19.716
  654    HA   LEU  82           HA       LEU  82   8.550   9.216 -22.399
  655    HB2  LEU  82           HB2      LEU  82   8.442  11.544 -21.680
  656    HB3  LEU  82           HB3      LEU  82   9.890  11.344 -20.720
  657    HG   LEU  82           HG       LEU  82  10.053  12.586 -22.961
  658   HD11  LEU  82          HD11      LEU  82  11.980  11.930 -21.636
  659   HD12  LEU  82          HD12      LEU  82  12.297  11.744 -23.364
  660   HD13  LEU  82          HD13      LEU  82  11.951  10.328 -22.373
  661   HD21  LEU  82          HD21      LEU  82  10.064   9.754 -23.990
  662   HD22  LEU  82          HD22      LEU  82  10.437  11.205 -24.921
  663   HD23  LEU  82          HD23      LEU  82   8.807  10.953 -24.294
  664    H    GLU  83           H        GLU  83  10.653   9.170 -19.533
  665    HA   GLU  83           HA       GLU  83  13.044   8.366 -20.706
  666    HB2  GLU  83           HB2      GLU  83  11.931   7.548 -18.018
  667    HB3  GLU  83           HB3      GLU  83  13.600   7.339 -18.520
  668    HG2  GLU  83           HG2      GLU  83  13.896   9.731 -18.633
  669    HG3  GLU  83           HG3      GLU  83  12.196   9.981 -18.226
  670    H    LEU  84           H        LEU  84  10.575   6.281 -19.211
  671    HA   LEU  84           HA       LEU  84  12.134   3.965 -19.864
  672    HB2  LEU  84           HB2      LEU  84  10.910   4.203 -17.728
  673    HB3  LEU  84           HB3      LEU  84   9.398   4.127 -18.604
  674    HG   LEU  84           HG       LEU  84   9.567   1.844 -18.978
  675   HD11  LEU  84          HD11      LEU  84  11.730   1.854 -20.074
  676   HD12  LEU  84          HD12      LEU  84  11.667   0.575 -18.859
  677   HD13  LEU  84          HD13      LEU  84  12.538   2.071 -18.521
  678   HD21  LEU  84          HD21      LEU  84   9.377   2.298 -16.567
  679   HD22  LEU  84          HD22      LEU  84  11.134   2.244 -16.428
  680   HD23  LEU  84          HD23      LEU  84  10.241   0.796 -16.884
  681    H    GLN  85           H        GLN  85   9.396   5.590 -21.288
  682    HA   GLN  85           HA       GLN  85   8.393   3.456 -22.811
  683    HB2  GLN  85           HB2      GLN  85   7.272   5.641 -22.530
  684    HB3  GLN  85           HB3      GLN  85   8.510   6.387 -23.528
  685    HG2  GLN  85           HG2      GLN  85   7.817   5.012 -25.413
  686    HG3  GLN  85           HG3      GLN  85   6.570   4.280 -24.416
  687   HE21  GLN  85          HE21      GLN  85   7.606   7.083 -26.073
  688   HE22  GLN  85          HE22      GLN  85   6.134   7.967 -25.936
  689    H    ARG  86           H        ARG  86  10.948   5.817 -23.446
  690    HA   ARG  86           HA       ARG  86  11.516   4.768 -26.065
  691    HB2  ARG  86           HB2      ARG  86  12.997   6.725 -24.306
  692    HB3  ARG  86           HB3      ARG  86  13.538   6.262 -25.912
  693    HG2  ARG  86           HG2      ARG  86  11.351   7.112 -26.791
  694    HG3  ARG  86           HG3      ARG  86  11.041   7.757 -25.175
  695    HD2  ARG  86           HD2      ARG  86  13.001   9.133 -25.275
  696    HD3  ARG  86           HD3      ARG  86  13.500   8.393 -26.794
  697    HE   ARG  86           HE       ARG  86  10.956   9.541 -27.118
  698   HH11  ARG  86          HH11      ARG  86  14.308  10.457 -26.698
  699   HH12  ARG  86          HH12      ARG  86  14.133  11.970 -27.521
  700   HH21  ARG  86          HH21      ARG  86  10.723  11.535 -28.208
  701   HH22  ARG  86          HH22      ARG  86  12.092  12.590 -28.370
  702    H    LEU  87           H        LEU  87  12.974   4.615 -22.866
  703    HA   LEU  87           HA       LEU  87  15.338   3.289 -23.548
  704    HB2  LEU  87           HB2      LEU  87  14.443   4.357 -21.301
  705    HB3  LEU  87           HB3      LEU  87  13.969   2.705 -20.963
  706    HG   LEU  87           HG       LEU  87  16.396   2.072 -21.445
  707   HD11  LEU  87          HD11      LEU  87  18.029   3.879 -21.105
  708   HD12  LEU  87          HD12      LEU  87  16.715   5.054 -21.111
  709   HD13  LEU  87          HD13      LEU  87  17.068   4.119 -22.563
  710   HD21  LEU  87          HD21      LEU  87  15.797   3.822 -19.069
  711   HD22  LEU  87          HD22      LEU  87  17.083   2.624 -19.187
  712   HD23  LEU  87          HD23      LEU  87  15.397   2.113 -19.217
  713    H    PHE  88           H        PHE  88  12.159   2.058 -22.617
  714    HA   PHE  88           HA       PHE  88  12.701  -0.669 -22.636
  715    HB2  PHE  88           HB2      PHE  88  10.601  -0.256 -21.827
  716    HB3  PHE  88           HB3      PHE  88  10.281   1.023 -22.990
  717    HD1  PHE  88           HD1      PHE  88   8.822   0.638 -24.702
  718    HD2  PHE  88           HD2      PHE  88  10.681  -2.682 -22.793
  719    HE1  PHE  88           HE1      PHE  88   7.432  -0.892 -26.022
  720    HE2  PHE  88           HE2      PHE  88   9.291  -4.221 -24.116
  721    HZ   PHE  88           HZ       PHE  88   7.670  -3.317 -25.740
  722    H    GLU  89           H        GLU  89  11.634   1.423 -25.311
  723    HA   GLU  89           HA       GLU  89  11.431  -0.543 -27.281
  724    HB2  GLU  89           HB2      GLU  89  12.265   2.342 -27.606
  725    HB3  GLU  89           HB3      GLU  89  11.675   1.295 -28.887
  726    HG2  GLU  89           HG2      GLU  89   9.523   1.116 -27.705
  727    HG3  GLU  89           HG3      GLU  89  10.148   2.205 -26.468
  728    H    GLU  90           H        GLU  90  14.188   1.247 -26.086
  729    HA   GLU  90           HA       GLU  90  15.862   0.607 -28.315
  730    HB2  GLU  90           HB2      GLU  90  16.246   1.972 -25.683
  731    HB3  GLU  90           HB3      GLU  90  17.627   1.586 -26.702
  732    HG2  GLU  90           HG2      GLU  90  16.653   2.896 -28.514
  733    HG3  GLU  90           HG3      GLU  90  15.268   3.268 -27.493
  734    H    PHE  91           H        PHE  91  15.468  -0.674 -25.039
  735    HA   PHE  91           HA       PHE  91  17.804  -2.370 -25.426
  736    HB2  PHE  91           HB2      PHE  91  16.104  -1.783 -23.013
  737    HB3  PHE  91           HB3      PHE  91  17.343  -3.034 -23.016
  738    HD1  PHE  91           HD1      PHE  91  16.698   0.553 -23.011
  739    HD2  PHE  91           HD2      PHE  91  19.700  -2.456 -23.186
  740    HE1  PHE  91           HE1      PHE  91  18.414   2.233 -22.485
  741    HE2  PHE  91           HE2      PHE  91  21.421  -0.780 -22.656
  742    HZ   PHE  91           HZ       PHE  91  20.777   1.572 -22.305
  743    H    ARG  92           H        ARG  92  14.863  -2.756 -26.558
  744    HA   ARG  92           HA       ARG  92  14.140  -5.367 -25.656
  745    HB2  ARG  92           HB2      ARG  92  13.590  -4.216 -28.399
  746    HB3  ARG  92           HB3      ARG  92  12.715  -5.509 -27.597
  747    HG2  ARG  92           HG2      ARG  92  12.090  -3.802 -25.836
  748    HG3  ARG  92           HG3      ARG  92  12.719  -2.588 -26.955
  749    HD2  ARG  92           HD2      ARG  92  10.520  -4.560 -27.525
  750    HD3  ARG  92           HD3      ARG  92  10.299  -2.848 -27.179
  751    HE   ARG  92           HE       ARG  92  11.765  -3.814 -29.550
  752   HH11  ARG  92          HH11      ARG  92   9.362  -1.727 -28.082
  753   HH12  ARG  92          HH12      ARG  92   8.970  -0.923 -29.565
  754   HH21  ARG  92          HH21      ARG  92  11.241  -2.748 -31.511
  755   HH22  ARG  92          HH22      ARG  92  10.042  -1.493 -31.507
  756    H    ASP  93           H        ASP  93  16.607  -4.148 -27.557
  757    HA   ASP  93           HA       ASP  93  17.110  -6.327 -29.294
  758    HB2  ASP  93           HB2      ASP  93  17.925  -4.048 -29.700
  759    HB3  ASP  93           HB3      ASP  93  18.963  -4.161 -28.282
  760    H    SER  94           H        SER  94  17.648  -5.877 -25.945
  761    HA   SER  94           HA       SER  94  19.684  -7.990 -25.924
  762    HB2  SER  94           HB2      SER  94  20.071  -7.296 -23.550
  763    HB3  SER  94           HB3      SER  94  20.402  -6.027 -24.727
  764    HG   SER  94           HG       SER  94  17.857  -5.801 -24.044
  765    H    ASP  95           H        ASP  95  19.504  -9.654 -24.217
  766    HA   ASP  95           HA       ASP  95  17.100 -11.026 -24.657
  767    HB2  ASP  95           HB2      ASP  95  17.996 -12.807 -23.382
  768    HB3  ASP  95           HB3      ASP  95  19.357 -12.055 -24.206
  769    H    ASP  96           H        ASP  96  18.117  -9.037 -21.954
  770    HA   ASP  96           HA       ASP  96  15.397  -9.325 -20.879
  771    HB2  ASP  96           HB2      ASP  96  16.901 -10.560 -19.392
  772    HB3  ASP  96           HB3      ASP  96  17.934  -9.144 -19.234
  773    H    VAL  97           H        VAL  97  14.534  -7.481 -21.536
  774    HA   VAL  97           HA       VAL  97  15.996  -5.104 -21.925
  775    HB   VAL  97           HB       VAL  97  13.978  -5.570 -23.219
  776   HG11  VAL  97          HG11      VAL  97  11.750  -5.300 -22.261
  777   HG12  VAL  97          HG12      VAL  97  12.460  -5.121 -20.657
  778   HG13  VAL  97          HG13      VAL  97  12.616  -6.649 -21.524
  779   HG21  VAL  97          HG21      VAL  97  12.880  -3.348 -23.033
  780   HG22  VAL  97          HG22      VAL  97  14.641  -3.273 -23.108
  781   HG23  VAL  97          HG23      VAL  97  13.816  -3.054 -21.565
  782    H    LEU  98           H        LEU  98  13.864  -6.154 -19.271
  783    HA   LEU  98           HA       LEU  98  13.786  -3.584 -18.047
  784    HB2  LEU  98           HB2      LEU  98  13.210  -6.255 -16.788
  785    HB3  LEU  98           HB3      LEU  98  12.778  -4.695 -16.126
  786    HG   LEU  98           HG       LEU  98  11.514  -4.538 -18.499
  787   HD11  LEU  98          HD11      LEU  98  11.536  -7.452 -17.752
  788   HD12  LEU  98          HD12      LEU  98  12.144  -6.734 -19.244
  789   HD13  LEU  98          HD13      LEU  98  10.414  -6.714 -18.894
  790   HD21  LEU  98          HD21      LEU  98  10.399  -5.917 -16.063
  791   HD22  LEU  98          HD22      LEU  98   9.482  -5.074 -17.312
  792   HD23  LEU  98          HD23      LEU  98  10.567  -4.173 -16.254
  793    H    GLY  99           H        GLY  99  15.888  -6.365 -17.729
  794    HA2  GLY  99           HA2      GLY  99  17.226  -5.609 -15.373
  795    HA3  GLY  99           HA3      GLY  99  17.915  -6.580 -16.676
  796    H    HIS 100           H        HIS 100  17.784  -4.780 -18.755
  797    HA   HIS 100           HA       HIS 100  20.060  -3.144 -18.202
  798    HB2  HIS 100           HB2      HIS 100  18.306  -3.423 -20.646
  799    HB3  HIS 100           HB3      HIS 100  19.699  -2.352 -20.581
  800    HD1  HIS 100           HD1      HIS 100  21.378  -3.477 -22.051
  801    HD2  HIS 100           HD2      HIS 100  19.579  -6.132 -19.407
  802    HE1  HIS 100           HE1      HIS 100  22.585  -5.656 -22.350
  803    HE2  HIS 100           HE2      HIS 100  21.455  -7.260 -20.775
  804    H    ILE 101           H        ILE 101  16.626  -2.692 -18.341
  805    HA   ILE 101           HA       ILE 101  16.467   0.090 -18.488
  806    HB   ILE 101           HB       ILE 101  14.704  -1.822 -16.947
  807   HG12  ILE 101          HG12      ILE 101  14.674  -2.309 -19.310
  808   HG13  ILE 101          HG13      ILE 101  13.161  -1.521 -18.879
  809   HG21  ILE 101          HG21      ILE 101  14.231   1.067 -17.660
  810   HG22  ILE 101          HG22      ILE 101  14.447   0.396 -16.043
  811   HG23  ILE 101          HG23      ILE 101  13.019  -0.027 -16.991
  812   HD11  ILE 101          HD11      ILE 101  13.984  -0.706 -20.991
  813   HD12  ILE 101          HD12      ILE 101  15.514  -0.247 -20.248
  814   HD13  ILE 101          HD13      ILE 101  14.026   0.579 -19.786
  815    H    MET 102           H        MET 102  16.400  -1.934 -15.553
  816    HA   MET 102           HA       MET 102  16.358   0.172 -13.731
  817    HB2  MET 102           HB2      MET 102  17.548  -2.572 -13.312
  818    HB3  MET 102           HB3      MET 102  17.068  -1.447 -12.048
  819    HG2  MET 102           HG2      MET 102  14.746  -1.604 -12.807
  820    HG3  MET 102           HG3      MET 102  15.238  -2.775 -14.035
  821    HE1  MET 102           HE1      MET 102  13.347  -4.390 -13.041
  822    HE2  MET 102           HE2      MET 102  12.971  -3.198 -11.794
  823    HE3  MET 102           HE3      MET 102  13.277  -4.878 -11.345
  824    H    LYS 103           H        LYS 103  19.078  -1.452 -15.248
  825    HA   LYS 103           HA       LYS 103  21.058  -0.274 -13.566
  826    HB2  LYS 103           HB2      LYS 103  21.366  -1.494 -16.313
  827    HB3  LYS 103           HB3      LYS 103  22.666  -1.174 -15.173
  828    HG2  LYS 103           HG2      LYS 103  20.403  -3.122 -14.779
  829    HG3  LYS 103           HG3      LYS 103  22.065  -3.528 -15.199
  830    HD2  LYS 103           HD2      LYS 103  22.816  -2.549 -13.064
  831    HD3  LYS 103           HD3      LYS 103  21.133  -2.220 -12.645
  832    HE2  LYS 103           HE2      LYS 103  20.635  -4.613 -12.765
  833    HE3  LYS 103           HE3      LYS 103  22.315  -4.942 -13.183
  834    HZ1  LYS 103           HZ1      LYS 103  22.958  -3.977 -11.033
  835    HZ2  LYS 103           HZ2      LYS 103  21.971  -5.338 -10.860
  836    HZ3  LYS 103           HZ3      LYS 103  21.326  -3.793 -10.632
  837    H    ASN 104           H        ASN 104  19.590   0.595 -16.647
  838    HA   ASN 104           HA       ASN 104  21.590   2.657 -17.111
  839    HB2  ASN 104           HB2      ASN 104  20.630   1.174 -18.942
  840    HB3  ASN 104           HB3      ASN 104  19.147   2.110 -18.792
  841   HD21  ASN 104          HD21      ASN 104  19.130   4.264 -19.462
  842   HD22  ASN 104          HD22      ASN 104  20.367   4.919 -20.470
  843    H    ILE 105           H        ILE 105  18.317   2.417 -15.919
  844    HA   ILE 105           HA       ILE 105  17.899   5.280 -16.295
  845    HB   ILE 105           HB       ILE 105  16.064   3.650 -16.749
  846   HG12  ILE 105          HG12      ILE 105  14.280   4.996 -15.646
  847   HG13  ILE 105          HG13      ILE 105  15.527   5.791 -14.691
  848   HG21  ILE 105          HG21      ILE 105  14.762   2.803 -14.842
  849   HG22  ILE 105          HG22      ILE 105  16.016   3.394 -13.751
  850   HG23  ILE 105          HG23      ILE 105  16.386   2.119 -14.913
  851   HD11  ILE 105          HD11      ILE 105  16.514   6.709 -16.701
  852   HD12  ILE 105          HD12      ILE 105  14.805   7.135 -16.600
  853   HD13  ILE 105          HD13      ILE 105  15.331   5.856 -17.692
  854    H    THR 106           H        THR 106  17.141   6.601 -14.554
  855    HA   THR 106           HA       THR 106  19.005   6.492 -12.418
  856    HB   THR 106           HB       THR 106  18.314   8.536 -13.633
  857    HG1  THR 106           HG1      THR 106  19.188   9.272 -11.842
  858   HG21  THR 106          HG21      THR 106  15.930   8.168 -13.815
  859   HG22  THR 106          HG22      THR 106  16.233   9.680 -12.959
  860   HG23  THR 106          HG23      THR 106  15.756   8.239 -12.060
  861    H    ALA 107           H        ALA 107  15.570   5.805 -12.701
  862    HA   ALA 107           HA       ALA 107  15.345   5.570  -9.789
  863    HB1  ALA 107           HB1      ALA 107  13.189   5.499 -11.894
  864    HB2  ALA 107           HB2      ALA 107  13.630   6.905 -10.925
  865    HB3  ALA 107           HB3      ALA 107  12.936   5.478 -10.149
  866    H    LYS 108           H        LYS 108  15.289   3.635  -8.818
  867    HA   LYS 108           HA       LYS 108  15.371   1.230 -10.403
  868    HB2  LYS 108           HB2      LYS 108  15.672   1.913  -7.528
  869    HB3  LYS 108           HB3      LYS 108  15.119   0.290  -7.903
  870    HG2  LYS 108           HG2      LYS 108  17.502   0.277  -7.610
  871    HG3  LYS 108           HG3      LYS 108  17.120  -0.049  -9.296
  872    HD2  LYS 108           HD2      LYS 108  17.726   2.750  -8.440
  873    HD3  LYS 108           HD3      LYS 108  19.047   1.605  -8.658
  874    HE2  LYS 108           HE2      LYS 108  18.121   1.142 -10.956
  875    HE3  LYS 108           HE3      LYS 108  17.029   2.503 -10.705
  876    HZ1  LYS 108           HZ1      LYS 108  19.996   2.608 -10.739
  877    HZ2  LYS 108           HZ2      LYS 108  18.996   3.919 -10.365
  878    HZ3  LYS 108           HZ3      LYS 108  18.947   3.234 -11.912
  879    H    ARG 109           H        ARG 109  13.504   0.755 -11.376
  880    HA   ARG 109           HA       ARG 109  11.038   0.831  -9.775
  881    HB2  ARG 109           HB2      ARG 109  11.306   0.842 -12.792
  882    HB3  ARG 109           HB3      ARG 109   9.823   1.055 -11.867
  883    HG2  ARG 109           HG2      ARG 109  10.585   3.166 -11.020
  884    HG3  ARG 109           HG3      ARG 109  12.176   2.931 -11.742
  885    HD2  ARG 109           HD2      ARG 109  11.080   2.924 -13.983
  886    HD3  ARG 109           HD3      ARG 109   9.560   3.332 -13.185
  887    HE   ARG 109           HE       ARG 109  10.870   5.346 -12.310
  888   HH11  ARG 109          HH11      ARG 109  11.417   3.913 -15.462
  889   HH12  ARG 109          HH12      ARG 109  12.046   5.374 -16.151
  890   HH21  ARG 109          HH21      ARG 109  11.710   7.261 -13.215
  891   HH22  ARG 109          HH22      ARG 109  12.224   7.289 -14.882
  892    H    SER 110           H        SER 110  10.236  -1.059  -9.209
  893    HA   SER 110           HA       SER 110  11.504  -3.479  -9.749
  894    HB2  SER 110           HB2      SER 110   8.636  -3.350  -8.886
  895    HB3  SER 110           HB3      SER 110   9.913  -4.433  -8.336
  896    HG   SER 110           HG       SER 110  10.821  -2.768  -7.177
  897    H    ARG 111           H        ARG 111  10.633  -5.396 -10.765
  898    HA   ARG 111           HA       ARG 111  10.076  -5.052 -13.460
  899    HB2  ARG 111           HB2      ARG 111   9.569  -7.442 -11.681
  900    HB3  ARG 111           HB3      ARG 111   9.454  -7.483 -13.437
  901    HG2  ARG 111           HG2      ARG 111  11.949  -6.698 -11.945
  902    HG3  ARG 111           HG3      ARG 111  11.602  -8.341 -12.485
  903    HD2  ARG 111           HD2      ARG 111  11.570  -7.639 -14.781
  904    HD3  ARG 111           HD3      ARG 111  11.708  -5.946 -14.309
  905    HE   ARG 111           HE       ARG 111  13.947  -6.617 -13.376
  906   HH11  ARG 111          HH11      ARG 111  12.506  -8.317 -16.084
  907   HH12  ARG 111          HH12      ARG 111  14.035  -8.789 -16.766
  908   HH21  ARG 111          HH21      ARG 111  15.951  -7.326 -14.226
  909   HH22  ARG 111          HH22      ARG 111  15.978  -8.250 -15.707
  910    H    ALA 112           H        ALA 112   7.835  -5.843 -10.828
  911    HA   ALA 112           HA       ALA 112   5.555  -6.167 -12.443
  912    HB1  ALA 112           HB1      ALA 112   4.277  -6.039 -10.391
  913    HB2  ALA 112           HB2      ALA 112   5.661  -5.344  -9.545
  914    HB3  ALA 112           HB3      ALA 112   5.733  -7.004 -10.137
  915    H    ARG 113           H        ARG 113   7.158  -3.319 -11.287
  916    HA   ARG 113           HA       ARG 113   4.890  -1.571 -11.619
  917    HB2  ARG 113           HB2      ARG 113   7.814  -0.807 -11.585
  918    HB3  ARG 113           HB3      ARG 113   6.442   0.250 -11.294
  919    HG2  ARG 113           HG2      ARG 113   5.934  -1.052  -9.253
  920    HG3  ARG 113           HG3      ARG 113   7.405  -1.987  -9.531
  921    HD2  ARG 113           HD2      ARG 113   8.610   0.263  -9.585
  922    HD3  ARG 113           HD3      ARG 113   7.135   0.929  -8.892
  923    HE   ARG 113           HE       ARG 113   8.519  -1.289  -7.542
  924   HH11  ARG 113          HH11      ARG 113   7.393   2.042  -7.529
  925   HH12  ARG 113          HH12      ARG 113   7.662   2.255  -5.835
  926   HH21  ARG 113          HH21      ARG 113   8.885  -0.979  -5.320
  927   HH22  ARG 113          HH22      ARG 113   8.510   0.545  -4.583
  928    H    ILE 114           H        ILE 114   7.872  -2.247 -13.392
  929    HA   ILE 114           HA       ILE 114   7.446  -0.538 -15.537
  930    HB   ILE 114           HB       ILE 114   8.952  -3.153 -15.523
  931   HG12  ILE 114          HG12      ILE 114   9.869  -0.323 -14.998
  932   HG13  ILE 114          HG13      ILE 114   9.683  -1.578 -13.784
  933   HG21  ILE 114          HG21      ILE 114   9.074  -0.802 -17.411
  934   HG22  ILE 114          HG22      ILE 114   8.548  -2.442 -17.789
  935   HG23  ILE 114          HG23      ILE 114  10.237  -2.128 -17.387
  936   HD11  ILE 114          HD11      ILE 114  11.612  -1.700 -16.087
  937   HD12  ILE 114          HD12      ILE 114  11.463  -2.875 -14.778
  938   HD13  ILE 114          HD13      ILE 114  12.024  -1.236 -14.437
  939    H    VAL 115           H        VAL 115   6.780  -4.055 -15.328
  940    HA   VAL 115           HA       VAL 115   5.836  -4.226 -17.983
  941    HB   VAL 115           HB       VAL 115   5.053  -6.456 -17.474
  942   HG11  VAL 115          HG11      VAL 115   7.647  -5.872 -16.055
  943   HG12  VAL 115          HG12      VAL 115   7.448  -6.148 -17.785
  944   HG13  VAL 115          HG13      VAL 115   7.122  -7.451 -16.642
  945   HG21  VAL 115          HG21      VAL 115   5.625  -5.886 -14.570
  946   HG22  VAL 115          HG22      VAL 115   5.047  -7.405 -15.259
  947   HG23  VAL 115          HG23      VAL 115   4.015  -5.975 -15.286
  948    H    ASP 116           H        ASP 116   4.167  -3.658 -14.923
  949    HA   ASP 116           HA       ASP 116   1.552  -3.924 -15.971
  950    HB2  ASP 116           HB2      ASP 116   1.958  -4.052 -13.583
  951    HB3  ASP 116           HB3      ASP 116   2.544  -2.393 -13.560
  952    H    LYS 117           H        LYS 117   3.861  -1.276 -15.869
  953    HA   LYS 117           HA       LYS 117   1.885   0.684 -16.652
  954    HB2  LYS 117           HB2      LYS 117   3.980   1.177 -15.297
  955    HB3  LYS 117           HB3      LYS 117   4.882   0.988 -16.795
  956    HG2  LYS 117           HG2      LYS 117   4.550   3.290 -16.587
  957    HG3  LYS 117           HG3      LYS 117   3.337   2.772 -17.757
  958    HD2  LYS 117           HD2      LYS 117   1.633   2.761 -16.004
  959    HD3  LYS 117           HD3      LYS 117   2.850   3.234 -14.809
  960    HE2  LYS 117           HE2      LYS 117   1.514   5.152 -15.538
  961    HE3  LYS 117           HE3      LYS 117   3.210   5.335 -15.980
  962    HZ1  LYS 117           HZ1      LYS 117   2.536   4.447 -18.219
  963    HZ2  LYS 117           HZ2      LYS 117   1.988   6.003 -17.847
  964    HZ3  LYS 117           HZ3      LYS 117   0.930   4.679 -17.746
  965    H    LEU 118           H        LEU 118   4.323  -1.306 -18.208
  966    HA   LEU 118           HA       LEU 118   4.279  -0.174 -20.768
  967    HB2  LEU 118           HB2      LEU 118   5.150  -2.658 -19.568
  968    HB3  LEU 118           HB3      LEU 118   4.454  -2.932 -21.155
  969    HG   LEU 118           HG       LEU 118   6.032  -1.169 -22.031
  970   HD11  LEU 118          HD11      LEU 118   8.019  -0.692 -20.695
  971   HD12  LEU 118          HD12      LEU 118   7.305  -1.545 -19.325
  972   HD13  LEU 118          HD13      LEU 118   6.557  -0.067 -19.933
  973   HD21  LEU 118          HD21      LEU 118   7.176  -3.672 -20.810
  974   HD22  LEU 118          HD22      LEU 118   7.926  -2.718 -22.090
  975   HD23  LEU 118          HD23      LEU 118   6.387  -3.532 -22.383
  976    H    LEU 119           H        LEU 119   2.317  -2.782 -19.402
  977    HA   LEU 119           HA       LEU 119   0.690  -3.211 -21.658
  978    HB2  LEU 119           HB2      LEU 119   0.435  -3.787 -18.734
  979    HB3  LEU 119           HB3      LEU 119  -0.961  -4.007 -19.768
  980    HG   LEU 119           HG       LEU 119   0.281  -6.110 -19.379
  981   HD11  LEU 119          HD11      LEU 119  -1.067  -5.835 -21.383
  982   HD12  LEU 119          HD12      LEU 119   0.354  -6.827 -21.705
  983   HD13  LEU 119          HD13      LEU 119   0.317  -5.147 -22.231
  984   HD21  LEU 119          HD21      LEU 119   2.497  -4.746 -20.916
  985   HD22  LEU 119          HD22      LEU 119   2.440  -6.462 -20.514
  986   HD23  LEU 119          HD23      LEU 119   2.552  -5.258 -19.228
  987    H    ALA 120           H        ALA 120   0.567  -0.919 -19.060
  988    HA   ALA 120           HA       ALA 120  -2.122  -0.062 -19.541
  989    HB1  ALA 120           HB1      ALA 120  -0.954   0.050 -17.341
  990    HB2  ALA 120           HB2      ALA 120  -1.726   1.561 -17.838
  991    HB3  ALA 120           HB3      ALA 120   0.022   1.370 -17.990
  992    H    LEU 121           H        LEU 121   1.068   0.948 -20.549
  993    HA   LEU 121           HA       LEU 121   0.154   3.311 -21.914
  994    HB2  LEU 121           HB2      LEU 121   2.725   1.743 -22.065
  995    HB3  LEU 121           HB3      LEU 121   2.440   3.227 -22.950
  996    HG   LEU 121           HG       LEU 121   2.415   3.002 -19.943
  997   HD11  LEU 121          HD11      LEU 121   4.633   2.570 -20.852
  998   HD12  LEU 121          HD12      LEU 121   4.575   4.140 -20.045
  999   HD13  LEU 121          HD13      LEU 121   4.539   4.050 -21.807
 1000   HD21  LEU 121          HD21      LEU 121   2.539   5.476 -20.076
 1001   HD22  LEU 121          HD22      LEU 121   1.035   4.813 -20.710
 1002   HD23  LEU 121          HD23      LEU 121   2.294   5.359 -21.819
 1003    H    GLY 122           H        GLY 122   0.363  -0.042 -22.570
 1004    HA2  GLY 122           HA2      GLY 122  -0.362  -1.245 -24.403
 1005    HA3  GLY 122           HA3      GLY 122  -0.754   0.273 -25.207
 1006    H    LEU 123           H        LEU 123   2.353  -0.524 -23.795
 1007    HA   LEU 123           HA       LEU 123   3.685   0.003 -26.299
 1008    HB2  LEU 123           HB2      LEU 123   4.651  -0.795 -23.552
 1009    HB3  LEU 123           HB3      LEU 123   5.737  -0.606 -24.918
 1010    HG   LEU 123           HG       LEU 123   4.007   1.572 -23.739
 1011   HD11  LEU 123          HD11      LEU 123   6.985   1.123 -23.615
 1012   HD12  LEU 123          HD12      LEU 123   5.850   0.958 -22.276
 1013   HD13  LEU 123          HD13      LEU 123   6.129   2.538 -23.006
 1014   HD21  LEU 123          HD21      LEU 123   4.337   1.851 -26.146
 1015   HD22  LEU 123          HD22      LEU 123   6.080   1.691 -25.926
 1016   HD23  LEU 123          HD23      LEU 123   5.226   3.066 -25.229
 1017    H    VAL 124           H        VAL 124   2.650  -2.660 -24.423
 1018    HA   VAL 124           HA       VAL 124   3.398  -4.500 -26.568
 1019    HB   VAL 124           HB       VAL 124   4.010  -6.239 -24.936
 1020   HG11  VAL 124          HG11      VAL 124   6.238  -5.386 -24.377
 1021   HG12  VAL 124          HG12      VAL 124   5.705  -3.750 -24.767
 1022   HG13  VAL 124          HG13      VAL 124   5.775  -4.980 -26.029
 1023   HG21  VAL 124          HG21      VAL 124   2.796  -5.323 -23.019
 1024   HG22  VAL 124          HG22      VAL 124   3.946  -3.990 -22.924
 1025   HG23  VAL 124          HG23      VAL 124   4.482  -5.642 -22.620
 1026    H    ALA 125           H        ALA 125   2.165  -6.499 -26.440
 1027    HA   ALA 125           HA       ALA 125  -0.539  -5.966 -25.460
 1028    HB1  ALA 125           HB1      ALA 125  -1.224  -7.807 -26.906
 1029    HB2  ALA 125           HB2      ALA 125   0.462  -8.128 -27.309
 1030    HB3  ALA 125           HB3      ALA 125  -0.292  -6.612 -27.806
 1031    H    GLU 126           H        GLU 126   2.214  -7.447 -24.432
 1032    HA   GLU 126           HA       GLU 126   1.054  -8.886 -22.304
 1033    HB2  GLU 126           HB2      GLU 126   1.721 -11.167 -23.073
 1034    HB3  GLU 126           HB3      GLU 126   0.368 -10.481 -23.960
 1035    HG2  GLU 126           HG2      GLU 126   2.118  -9.693 -25.643
 1036    HG3  GLU 126           HG3      GLU 126   3.200 -10.832 -24.851
 1037    H    ARG 127           H        ARG 127   2.820 -10.472 -21.367
 1038    HA   ARG 127           HA       ARG 127   5.106  -8.786 -21.016
 1039    HB2  ARG 127           HB2      ARG 127   4.366 -11.428 -19.780
 1040    HB3  ARG 127           HB3      ARG 127   5.810 -10.521 -19.356
 1041    HG2  ARG 127           HG2      ARG 127   4.378  -8.621 -18.685
 1042    HG3  ARG 127           HG3      ARG 127   2.958  -9.620 -19.009
 1043    HD2  ARG 127           HD2      ARG 127   5.126 -10.146 -16.987
 1044    HD3  ARG 127           HD3      ARG 127   3.472  -9.639 -16.650
 1045    HE   ARG 127           HE       ARG 127   3.768 -12.147 -18.089
 1046   HH11  ARG 127          HH11      ARG 127   3.286 -10.548 -15.003
 1047   HH12  ARG 127          HH12      ARG 127   2.693 -11.974 -14.218
 1048   HH21  ARG 127          HH21      ARG 127   2.983 -14.022 -17.047
 1049   HH22  ARG 127          HH22      ARG 127   2.508 -13.943 -15.382
 1050    H    ARG 128           H        ARG 128   4.470 -11.664 -22.885
 1051    HA   ARG 128           HA       ARG 128   7.078 -12.723 -22.946
 1052    HB2  ARG 128           HB2      ARG 128   6.288 -14.229 -24.461
 1053    HB3  ARG 128           HB3      ARG 128   4.737 -13.599 -23.933
 1054    HG2  ARG 128           HG2      ARG 128   4.555 -12.203 -25.853
 1055    HG3  ARG 128           HG3      ARG 128   6.222 -12.533 -26.322
 1056    HD2  ARG 128           HD2      ARG 128   4.877 -13.844 -27.742
 1057    HD3  ARG 128           HD3      ARG 128   5.542 -14.954 -26.546
 1058    HE   ARG 128           HE       ARG 128   2.911 -13.855 -25.972
 1059   HH11  ARG 128          HH11      ARG 128   4.774 -16.545 -27.221
 1060   HH12  ARG 128          HH12      ARG 128   3.455 -17.664 -27.126
 1061   HH21  ARG 128          HH21      ARG 128   1.182 -15.306 -25.862
 1062   HH22  ARG 128          HH22      ARG 128   1.398 -16.951 -26.369
 1063    H    GLU 129           H        GLU 129   5.655 -10.037 -24.571
 1064    HA   GLU 129           HA       GLU 129   7.377  -9.887 -26.808
 1065    HB2  GLU 129           HB2      GLU 129   5.740  -7.737 -25.459
 1066    HB3  GLU 129           HB3      GLU 129   6.463  -7.611 -27.053
 1067    HG2  GLU 129           HG2      GLU 129   4.357  -9.598 -26.233
 1068    HG3  GLU 129           HG3      GLU 129   4.076  -8.125 -27.159
 1069    H    LEU 130           H        LEU 130   7.658  -8.845 -23.527
 1070    HA   LEU 130           HA       LEU 130   9.944  -7.152 -24.194
 1071    HB2  LEU 130           HB2      LEU 130   9.738  -6.640 -21.635
 1072    HB3  LEU 130           HB3      LEU 130   8.683  -5.869 -22.800
 1073    HG   LEU 130           HG       LEU 130   7.728  -8.389 -21.521
 1074   HD11  LEU 130          HD11      LEU 130   6.832  -7.078 -19.634
 1075   HD12  LEU 130          HD12      LEU 130   7.795  -5.699 -20.164
 1076   HD13  LEU 130          HD13      LEU 130   8.592  -7.175 -19.624
 1077   HD21  LEU 130          HD21      LEU 130   6.334  -7.383 -23.212
 1078   HD22  LEU 130          HD22      LEU 130   6.451  -5.806 -22.422
 1079   HD23  LEU 130          HD23      LEU 130   5.579  -7.120 -21.637
 1080    H    TYR 131           H        TYR 131   9.721 -10.221 -23.902
 1081    HA   TYR 131           HA       TYR 131  12.214 -10.412 -22.358
 1082    HB2  TYR 131           HB2      TYR 131   9.975 -12.432 -22.526
 1083    HB3  TYR 131           HB3      TYR 131  11.586 -12.832 -21.944
 1084    HD1  TYR 131           HD1      TYR 131   8.383 -11.520 -21.074
 1085    HD2  TYR 131           HD2      TYR 131  12.478 -11.526 -19.931
 1086    HE1  TYR 131           HE1      TYR 131   7.749 -10.758 -18.828
 1087    HE2  TYR 131           HE2      TYR 131  11.853 -10.767 -17.676
 1088    HH   TYR 131           HH       TYR 131   9.985  -9.567 -16.597
 1089    H    LYS 132           H        LYS 132  13.606 -10.234 -23.989
 1090    HA   LYS 132           HA       LYS 132  13.225 -11.499 -26.534
 1091    HB2  LYS 132           HB2      LYS 132  14.373  -9.327 -26.257
 1092    HB3  LYS 132           HB3      LYS 132  15.655 -10.127 -25.372
 1093    HG2  LYS 132           HG2      LYS 132  16.546  -9.861 -27.486
 1094    HG3  LYS 132           HG3      LYS 132  15.964 -11.528 -27.510
 1095    HD2  LYS 132           HD2      LYS 132  13.989 -10.871 -28.716
 1096    HD3  LYS 132           HD3      LYS 132  14.409  -9.164 -28.556
 1097    HE2  LYS 132           HE2      LYS 132  16.484  -9.624 -29.847
 1098    HE3  LYS 132           HE3      LYS 132  15.901 -11.264 -30.115
 1099    HZ1  LYS 132           HZ1      LYS 132  13.966 -10.345 -31.239
 1100    HZ2  LYS 132           HZ2      LYS 132  15.392  -9.844 -31.988
 1101    HZ3  LYS 132           HZ3      LYS 132  14.542  -8.777 -30.993
 1102    H    LYS 133           H        LYS 133  12.939 -13.609 -25.381
 1103    HA   LYS 133           HA       LYS 133  15.504 -14.959 -24.857
 1104    HB2  LYS 133           HB2      LYS 133  12.734 -15.917 -24.124
 1105    HB3  LYS 133           HB3      LYS 133  14.263 -16.613 -23.611
 1106    HG2  LYS 133           HG2      LYS 133  13.218 -13.894 -22.833
 1107    HG3  LYS 133           HG3      LYS 133  13.217 -15.334 -21.817
 1108    HD2  LYS 133           HD2      LYS 133  15.670 -15.381 -21.894
 1109    HD3  LYS 133           HD3      LYS 133  15.664 -13.937 -22.910
 1110    HE2  LYS 133           HE2      LYS 133  14.630 -12.653 -21.133
 1111    HE3  LYS 133           HE3      LYS 133  14.520 -14.091 -20.122
 1112    HZ1  LYS 133           HZ1      LYS 133  16.400 -12.714 -19.499
 1113    HZ2  LYS 133           HZ2      LYS 133  17.047 -12.834 -21.055
 1114    HZ3  LYS 133           HZ3      LYS 133  16.929 -14.209 -20.078
 1115    H    ARG 134           H        ARG 134  15.401 -17.350 -25.465
 1116    HA   ARG 134           HA       ARG 134  14.831 -17.654 -28.209
 1117    HB2  ARG 134           HB2      ARG 134  16.570 -18.950 -27.063
 1118    HB3  ARG 134           HB3      ARG 134  15.351 -19.745 -26.079
 1119    HG2  ARG 134           HG2      ARG 134  15.043 -19.989 -29.005
 1120    HG3  ARG 134           HG3      ARG 134  16.411 -20.832 -28.277
 1121    HD2  ARG 134           HD2      ARG 134  14.964 -22.036 -26.799
 1122    HD3  ARG 134           HD3      ARG 134  13.575 -21.076 -27.304
 1123    HE   ARG 134           HE       ARG 134  14.564 -22.271 -29.593
 1124   HH11  ARG 134          HH11      ARG 134  13.279 -23.352 -26.527
 1125   HH12  ARG 134          HH12      ARG 134  12.558 -24.783 -27.189
 1126   HH21  ARG 134          HH21      ARG 134  13.632 -24.158 -30.469
 1127   HH22  ARG 134          HH22      ARG 134  12.769 -25.250 -29.435
 1128    H    GLN 135           H        GLN 135  12.680 -16.969 -28.375
 1129    HA   GLN 135           HA       GLN 135  10.769 -19.149 -27.910
 1130    HB2  GLN 135           HB2      GLN 135   9.000 -17.556 -27.442
 1131    HB3  GLN 135           HB3      GLN 135  10.327 -17.278 -26.325
 1132    HG2  GLN 135           HG2      GLN 135  11.074 -15.392 -27.724
 1133    HG3  GLN 135           HG3      GLN 135   9.685 -15.650 -28.776
 1134   HE21  GLN 135          HE21      GLN 135  10.376 -13.299 -27.251
 1135   HE22  GLN 135          HE22      GLN 135   9.047 -12.989 -26.188
 1136    H    LYS 136           H        LYS 136   8.835 -18.885 -29.463
 1137    HA   LYS 136           HA       LYS 136   9.647 -18.595 -32.135
 1138    HB2  LYS 136           HB2      LYS 136   7.261 -18.641 -32.687
 1139    HB3  LYS 136           HB3      LYS 136   7.644 -19.859 -31.481
 1140    HG2  LYS 136           HG2      LYS 136   6.648 -18.590 -29.749
 1141    HG3  LYS 136           HG3      LYS 136   6.515 -17.163 -30.780
 1142    HD2  LYS 136           HD2      LYS 136   4.946 -18.399 -32.230
 1143    HD3  LYS 136           HD3      LYS 136   5.046 -19.774 -31.126
 1144    HE2  LYS 136           HE2      LYS 136   4.025 -18.551 -29.372
 1145    HE3  LYS 136           HE3      LYS 136   4.190 -17.029 -30.246
 1146    HZ1  LYS 136           HZ1      LYS 136   2.491 -19.305 -31.109
 1147    HZ2  LYS 136           HZ2      LYS 136   2.603 -17.795 -31.861
 1148    HZ3  LYS 136           HZ3      LYS 136   1.927 -17.921 -30.319
 1149    H    LYS 137           H        LYS 137   8.127 -16.907 -33.564
 1150    HA   LYS 137           HA       LYS 137   9.411 -14.441 -33.069
 1151    HB2  LYS 137           HB2      LYS 137   8.638 -15.193 -35.337
 1152    HB3  LYS 137           HB3      LYS 137   6.990 -14.829 -34.836
 1153    HG2  LYS 137           HG2      LYS 137   7.851 -12.483 -34.309
 1154    HG3  LYS 137           HG3      LYS 137   9.281 -12.932 -35.233
 1155    HD2  LYS 137           HD2      LYS 137   7.918 -13.344 -37.198
 1156    HD3  LYS 137           HD3      LYS 137   6.451 -12.993 -36.278
 1157    HE2  LYS 137           HE2      LYS 137   7.326 -10.710 -35.848
 1158    HE3  LYS 137           HE3      LYS 137   8.701 -11.077 -36.887
 1159    HZ1  LYS 137           HZ1      LYS 137   7.060  -9.871 -38.123
 1160    HZ2  LYS 137           HZ2      LYS 137   5.850 -10.976 -37.708
 1161    HZ3  LYS 137           HZ3      LYS 137   7.120 -11.456 -38.716
 1162    H    LEU 138           H        LEU 138   8.657 -12.497 -32.377
 1163    HA   LEU 138           HA       LEU 138   7.018 -12.354 -30.172
 1164    HB2  LEU 138           HB2      LEU 138   7.634 -10.187 -32.178
 1165    HB3  LEU 138           HB3      LEU 138   7.038  -9.924 -30.548
 1166    HG   LEU 138           HG       LEU 138   9.669 -11.267 -31.144
 1167   HD11  LEU 138          HD11      LEU 138   9.719  -9.012 -32.026
 1168   HD12  LEU 138          HD12      LEU 138  10.706  -9.123 -30.567
 1169   HD13  LEU 138          HD13      LEU 138   9.107  -8.381 -30.495
 1170   HD21  LEU 138          HD21      LEU 138  10.140 -10.695 -28.794
 1171   HD22  LEU 138          HD22      LEU 138   8.767 -11.790 -28.959
 1172   HD23  LEU 138          HD23      LEU 138   8.496 -10.079 -28.635
 1173    H    ALA 139           H        ALA 139   4.975 -11.419 -29.827
 1174    HA   ALA 139           HA       ALA 139   3.023 -12.258 -31.791
 1175    HB1  ALA 139           HB1      ALA 139   1.407 -11.852 -30.068
 1176    HB2  ALA 139           HB2      ALA 139   2.573 -10.931 -29.123
 1177    HB3  ALA 139           HB3      ALA 139   2.790 -12.667 -29.341
 1178    H    SER 140           H        SER 140   0.993 -10.304 -31.253
 1179    HA   SER 140           HA       SER 140   2.074  -8.113 -32.840
 1180    HB2  SER 140           HB2      SER 140  -0.072  -9.251 -33.499
 1181    HB3  SER 140           HB3      SER 140  -0.804  -8.592 -32.037
 1182    HG   SER 140           HG       SER 140  -1.127  -6.842 -33.128
 1183    H    SER 141           H        SER 141   3.330  -7.274 -31.110
 1184    HA   SER 141           HA       SER 141   2.058  -6.116 -28.822
 1185    HB2  SER 141           HB2      SER 141   4.419  -6.939 -28.841
 1186    HB3  SER 141           HB3      SER 141   4.827  -5.637 -29.957
 1187    HG   SER 141           HG       SER 141   4.653  -4.201 -28.383
  Start of MODEL   12
    1    H1   ASP   1           HT1      ASP   1 -23.238  10.236 -11.008
    2    H2   ASP   1           HT2      ASP   1 -24.190   9.660  -9.733
    3    H3   ASP   1           HT3      ASP   1 -24.177  11.309 -10.098
    4    HA   ASP   1           HA       ASP   1 -25.245  10.939 -12.183
    5    HB2  ASP   1           HB2      ASP   1 -25.983   8.669 -12.826
    6    HB3  ASP   1           HB3      ASP   1 -24.234   8.751 -12.685
    7    HA   PRO   2           HA       PRO   2 -29.389  11.336 -10.528
    8    HB2  PRO   2           HB2      PRO   2 -30.411   8.848 -11.601
    9    HB3  PRO   2           HB3      PRO   2 -30.784  10.499 -12.086
   10    HG2  PRO   2           HG2      PRO   2 -28.864   8.601 -13.249
   11    HG3  PRO   2           HG3      PRO   2 -29.616  10.029 -13.980
   12    HD2  PRO   2           HD2      PRO   2 -27.018  10.007 -13.335
   13    HD3  PRO   2           HD3      PRO   2 -28.003  11.466 -13.122
   14    H    SER   3           H        SER   3 -28.209   7.944 -10.372
   15    HA   SER   3           HA       SER   3 -29.798   7.498  -7.981
   16    HB2  SER   3           HB2      SER   3 -27.773   5.588  -9.146
   17    HB3  SER   3           HB3      SER   3 -29.192   5.220  -8.171
   18    HG   SER   3           HG       SER   3 -30.356   6.274 -10.048
   19    H    ARG   4           H        ARG   4 -26.399   7.754  -8.902
   20    HA   ARG   4           HA       ARG   4 -25.578   7.249  -6.169
   21    HB2  ARG   4           HB2      ARG   4 -23.978   7.713  -8.677
   22    HB3  ARG   4           HB3      ARG   4 -23.272   7.394  -7.097
   23    HG2  ARG   4           HG2      ARG   4 -24.293   5.227  -7.012
   24    HG3  ARG   4           HG3      ARG   4 -25.184   5.547  -8.500
   25    HD2  ARG   4           HD2      ARG   4 -23.012   5.758  -9.685
   26    HD3  ARG   4           HD3      ARG   4 -22.199   5.277  -8.195
   27    HE   ARG   4           HE       ARG   4 -22.993   3.110  -8.466
   28   HH11  ARG   4          HH11      ARG   4 -24.257   5.232 -10.960
   29   HH12  ARG   4          HH12      ARG   4 -24.803   3.917 -11.960
   30   HH21  ARG   4          HH21      ARG   4 -23.705   1.393  -9.787
   31   HH22  ARG   4          HH22      ARG   4 -24.495   1.734 -11.293
   32    H    ARG   5           H        ARG   5 -26.142   8.936  -4.977
   33    HA   ARG   5           HA       ARG   5 -25.004  11.568  -5.476
   34    HB2  ARG   5           HB2      ARG   5 -27.212  10.678  -4.076
   35    HB3  ARG   5           HB3      ARG   5 -26.043  10.913  -2.789
   36    HG2  ARG   5           HG2      ARG   5 -26.941  13.001  -4.764
   37    HG3  ARG   5           HG3      ARG   5 -27.464  12.862  -3.088
   38    HD2  ARG   5           HD2      ARG   5 -25.843  14.436  -2.842
   39    HD3  ARG   5           HD3      ARG   5 -24.860  12.988  -2.644
   40    HE   ARG   5           HE       ARG   5 -24.894  13.633  -5.359
   41   HH11  ARG   5          HH11      ARG   5 -23.714  14.986  -2.353
   42   HH12  ARG   5          HH12      ARG   5 -22.416  15.857  -3.104
   43   HH21  ARG   5          HH21      ARG   5 -23.200  14.771  -6.356
   44   HH22  ARG   5          HH22      ARG   5 -22.119  15.731  -5.395
   45    H    ALA   6           H        ALA   6 -23.238  12.375  -4.169
   46    HA   ALA   6           HA       ALA   6 -21.297  10.407  -3.610
   47    HB1  ALA   6           HB1      ALA   6 -21.169  13.240  -2.613
   48    HB2  ALA   6           HB2      ALA   6 -20.825  12.784  -4.282
   49    HB3  ALA   6           HB3      ALA   6 -19.831  12.140  -2.971
   50    HA   PRO   7           HA       PRO   7 -21.932   8.582   0.191
   51    HB2  PRO   7           HB2      PRO   7 -19.491   9.314   1.443
   52    HB3  PRO   7           HB3      PRO   7 -19.857   7.824   0.573
   53    HG2  PRO   7           HG2      PRO   7 -18.499  10.289  -0.377
   54    HG3  PRO   7           HG3      PRO   7 -18.249   8.603  -0.870
   55    HD2  PRO   7           HD2      PRO   7 -19.521  10.304  -2.460
   56    HD3  PRO   7           HD3      PRO   7 -20.087   8.628  -2.300
   57    H    THR   8           H        THR   8 -23.224   9.176   1.751
   58    HA   THR   8           HA       THR   8 -22.320  11.279   3.595
   59    HB   THR   8           HB       THR   8 -24.735  11.645   4.180
   60    HG1  THR   8           HG1      THR   8 -25.446   9.608   3.224
   61   HG21  THR   8          HG21      THR   8 -23.604  13.207   2.682
   62   HG22  THR   8          HG22      THR   8 -25.286  12.996   2.200
   63   HG23  THR   8          HG23      THR   8 -24.002  12.189   1.298
   64    H    TRP   9           H        TRP   9 -21.403  10.007   5.155
   65    HA   TRP   9           HA       TRP   9 -22.629   7.408   5.679
   66    HB2  TRP   9           HB2      TRP   9 -19.875   8.485   6.241
   67    HB3  TRP   9           HB3      TRP   9 -20.444   6.940   6.866
   68    HD1  TRP   9           HD1      TRP   9 -19.167   8.592   3.721
   69    HE1  TRP   9           HE1      TRP   9 -18.901   6.813   1.881
   70    HE3  TRP   9           HE3      TRP   9 -21.492   4.666   6.020
   71    HZ2  TRP   9           HZ2      TRP   9 -19.593   4.132   1.457
   72    HZ3  TRP   9           HZ3      TRP   9 -21.655   2.523   4.813
   73    HH2  TRP   9           HH2      TRP   9 -20.722   2.272   2.580
   74    H    SER  10           H        SER  10 -22.963   6.585   7.678
   75    HA   SER  10           HA       SER  10 -22.922   8.440   9.958
   76    HB2  SER  10           HB2      SER  10 -24.985   7.064  10.718
   77    HB3  SER  10           HB3      SER  10 -25.220   8.265   9.449
   78    HG   SER  10           HG       SER  10 -24.914   6.482   7.929
   79    HA   PRO  11           HA       PRO  11 -20.565   5.661  12.389
   80    HB2  PRO  11           HB2      PRO  11 -22.902   5.211  14.190
   81    HB3  PRO  11           HB3      PRO  11 -21.239   5.656  14.594
   82    HG2  PRO  11           HG2      PRO  11 -23.155   7.486  14.635
   83    HG3  PRO  11           HG3      PRO  11 -21.551   7.878  13.991
   84    HD2  PRO  11           HD2      PRO  11 -24.103   7.358  12.540
   85    HD3  PRO  11           HD3      PRO  11 -22.785   8.480  12.144
   86    H    GLU  12           H        GLU  12 -23.883   4.324  12.486
   87    HA   GLU  12           HA       GLU  12 -23.110   1.621  12.654
   88    HB2  GLU  12           HB2      GLU  12 -25.393   2.727  13.125
   89    HB3  GLU  12           HB3      GLU  12 -25.672   2.604  11.398
   90    HG2  GLU  12           HG2      GLU  12 -25.106   0.270  13.208
   91    HG3  GLU  12           HG3      GLU  12 -26.712   0.805  12.737
   92    H    GLU  13           H        GLU  13 -23.740   3.748   9.977
   93    HA   GLU  13           HA       GLU  13 -24.125   1.894   7.942
   94    HB2  GLU  13           HB2      GLU  13 -24.505   4.441   8.069
   95    HB3  GLU  13           HB3      GLU  13 -22.838   4.567   7.539
   96    HG2  GLU  13           HG2      GLU  13 -23.335   3.467   5.485
   97    HG3  GLU  13           HG3      GLU  13 -24.962   3.066   6.039
   98    H    GLU  14           H        GLU  14 -21.122   3.499   9.019
   99    HA   GLU  14           HA       GLU  14 -19.526   2.155   7.059
  100    HB2  GLU  14           HB2      GLU  14 -18.709   3.639   9.561
  101    HB3  GLU  14           HB3      GLU  14 -17.590   3.040   8.342
  102    HG2  GLU  14           HG2      GLU  14 -18.861   4.447   6.673
  103    HG3  GLU  14           HG3      GLU  14 -19.663   5.190   8.056
  104    H    ALA  15           H        ALA  15 -20.590   1.404  10.278
  105    HA   ALA  15           HA       ALA  15 -18.755  -0.727  10.762
  106    HB1  ALA  15           HB1      ALA  15 -21.518  -0.233  11.884
  107    HB2  ALA  15           HB2      ALA  15 -19.991   0.300  12.589
  108    HB3  ALA  15           HB3      ALA  15 -20.366  -1.420  12.496
  109    H    HIS  16           H        HIS  16 -21.957  -0.492   9.374
  110    HA   HIS  16           HA       HIS  16 -22.356  -3.182   8.703
  111    HB2  HIS  16           HB2      HIS  16 -24.121  -1.396   8.793
  112    HB3  HIS  16           HB3      HIS  16 -23.459  -0.735   7.305
  113    HD1  HIS  16           HD1      HIS  16 -26.087  -1.253   6.633
  114    HD2  HIS  16           HD2      HIS  16 -23.510  -4.489   6.967
  115    HE1  HIS  16           HE1      HIS  16 -27.189  -3.142   5.385
  116    HE2  HIS  16           HE2      HIS  16 -25.708  -5.132   5.776
  117    H    LEU  17           H        LEU  17 -20.498  -0.632   7.270
  118    HA   LEU  17           HA       LEU  17 -20.300  -1.647   4.637
  119    HB2  LEU  17           HB2      LEU  17 -19.718   0.672   5.364
  120    HB3  LEU  17           HB3      LEU  17 -18.307   0.024   6.173
  121    HG   LEU  17           HG       LEU  17 -17.452  -0.754   3.972
  122   HD11  LEU  17          HD11      LEU  17 -19.959   0.579   3.028
  123   HD12  LEU  17          HD12      LEU  17 -19.324  -1.010   2.610
  124   HD13  LEU  17          HD13      LEU  17 -18.547   0.447   1.984
  125   HD21  LEU  17          HD21      LEU  17 -16.677   1.330   4.911
  126   HD22  LEU  17          HD22      LEU  17 -18.066   2.183   4.235
  127   HD23  LEU  17          HD23      LEU  17 -16.849   1.488   3.164
  128    H    ARG  18           H        ARG  18 -18.194  -1.917   7.490
  129    HA   ARG  18           HA       ARG  18 -16.507  -3.867   6.261
  130    HB2  ARG  18           HB2      ARG  18 -15.497  -4.098   8.485
  131    HB3  ARG  18           HB3      ARG  18 -15.621  -2.410   8.009
  132    HG2  ARG  18           HG2      ARG  18 -17.639  -2.203   9.411
  133    HG3  ARG  18           HG3      ARG  18 -17.406  -3.871   9.942
  134    HD2  ARG  18           HD2      ARG  18 -15.181  -3.247  10.802
  135    HD3  ARG  18           HD3      ARG  18 -15.486  -1.577  10.332
  136    HE   ARG  18           HE       ARG  18 -17.517  -2.623  12.054
  137   HH11  ARG  18          HH11      ARG  18 -14.324  -1.192  11.967
  138   HH12  ARG  18          HH12      ARG  18 -14.396  -0.621  13.602
  139   HH21  ARG  18          HH21      ARG  18 -17.620  -1.862  14.204
  140   HH22  ARG  18          HH22      ARG  18 -16.273  -1.000  14.875
  141    H    GLU  19           H        GLU  19 -19.372  -3.837   8.223
  142    HA   GLU  19           HA       GLU  19 -19.479  -6.375   9.218
  143    HB2  GLU  19           HB2      GLU  19 -21.152  -4.607   9.629
  144    HB3  GLU  19           HB3      GLU  19 -21.783  -4.874   8.010
  145    HG2  GLU  19           HG2      GLU  19 -23.168  -5.979   9.635
  146    HG3  GLU  19           HG3      GLU  19 -22.358  -7.163   8.614
  147    H    LEU  20           H        LEU  20 -20.665  -5.245   6.095
  148    HA   LEU  20           HA       LEU  20 -21.440  -7.794   5.135
  149    HB2  LEU  20           HB2      LEU  20 -21.643  -5.088   4.344
  150    HB3  LEU  20           HB3      LEU  20 -20.905  -5.957   3.011
  151    HG   LEU  20           HG       LEU  20 -23.444  -6.905   4.315
  152   HD11  LEU  20          HD11      LEU  20 -24.675  -5.792   2.547
  153   HD12  LEU  20          HD12      LEU  20 -23.183  -5.082   1.932
  154   HD13  LEU  20          HD13      LEU  20 -23.791  -4.618   3.521
  155   HD21  LEU  20          HD21      LEU  20 -22.250  -8.539   2.976
  156   HD22  LEU  20          HD22      LEU  20 -22.173  -7.405   1.627
  157   HD23  LEU  20          HD23      LEU  20 -23.732  -8.041   2.157
  158    H    TYR  21           H        TYR  21 -18.474  -5.947   4.977
  159    HA   TYR  21           HA       TYR  21 -17.237  -7.429   2.897
  160    HB2  TYR  21           HB2      TYR  21 -16.340  -5.265   3.450
  161    HB3  TYR  21           HB3      TYR  21 -16.088  -5.740   5.126
  162    HD1  TYR  21           HD1      TYR  21 -13.966  -6.337   5.768
  163    HD2  TYR  21           HD2      TYR  21 -15.064  -6.814   1.692
  164    HE1  TYR  21           HE1      TYR  21 -11.678  -7.063   5.248
  165    HE2  TYR  21           HE2      TYR  21 -12.774  -7.537   1.155
  166    HH   TYR  21           HH       TYR  21 -10.520  -7.361   2.056
  167    H    LEU  22           H        LEU  22 -17.030  -7.556   6.418
  168    HA   LEU  22           HA       LEU  22 -15.201  -9.644   6.641
  169    HB2  LEU  22           HB2      LEU  22 -17.484  -9.062   8.524
  170    HB3  LEU  22           HB3      LEU  22 -15.997  -9.896   8.907
  171    HG   LEU  22           HG       LEU  22 -16.288  -6.976   8.229
  172   HD11  LEU  22          HD11      LEU  22 -17.029  -7.510  10.464
  173   HD12  LEU  22          HD12      LEU  22 -15.505  -6.626  10.519
  174   HD13  LEU  22          HD13      LEU  22 -15.522  -8.370  10.784
  175   HD21  LEU  22          HD21      LEU  22 -13.789  -8.526   8.884
  176   HD22  LEU  22          HD22      LEU  22 -13.907  -6.777   8.675
  177   HD23  LEU  22          HD23      LEU  22 -14.209  -7.851   7.310
  178    H    ALA  23           H        ALA  23 -18.580  -9.713   5.859
  179    HA   ALA  23           HA       ALA  23 -18.917 -12.525   6.374
  180    HB1  ALA  23           HB1      ALA  23 -21.102 -12.253   5.354
  181    HB2  ALA  23           HB2      ALA  23 -20.656 -10.644   4.783
  182    HB3  ALA  23           HB3      ALA  23 -20.799 -10.960   6.512
  183    H    ASN  24           H        ASN  24 -18.596 -10.536   3.422
  184    HA   ASN  24           HA       ASN  24 -18.783 -12.948   1.811
  185    HB2  ASN  24           HB2      ASN  24 -18.852 -10.018   1.156
  186    HB3  ASN  24           HB3      ASN  24 -18.729 -11.246  -0.098
  187   HD21  ASN  24          HD21      ASN  24 -20.737  -9.828   2.345
  188   HD22  ASN  24          HD22      ASN  24 -22.220 -10.563   1.831
  189    H    LYS  25           H        LYS  25 -16.271 -11.277   3.215
  190    HA   LYS  25           HA       LYS  25 -14.350 -11.220   1.156
  191    HB2  LYS  25           HB2      LYS  25 -12.665 -11.216   2.960
  192    HB3  LYS  25           HB3      LYS  25 -13.955 -10.061   3.257
  193    HG2  LYS  25           HG2      LYS  25 -14.927 -11.429   4.920
  194    HG3  LYS  25           HG3      LYS  25 -13.924 -12.808   4.471
  195    HD2  LYS  25           HD2      LYS  25 -12.840 -10.222   5.579
  196    HD3  LYS  25           HD3      LYS  25 -13.208 -11.641   6.561
  197    HE2  LYS  25           HE2      LYS  25 -11.625 -12.946   5.145
  198    HE3  LYS  25           HE3      LYS  25 -11.191 -11.448   4.326
  199    HZ1  LYS  25           HZ1      LYS  25  -9.625 -12.021   6.083
  200    HZ2  LYS  25           HZ2      LYS  25 -10.867 -11.959   7.232
  201    HZ3  LYS  25           HZ3      LYS  25 -10.404 -10.557   6.410
  202    H    ASP  26           H        ASP  26 -15.690 -13.795   2.966
  203    HA   ASP  26           HA       ASP  26 -13.537 -15.649   2.666
  204    HB2  ASP  26           HB2      ASP  26 -15.013 -15.920   4.534
  205    HB3  ASP  26           HB3      ASP  26 -16.427 -15.962   3.487
  206    H    VAL  27           H        VAL  27 -16.127 -14.606   0.687
  207    HA   VAL  27           HA       VAL  27 -16.356 -17.035  -0.846
  208    HB   VAL  27           HB       VAL  27 -17.385 -14.299  -1.606
  209   HG11  VAL  27          HG11      VAL  27 -18.280 -17.079  -2.366
  210   HG12  VAL  27          HG12      VAL  27 -17.422 -15.938  -3.400
  211   HG13  VAL  27          HG13      VAL  27 -19.063 -15.578  -2.863
  212   HG21  VAL  27          HG21      VAL  27 -19.490 -14.909  -0.514
  213   HG22  VAL  27          HG22      VAL  27 -18.159 -14.835   0.642
  214   HG23  VAL  27          HG23      VAL  27 -18.751 -16.398   0.077
  215    H    GLU  28           H        GLU  28 -14.685 -17.597  -2.080
  216    HA   GLU  28           HA       GLU  28 -12.929 -15.580  -3.208
  217    HB2  GLU  28           HB2      GLU  28 -12.790 -18.594  -3.365
  218    HB3  GLU  28           HB3      GLU  28 -11.528 -17.476  -3.866
  219    HG2  GLU  28           HG2      GLU  28 -11.270 -16.712  -1.578
  220    HG3  GLU  28           HG3      GLU  28 -12.569 -17.786  -1.057
  221    H    GLY  29           H        GLY  29 -12.679 -15.136  -5.347
  222    HA2  GLY  29           HA2      GLY  29 -13.047 -15.361  -7.653
  223    HA3  GLY  29           HA3      GLY  29 -14.198 -16.652  -7.325
  224    H    GLN  30           H        GLN  30 -14.928 -14.277  -5.219
  225    HA   GLN  30           HA       GLN  30 -16.938 -13.133  -7.026
  226    HB2  GLN  30           HB2      GLN  30 -17.994 -14.296  -5.198
  227    HB3  GLN  30           HB3      GLN  30 -16.979 -13.465  -4.023
  228    HG2  GLN  30           HG2      GLN  30 -18.008 -11.319  -4.778
  229    HG3  GLN  30           HG3      GLN  30 -19.131 -12.256  -5.745
  230   HE21  GLN  30          HE21      GLN  30 -18.209 -11.250  -2.593
  231   HE22  GLN  30          HE22      GLN  30 -19.629 -11.792  -1.790
  232    H    ASP  31           H        ASP  31 -17.176 -10.973  -7.217
  233    HA   ASP  31           HA       ASP  31 -15.257  -9.115  -6.253
  234    HB2  ASP  31           HB2      ASP  31 -16.907  -8.904  -8.244
  235    HB3  ASP  31           HB3      ASP  31 -18.091  -8.457  -7.015
  236    H    VAL  32           H        VAL  32 -15.066  -8.957  -4.034
  237    HA   VAL  32           HA       VAL  32 -17.294  -9.375  -2.301
  238    HB   VAL  32           HB       VAL  32 -14.895  -9.808  -1.669
  239   HG11  VAL  32          HG11      VAL  32 -14.852  -6.812  -1.398
  240   HG12  VAL  32          HG12      VAL  32 -13.913  -7.786  -2.529
  241   HG13  VAL  32          HG13      VAL  32 -13.604  -7.907  -0.797
  242   HG21  VAL  32          HG21      VAL  32 -15.173  -9.053   0.669
  243   HG22  VAL  32          HG22      VAL  32 -16.626  -9.811   0.017
  244   HG23  VAL  32          HG23      VAL  32 -16.537  -8.056   0.159
  245    H    VAL  33           H        VAL  33 -15.923  -6.596  -3.860
  246    HA   VAL  33           HA       VAL  33 -16.902  -4.581  -2.144
  247    HB   VAL  33           HB       VAL  33 -16.915  -3.948  -5.010
  248   HG11  VAL  33          HG11      VAL  33 -15.582  -2.709  -2.626
  249   HG12  VAL  33          HG12      VAL  33 -17.103  -2.219  -3.366
  250   HG13  VAL  33          HG13      VAL  33 -15.592  -2.034  -4.254
  251   HG21  VAL  33          HG21      VAL  33 -14.572  -5.235  -3.737
  252   HG22  VAL  33          HG22      VAL  33 -14.287  -3.865  -4.810
  253   HG23  VAL  33          HG23      VAL  33 -15.141  -5.290  -5.404
  254    H    GLU  34           H        GLU  34 -18.181  -5.919  -5.189
  255    HA   GLU  34           HA       GLU  34 -20.615  -4.546  -5.128
  256    HB2  GLU  34           HB2      GLU  34 -19.833  -7.146  -6.412
  257    HB3  GLU  34           HB3      GLU  34 -21.450  -6.471  -6.576
  258    HG2  GLU  34           HG2      GLU  34 -20.375  -4.380  -7.452
  259    HG3  GLU  34           HG3      GLU  34 -18.856  -5.272  -7.498
  260    H    ALA  35           H        ALA  35 -19.642  -7.544  -3.588
  261    HA   ALA  35           HA       ALA  35 -22.134  -8.382  -2.648
  262    HB1  ALA  35           HB1      ALA  35 -19.475  -8.534  -1.232
  263    HB2  ALA  35           HB2      ALA  35 -20.091  -9.705  -2.401
  264    HB3  ALA  35           HB3      ALA  35 -20.908  -9.491  -0.852
  265    H    ILE  36           H        ILE  36 -19.817  -6.092  -1.292
  266    HA   ILE  36           HA       ILE  36 -21.359  -5.459   1.012
  267    HB   ILE  36           HB       ILE  36 -19.223  -3.798  -0.325
  268   HG12  ILE  36          HG12      ILE  36 -18.817  -5.663   1.998
  269   HG13  ILE  36          HG13      ILE  36 -18.650  -6.223   0.336
  270   HG21  ILE  36          HG21      ILE  36 -20.510  -2.531   1.276
  271   HG22  ILE  36          HG22      ILE  36 -18.909  -2.865   1.936
  272   HG23  ILE  36          HG23      ILE  36 -20.303  -3.793   2.489
  273   HD11  ILE  36          HD11      ILE  36 -17.076  -4.009   1.624
  274   HD12  ILE  36          HD12      ILE  36 -16.914  -4.553  -0.043
  275   HD13  ILE  36          HD13      ILE  36 -16.503  -5.638   1.281
  276    H    LEU  37           H        LEU  37 -20.602  -3.520  -1.882
  277    HA   LEU  37           HA       LEU  37 -22.250  -1.392  -1.028
  278    HB2  LEU  37           HB2      LEU  37 -21.875  -0.491  -3.357
  279    HB3  LEU  37           HB3      LEU  37 -20.475  -0.764  -2.355
  280    HG   LEU  37           HG       LEU  37 -20.102  -2.931  -3.636
  281   HD11  LEU  37          HD11      LEU  37 -22.260  -3.286  -4.607
  282   HD12  LEU  37          HD12      LEU  37 -21.142  -2.928  -5.928
  283   HD13  LEU  37          HD13      LEU  37 -22.254  -1.688  -5.351
  284   HD21  LEU  37          HD21      LEU  37 -19.948  -0.248  -4.990
  285   HD22  LEU  37          HD22      LEU  37 -19.263  -1.717  -5.684
  286   HD23  LEU  37          HD23      LEU  37 -18.677  -1.122  -4.134
  287    H    ALA  38           H        ALA  38 -23.023  -4.207  -2.853
  288    HA   ALA  38           HA       ALA  38 -25.423  -2.995  -3.954
  289    HB1  ALA  38           HB1      ALA  38 -24.126  -4.553  -5.317
  290    HB2  ALA  38           HB2      ALA  38 -25.785  -5.102  -5.079
  291    HB3  ALA  38           HB3      ALA  38 -24.471  -5.839  -4.161
  292    H    HIS  39           H        HIS  39 -24.543  -5.179  -1.334
  293    HA   HIS  39           HA       HIS  39 -27.250  -6.057  -0.946
  294    HB2  HIS  39           HB2      HIS  39 -24.704  -6.490   0.558
  295    HB3  HIS  39           HB3      HIS  39 -26.241  -6.856   1.333
  296    HD1  HIS  39           HD1      HIS  39 -27.547  -8.902   0.483
  297    HD2  HIS  39           HD2      HIS  39 -23.995  -8.209  -1.553
  298    HE1  HIS  39           HE1      HIS  39 -27.134 -10.973  -0.885
  299    HE2  HIS  39           HE2      HIS  39 -24.893 -10.594  -1.973
  300    H    LEU  40           H        LEU  40 -25.238  -3.490   0.362
  301    HA   LEU  40           HA       LEU  40 -27.500  -2.706   2.031
  302    HB2  LEU  40           HB2      LEU  40 -25.931  -0.849   2.805
  303    HB3  LEU  40           HB3      LEU  40 -25.604  -2.480   3.334
  304    HG   LEU  40           HG       LEU  40 -23.875  -2.562   1.427
  305   HD11  LEU  40          HD11      LEU  40 -24.583  -0.554   0.233
  306   HD12  LEU  40          HD12      LEU  40 -22.916  -0.413   0.791
  307   HD13  LEU  40          HD13      LEU  40 -24.204   0.428   1.653
  308   HD21  LEU  40          HD21      LEU  40 -23.434  -0.712   3.770
  309   HD22  LEU  40          HD22      LEU  40 -22.182  -1.542   2.842
  310   HD23  LEU  40          HD23      LEU  40 -23.323  -2.473   3.811
  311    H    ASN  41           H        ASN  41 -28.891  -1.216   1.453
  312    HA   ASN  41           HA       ASN  41 -28.222   0.453  -0.880
  313    HB2  ASN  41           HB2      ASN  41 -30.530   0.571  -1.454
  314    HB3  ASN  41           HB3      ASN  41 -30.205  -1.116  -1.100
  315   HD21  ASN  41          HD21      ASN  41 -30.280  -0.777   1.799
  316   HD22  ASN  41          HD22      ASN  41 -31.937  -0.535   2.209
  317    H    THR  42           H        THR  42 -27.305   1.065   1.653
  318    HA   THR  42           HA       THR  42 -29.077   3.044   2.803
  319    HB   THR  42           HB       THR  42 -27.848   1.572   4.317
  320    HG1  THR  42           HG1      THR  42 -26.659   4.128   4.636
  321   HG21  THR  42          HG21      THR  42 -25.847   1.228   2.911
  322   HG22  THR  42          HG22      THR  42 -25.434   1.685   4.561
  323   HG23  THR  42          HG23      THR  42 -25.335   2.882   3.263
  324    H    VAL  43           H        VAL  43 -26.148   2.890   0.884
  325    HA   VAL  43           HA       VAL  43 -26.281   5.775   0.523
  326    HB   VAL  43           HB       VAL  43 -24.670   5.397   2.364
  327   HG11  VAL  43          HG11      VAL  43 -23.104   3.850   0.328
  328   HG12  VAL  43          HG12      VAL  43 -23.868   3.200   1.776
  329   HG13  VAL  43          HG13      VAL  43 -22.521   4.329   1.922
  330   HG21  VAL  43          HG21      VAL  43 -22.830   6.699   1.429
  331   HG22  VAL  43          HG22      VAL  43 -24.412   7.330   0.975
  332   HG23  VAL  43          HG23      VAL  43 -23.470   6.400  -0.188
  333    HA   PRO  44           HA       PRO  44 -25.184   4.452  -3.653
  334    HB2  PRO  44           HB2      PRO  44 -25.019   7.268  -4.312
  335    HB3  PRO  44           HB3      PRO  44 -26.209   6.075  -4.836
  336    HG2  PRO  44           HG2      PRO  44 -26.796   8.146  -3.168
  337    HG3  PRO  44           HG3      PRO  44 -27.667   6.602  -3.156
  338    HD2  PRO  44           HD2      PRO  44 -25.516   7.580  -1.320
  339    HD3  PRO  44           HD3      PRO  44 -26.991   6.659  -0.950
  340    H    ARG  45           H        ARG  45 -23.114   3.878  -4.118
  341    HA   ARG  45           HA       ARG  45 -20.987   5.860  -3.654
  342    HB2  ARG  45           HB2      ARG  45 -20.580   2.933  -3.111
  343    HB3  ARG  45           HB3      ARG  45 -19.508   4.266  -2.719
  344    HG2  ARG  45           HG2      ARG  45 -22.189   3.793  -1.473
  345    HG3  ARG  45           HG3      ARG  45 -20.659   3.290  -0.779
  346    HD2  ARG  45           HD2      ARG  45 -21.618   6.081  -1.290
  347    HD3  ARG  45           HD3      ARG  45 -21.356   5.310   0.244
  348    HE   ARG  45           HE       ARG  45 -19.578   6.878  -0.977
  349   HH11  ARG  45          HH11      ARG  45 -19.268   3.486  -0.168
  350   HH12  ARG  45          HH12      ARG  45 -17.647   3.653   0.405
  351   HH21  ARG  45          HH21      ARG  45 -17.464   7.100  -0.145
  352   HH22  ARG  45          HH22      ARG  45 -16.622   5.687   0.405
  353    H    THR  46           H        THR  46 -18.915   5.054  -4.583
  354    HA   THR  46           HA       THR  46 -19.277   3.704  -7.158
  355    HB   THR  46           HB       THR  46 -17.286   4.773  -7.868
  356    HG1  THR  46           HG1      THR  46 -15.756   5.590  -6.462
  357   HG21  THR  46          HG21      THR  46 -18.669   6.620  -5.907
  358   HG22  THR  46          HG22      THR  46 -19.055   6.418  -7.621
  359   HG23  THR  46          HG23      THR  46 -17.527   7.159  -7.145
  360    H    ARG  47           H        ARG  47 -17.673   1.967  -7.650
  361    HA   ARG  47           HA       ARG  47 -17.298   0.095  -5.617
  362    HB2  ARG  47           HB2      ARG  47 -16.096   0.494  -8.318
  363    HB3  ARG  47           HB3      ARG  47 -15.310  -0.640  -7.233
  364    HG2  ARG  47           HG2      ARG  47 -16.853  -1.764  -8.739
  365    HG3  ARG  47           HG3      ARG  47 -17.361  -1.930  -7.062
  366    HD2  ARG  47           HD2      ARG  47 -19.110  -0.365  -7.341
  367    HD3  ARG  47           HD3      ARG  47 -18.471   0.186  -8.889
  368    HE   ARG  47           HE       ARG  47 -18.986  -2.259  -9.572
  369   HH11  ARG  47          HH11      ARG  47 -20.923  -0.299  -7.406
  370   HH12  ARG  47          HH12      ARG  47 -22.405  -1.095  -7.819
  371   HH21  ARG  47          HH21      ARG  47 -20.956  -3.269 -10.129
  372   HH22  ARG  47          HH22      ARG  47 -22.427  -2.762  -9.366
  373    H    LYS  48           H        LYS  48 -15.181   2.580  -6.871
  374    HA   LYS  48           HA       LYS  48 -12.868   2.126  -5.403
  375    HB2  LYS  48           HB2      LYS  48 -13.058   3.732  -7.257
  376    HB3  LYS  48           HB3      LYS  48 -14.083   4.759  -6.264
  377    HG2  LYS  48           HG2      LYS  48 -12.160   4.936  -4.655
  378    HG3  LYS  48           HG3      LYS  48 -11.182   4.136  -5.884
  379    HD2  LYS  48           HD2      LYS  48 -10.865   6.507  -6.083
  380    HD3  LYS  48           HD3      LYS  48 -11.785   5.936  -7.475
  381    HE2  LYS  48           HE2      LYS  48 -13.838   6.749  -6.525
  382    HE3  LYS  48           HE3      LYS  48 -13.029   7.166  -5.016
  383    HZ1  LYS  48           HZ1      LYS  48 -13.344   9.131  -6.343
  384    HZ2  LYS  48           HZ2      LYS  48 -12.567   8.422  -7.668
  385    HZ3  LYS  48           HZ3      LYS  48 -11.690   8.781  -6.268
  386    H    GLN  49           H        GLN  49 -15.647   4.177  -4.623
  387    HA   GLN  49           HA       GLN  49 -14.719   5.297  -2.259
  388    HB2  GLN  49           HB2      GLN  49 -17.475   4.696  -3.264
  389    HB3  GLN  49           HB3      GLN  49 -17.210   5.501  -1.731
  390    HG2  GLN  49           HG2      GLN  49 -16.210   6.497  -4.379
  391    HG3  GLN  49           HG3      GLN  49 -17.693   7.037  -3.582
  392   HE21  GLN  49          HE21      GLN  49 -16.991   9.154  -3.446
  393   HE22  GLN  49          HE22      GLN  49 -15.767   9.642  -2.330
  394    H    ILE  50           H        ILE  50 -16.480   2.279  -2.744
  395    HA   ILE  50           HA       ILE  50 -16.925   1.723  -0.009
  396    HB   ILE  50           HB       ILE  50 -16.645  -0.258  -2.266
  397   HG12  ILE  50          HG12      ILE  50 -18.270   1.663  -2.643
  398   HG13  ILE  50          HG13      ILE  50 -18.939   0.048  -2.748
  399   HG21  ILE  50          HG21      ILE  50 -16.621  -1.294  -0.090
  400   HG22  ILE  50          HG22      ILE  50 -18.173  -1.610  -0.866
  401   HG23  ILE  50          HG23      ILE  50 -18.048  -0.381   0.394
  402   HD11  ILE  50          HD11      ILE  50 -19.161   1.915  -0.409
  403   HD12  ILE  50          HD12      ILE  50 -19.825   0.278  -0.478
  404   HD13  ILE  50          HD13      ILE  50 -20.432   1.528  -1.566
  405    H    ILE  51           H        ILE  51 -14.518   0.572  -2.333
  406    HA   ILE  51           HA       ILE  51 -13.069  -1.096  -0.613
  407    HB   ILE  51           HB       ILE  51 -11.970   0.511  -2.931
  408   HG12  ILE  51          HG12      ILE  51 -13.069  -2.306  -2.909
  409   HG13  ILE  51          HG13      ILE  51 -13.917  -0.902  -3.545
  410   HG21  ILE  51          HG21      ILE  51 -10.291  -1.312  -3.044
  411   HG22  ILE  51          HG22      ILE  51 -10.940  -1.952  -1.536
  412   HG23  ILE  51          HG23      ILE  51 -10.194  -0.354  -1.567
  413   HD11  ILE  51          HD11      ILE  51 -11.335  -2.043  -4.584
  414   HD12  ILE  51          HD12      ILE  51 -12.142  -0.605  -5.211
  415   HD13  ILE  51          HD13      ILE  51 -12.924  -2.182  -5.335
  416    H    HIS  52           H        HIS  52 -12.826   2.319  -1.336
  417    HA   HIS  52           HA       HIS  52 -10.422   2.875  -0.091
  418    HB2  HIS  52           HB2      HIS  52 -12.698   4.417  -1.079
  419    HB3  HIS  52           HB3      HIS  52 -11.806   5.215   0.215
  420    HD1  HIS  52           HD1      HIS  52 -10.071   6.704  -0.732
  421    HD2  HIS  52           HD2      HIS  52 -10.565   3.267  -3.012
  422    HE1  HIS  52           HE1      HIS  52  -8.329   6.827  -2.539
  423    HE2  HIS  52           HE2      HIS  52  -8.532   4.661  -3.787
  424    H    HIS  53           H        HIS  53 -13.694   3.262   1.380
  425    HA   HIS  53           HA       HIS  53 -12.728   4.116   3.875
  426    HB2  HIS  53           HB2      HIS  53 -15.258   2.765   3.027
  427    HB3  HIS  53           HB3      HIS  53 -14.920   2.993   4.738
  428    HD1  HIS  53           HD1      HIS  53 -13.926   5.776   4.943
  429    HD2  HIS  53           HD2      HIS  53 -16.975   4.673   2.324
  430    HE1  HIS  53           HE1      HIS  53 -15.181   7.891   4.449
  431    HE2  HIS  53           HE2      HIS  53 -16.974   7.229   2.821
  432    H    LEU  54           H        LEU  54 -12.888   0.962   2.495
  433    HA   LEU  54           HA       LEU  54 -12.821  -0.376   5.054
  434    HB2  LEU  54           HB2      LEU  54 -12.939  -1.342   2.211
  435    HB3  LEU  54           HB3      LEU  54 -12.757  -2.440   3.565
  436    HG   LEU  54           HG       LEU  54 -15.042  -0.486   3.447
  437   HD11  LEU  54          HD11      LEU  54 -15.052  -1.861   1.382
  438   HD12  LEU  54          HD12      LEU  54 -16.431  -2.161   2.437
  439   HD13  LEU  54          HD13      LEU  54 -15.092  -3.307   2.390
  440   HD21  LEU  54          HD21      LEU  54 -16.097  -2.127   4.926
  441   HD22  LEU  54          HD22      LEU  54 -14.579  -1.534   5.596
  442   HD23  LEU  54          HD23      LEU  54 -14.650  -3.131   4.850
  443    H    VAL  55           H        VAL  55 -10.655  -0.090   2.223
  444    HA   VAL  55           HA       VAL  55  -8.528  -1.506   3.500
  445    HB   VAL  55           HB       VAL  55  -7.080  -0.669   1.719
  446   HG11  VAL  55          HG11      VAL  55  -8.294  -1.613  -0.196
  447   HG12  VAL  55          HG12      VAL  55  -9.785  -1.564   0.745
  448   HG13  VAL  55          HG13      VAL  55  -8.452  -2.599   1.257
  449   HG21  VAL  55          HG21      VAL  55  -7.956   0.797  -0.044
  450   HG22  VAL  55          HG22      VAL  55  -7.923   1.606   1.524
  451   HG23  VAL  55          HG23      VAL  55  -9.448   1.001   0.873
  452    H    GLN  56           H        GLN  56  -9.663   1.746   3.564
  453    HA   GLN  56           HA       GLN  56  -7.277   2.824   4.762
  454    HB2  GLN  56           HB2      GLN  56 -10.031   3.927   4.266
  455    HB3  GLN  56           HB3      GLN  56  -8.833   4.818   5.171
  456    HG2  GLN  56           HG2      GLN  56  -7.320   4.673   3.194
  457    HG3  GLN  56           HG3      GLN  56  -8.646   3.923   2.311
  458   HE21  GLN  56          HE21      GLN  56 -10.484   5.164   1.827
  459   HE22  GLN  56          HE22      GLN  56 -10.429   6.894   1.805
  460    H    MET  57           H        MET  57 -10.056   1.142   5.864
  461    HA   MET  57           HA       MET  57  -9.893   2.210   8.555
  462    HB2  MET  57           HB2      MET  57 -12.022   1.362   7.327
  463    HB3  MET  57           HB3      MET  57 -11.460  -0.235   7.796
  464    HG2  MET  57           HG2      MET  57 -11.444   0.510  10.156
  465    HG3  MET  57           HG3      MET  57 -12.132   2.047   9.639
  466    HE1  MET  57           HE1      MET  57 -14.061   0.730   7.219
  467    HE2  MET  57           HE2      MET  57 -14.472   2.123   8.220
  468    HE3  MET  57           HE3      MET  57 -15.582   0.756   8.113
  469    H    GLY  58           H        GLY  58  -8.099   0.079   6.815
  470    HA2  GLY  58           HA2      GLY  58  -6.260  -1.126   7.553
  471    HA3  GLY  58           HA3      GLY  58  -6.795  -0.875   9.207
  472    H    LEU  59           H        LEU  59  -9.438  -1.993   7.674
  473    HA   LEU  59           HA       LEU  59  -9.057  -4.645   8.753
  474    HB2  LEU  59           HB2      LEU  59 -11.436  -4.975   8.123
  475    HB3  LEU  59           HB3      LEU  59 -11.155  -3.633   9.214
  476    HG   LEU  59           HG       LEU  59 -11.155  -2.213   7.012
  477   HD11  LEU  59          HD11      LEU  59 -11.229  -4.063   5.463
  478   HD12  LEU  59          HD12      LEU  59 -12.702  -3.102   5.344
  479   HD13  LEU  59          HD13      LEU  59 -12.724  -4.644   6.194
  480   HD21  LEU  59          HD21      LEU  59 -12.754  -1.983   8.825
  481   HD22  LEU  59          HD22      LEU  59 -13.666  -3.360   8.211
  482   HD23  LEU  59          HD23      LEU  59 -13.560  -1.879   7.262
  483    H    ALA  60           H        ALA  60  -8.805  -3.080   5.763
  484    HA   ALA  60           HA       ALA  60  -8.199  -5.665   4.495
  485    HB1  ALA  60           HB1      ALA  60 -10.354  -4.890   3.624
  486    HB2  ALA  60           HB2      ALA  60  -9.109  -4.850   2.375
  487    HB3  ALA  60           HB3      ALA  60  -9.618  -3.355   3.162
  488    H    ASP  61           H        ASP  61  -6.578  -5.490   2.779
  489    HA   ASP  61           HA       ASP  61  -4.608  -3.494   3.511
  490    HB2  ASP  61           HB2      ASP  61  -4.488  -5.937   1.754
  491    HB3  ASP  61           HB3      ASP  61  -3.177  -4.765   1.791
  492    H    SER  62           H        SER  62  -5.933  -4.637   0.379
  493    HA   SER  62           HA       SER  62  -5.863  -1.903  -0.604
  494    HB2  SER  62           HB2      SER  62  -3.552  -2.699  -0.955
  495    HB3  SER  62           HB3      SER  62  -4.168  -4.068  -1.880
  496    HG   SER  62           HG       SER  62  -3.833  -1.434  -2.617
  497    H    VAL  63           H        VAL  63  -6.396  -1.978  -3.060
  498    HA   VAL  63           HA       VAL  63  -8.976  -2.950  -3.463
  499    HB   VAL  63           HB       VAL  63  -6.852  -2.214  -5.490
  500   HG11  VAL  63          HG11      VAL  63  -8.563  -3.525  -6.580
  501   HG12  VAL  63          HG12      VAL  63  -8.712  -1.832  -7.054
  502   HG13  VAL  63          HG13      VAL  63  -9.826  -2.517  -5.871
  503   HG21  VAL  63          HG21      VAL  63  -7.883  -0.031  -5.548
  504   HG22  VAL  63          HG22      VAL  63  -7.443  -0.425  -3.884
  505   HG23  VAL  63          HG23      VAL  63  -9.123  -0.548  -4.407
  506    H    LYS  64           H        LYS  64  -5.887  -4.426  -3.905
  507    HA   LYS  64           HA       LYS  64  -6.399  -6.498  -5.677
  508    HB2  LYS  64           HB2      LYS  64  -4.363  -7.329  -4.993
  509    HB3  LYS  64           HB3      LYS  64  -4.265  -5.694  -4.370
  510    HG2  LYS  64           HG2      LYS  64  -4.877  -6.435  -2.161
  511    HG3  LYS  64           HG3      LYS  64  -5.073  -8.086  -2.749
  512    HD2  LYS  64           HD2      LYS  64  -2.664  -8.047  -3.414
  513    HD3  LYS  64           HD3      LYS  64  -2.523  -6.485  -2.607
  514    HE2  LYS  64           HE2      LYS  64  -3.394  -9.056  -1.289
  515    HE3  LYS  64           HE3      LYS  64  -1.774  -8.369  -1.191
  516    HZ1  LYS  64           HZ1      LYS  64  -3.035  -7.813   0.761
  517    HZ2  LYS  64           HZ2      LYS  64  -4.282  -7.132  -0.161
  518    HZ3  LYS  64           HZ3      LYS  64  -2.751  -6.403  -0.127
  519    H    ASP  65           H        ASP  65  -7.086  -6.192  -2.280
  520    HA   ASP  65           HA       ASP  65  -7.870  -8.943  -1.944
  521    HB2  ASP  65           HB2      ASP  65  -8.295  -6.609  -0.065
  522    HB3  ASP  65           HB3      ASP  65  -8.402  -8.317   0.346
  523    H    PHE  66           H        PHE  66  -9.368  -6.349  -3.345
  524    HA   PHE  66           HA       PHE  66 -12.017  -7.012  -2.276
  525    HB2  PHE  66           HB2      PHE  66 -10.743  -4.550  -3.276
  526    HB3  PHE  66           HB3      PHE  66 -12.429  -4.772  -3.737
  527    HD1  PHE  66           HD1      PHE  66 -10.172  -4.829  -0.804
  528    HD2  PHE  66           HD2      PHE  66 -14.112  -4.195  -2.286
  529    HE1  PHE  66           HE1      PHE  66 -10.886  -4.065   1.415
  530    HE2  PHE  66           HE2      PHE  66 -14.822  -3.445  -0.092
  531    HZ   PHE  66           HZ       PHE  66 -13.213  -3.373   1.778
  532    H    GLN  67           H        GLN  67 -10.399  -6.340  -5.376
  533    HA   GLN  67           HA       GLN  67 -12.355  -7.928  -6.774
  534    HB2  GLN  67           HB2      GLN  67 -13.470  -6.145  -7.870
  535    HB3  GLN  67           HB3      GLN  67 -13.380  -5.704  -6.161
  536    HG2  GLN  67           HG2      GLN  67 -11.718  -4.107  -6.533
  537    HG3  GLN  67           HG3      GLN  67 -11.382  -4.703  -8.156
  538   HE21  GLN  67          HE21      GLN  67 -14.621  -4.351  -6.975
  539   HE22  GLN  67          HE22      GLN  67 -15.035  -2.989  -7.946
  540    H    ARG  68           H        ARG  68  -9.408  -7.685  -6.482
  541    HA   ARG  68           HA       ARG  68  -8.736  -7.228  -9.302
  542    HB2  ARG  68           HB2      ARG  68  -7.777  -5.775  -6.977
  543    HB3  ARG  68           HB3      ARG  68  -6.459  -6.488  -7.894
  544    HG2  ARG  68           HG2      ARG  68  -7.409  -5.389  -9.934
  545    HG3  ARG  68           HG3      ARG  68  -8.528  -4.538  -8.864
  546    HD2  ARG  68           HD2      ARG  68  -6.706  -3.509  -7.685
  547    HD3  ARG  68           HD3      ARG  68  -5.530  -4.472  -8.578
  548    HE   ARG  68           HE       ARG  68  -7.243  -2.719 -10.143
  549   HH11  ARG  68          HH11      ARG  68  -4.149  -3.256  -8.606
  550   HH12  ARG  68          HH12      ARG  68  -3.323  -2.058  -9.548
  551   HH21  ARG  68          HH21      ARG  68  -6.147  -1.133 -11.403
  552   HH22  ARG  68          HH22      ARG  68  -4.454  -0.859 -11.140
  553    H    LYS  69           H        LYS  69  -7.304  -8.605 -10.188
  554    HA   LYS  69           HA       LYS  69  -5.860 -10.464  -8.431
  555    HB2  LYS  69           HB2      LYS  69  -6.291 -10.444 -11.429
  556    HB3  LYS  69           HB3      LYS  69  -5.226 -11.578 -10.610
  557    HG2  LYS  69           HG2      LYS  69  -7.113 -12.501  -9.393
  558    HG3  LYS  69           HG3      LYS  69  -8.193 -11.321 -10.140
  559    HD2  LYS  69           HD2      LYS  69  -7.803 -12.264 -12.317
  560    HD3  LYS  69           HD3      LYS  69  -6.567 -13.346 -11.672
  561    HE2  LYS  69           HE2      LYS  69  -9.477 -13.384 -10.881
  562    HE3  LYS  69           HE3      LYS  69  -8.746 -14.464 -12.070
  563    HZ1  LYS  69           HZ1      LYS  69  -7.997 -14.282  -9.199
  564    HZ2  LYS  69           HZ2      LYS  69  -7.283 -15.309 -10.336
  565    HZ3  LYS  69           HZ3      LYS  69  -8.904 -15.517  -9.909
  566    H    GLY  70           H        GLY  70  -5.662  -7.528  -9.857
  567    HA2  GLY  70           HA2      GLY  70  -2.838  -7.580 -10.528
  568    HA3  GLY  70           HA3      GLY  70  -3.941  -6.228 -10.730
  569    H    THR  71           H        THR  71  -1.258  -6.929  -9.270
  570    HA   THR  71           HA       THR  71  -1.928  -5.480  -6.789
  571    HB   THR  71           HB       THR  71   0.371  -6.624  -6.084
  572    HG1  THR  71           HG1      THR  71  -0.722  -8.310  -8.105
  573   HG21  THR  71          HG21      THR  71  -0.899  -8.397  -4.990
  574   HG22  THR  71          HG22      THR  71  -2.270  -8.091  -6.057
  575   HG23  THR  71          HG23      THR  71  -1.762  -6.861  -4.897
  576    H    HIS  72           H        HIS  72   0.008  -4.264  -5.892
  577    HA   HIS  72           HA       HIS  72   1.430  -2.733  -7.761
  578    HB2  HIS  72           HB2      HIS  72   2.770  -1.964  -5.945
  579    HB3  HIS  72           HB3      HIS  72   1.185  -2.262  -5.245
  580    HD1  HIS  72           HD1      HIS  72   1.031  -4.697  -3.966
  581    HD2  HIS  72           HD2      HIS  72   4.812  -3.148  -4.681
  582    HE1  HIS  72           HE1      HIS  72   2.603  -6.094  -2.605
  583    HE2  HIS  72           HE2      HIS  72   4.781  -4.815  -2.700
  584    H    ILE  73           H        ILE  73   2.958  -3.413  -9.162
  585    HA   ILE  73           HA       ILE  73   4.321  -5.907  -8.457
  586    HB   ILE  73           HB       ILE  73   2.639  -5.327 -10.799
  587   HG12  ILE  73          HG12      ILE  73   2.417  -6.980  -8.742
  588   HG13  ILE  73          HG13      ILE  73   1.786  -7.398 -10.343
  589   HG21  ILE  73          HG21      ILE  73   5.266  -6.746 -11.037
  590   HG22  ILE  73          HG22      ILE  73   4.587  -5.498 -12.080
  591   HG23  ILE  73          HG23      ILE  73   3.911  -7.126 -12.099
  592   HD11  ILE  73          HD11      ILE  73   3.692  -8.782 -10.790
  593   HD12  ILE  73          HD12      ILE  73   3.025  -9.230  -9.217
  594   HD13  ILE  73          HD13      ILE  73   4.484  -8.243  -9.311
  595    H    VAL  74           H        VAL  74   6.363  -5.890  -8.576
  596    HA   VAL  74           HA       VAL  74   7.873  -3.775  -9.765
  597    HB   VAL  74           HB       VAL  74   9.821  -4.967  -8.991
  598   HG11  VAL  74          HG11      VAL  74   8.553  -3.824  -7.263
  599   HG12  VAL  74          HG12      VAL  74   9.269  -5.295  -6.603
  600   HG13  VAL  74          HG13      VAL  74   7.552  -5.258  -7.012
  601   HG21  VAL  74          HG21      VAL  74   9.181  -7.225  -9.752
  602   HG22  VAL  74          HG22      VAL  74   8.018  -7.333  -8.429
  603   HG23  VAL  74          HG23      VAL  74   9.747  -7.229  -8.082
  604    H    LEU  75           H        LEU  75   9.261  -4.031 -11.621
  605    HA   LEU  75           HA       LEU  75   8.001  -5.125 -13.814
  606    HB2  LEU  75           HB2      LEU  75  10.157  -4.817 -15.007
  607    HB3  LEU  75           HB3      LEU  75   9.634  -3.412 -14.096
  608    HG   LEU  75           HG       LEU  75  11.327  -4.997 -12.427
  609   HD11  LEU  75          HD11      LEU  75  12.510  -4.310 -15.116
  610   HD12  LEU  75          HD12      LEU  75  12.219  -5.933 -14.489
  611   HD13  LEU  75          HD13      LEU  75  13.405  -4.884 -13.707
  612   HD21  LEU  75          HD21      LEU  75  11.715  -2.301 -13.729
  613   HD22  LEU  75          HD22      LEU  75  12.652  -2.937 -12.378
  614   HD23  LEU  75          HD23      LEU  75  10.930  -2.608 -12.178
  615    H    TRP  76           H        TRP  76   7.400  -7.253 -13.653
  616    HA   TRP  76           HA       TRP  76   9.457  -9.260 -13.171
  617    HB2  TRP  76           HB2      TRP  76   6.461  -9.346 -13.255
  618    HB3  TRP  76           HB3      TRP  76   7.390 -10.832 -13.396
  619    HD1  TRP  76           HD1      TRP  76   5.890  -8.610 -10.879
  620    HE1  TRP  76           HE1      TRP  76   6.688  -9.237  -8.518
  621    HE3  TRP  76           HE3      TRP  76   9.738 -11.704 -12.135
  622    HZ2  TRP  76           HZ2      TRP  76   8.685 -10.831  -7.344
  623    HZ3  TRP  76           HZ3      TRP  76  11.044 -12.742 -10.327
  624    HH2  TRP  76           HH2      TRP  76  10.526 -12.309  -7.994
  625    H    THR  77           H        THR  77  10.617  -9.693 -14.887
  626    HA   THR  77           HA       THR  77   9.301 -10.093 -17.474
  627    HB   THR  77           HB       THR  77  11.636 -10.153 -18.370
  628    HG1  THR  77           HG1      THR  77  13.085  -9.080 -16.552
  629   HG21  THR  77          HG21      THR  77  10.382  -8.044 -18.369
  630   HG22  THR  77          HG22      THR  77  12.097  -7.752 -18.085
  631   HG23  THR  77          HG23      THR  77  10.958  -7.695 -16.740
  632    H    GLY  78           H        GLY  78  10.384 -11.999 -18.751
  633    HA2  GLY  78           HA2      GLY  78  10.064 -14.441 -17.408
  634    HA3  GLY  78           HA3      GLY  78  10.942 -14.229 -18.919
  635    H    ASP  79           H        ASP  79  12.917 -12.507 -18.067
  636    HA   ASP  79           HA       ASP  79  14.901 -14.148 -16.997
  637    HB2  ASP  79           HB2      ASP  79  15.303 -12.077 -18.298
  638    HB3  ASP  79           HB3      ASP  79  14.720 -11.132 -16.936
  639    H    GLN  80           H        GLN  80  13.242 -11.414 -15.424
  640    HA   GLN  80           HA       GLN  80  14.433 -11.706 -12.923
  641    HB2  GLN  80           HB2      GLN  80  13.270  -9.663 -13.547
  642    HB3  GLN  80           HB3      GLN  80  11.749 -10.529 -13.642
  643    HG2  GLN  80           HG2      GLN  80  11.541 -10.710 -11.365
  644    HG3  GLN  80           HG3      GLN  80  13.265 -10.495 -11.082
  645   HE21  GLN  80          HE21      GLN  80  10.781  -9.143 -10.092
  646   HE22  GLN  80          HE22      GLN  80  11.052  -7.460 -10.370
  647    H    GLU  81           H        GLU  81  11.428 -13.089 -14.160
  648    HA   GLU  81           HA       GLU  81  10.599 -14.152 -11.670
  649    HB2  GLU  81           HB2      GLU  81   9.093 -13.716 -13.598
  650    HB3  GLU  81           HB3      GLU  81   9.826 -15.077 -14.437
  651    HG2  GLU  81           HG2      GLU  81   8.925 -16.629 -12.933
  652    HG3  GLU  81           HG3      GLU  81   8.538 -15.385 -11.747
  653    H    LEU  82           H        LEU  82  12.342 -15.548 -14.421
  654    HA   LEU  82           HA       LEU  82  12.600 -18.141 -13.298
  655    HB2  LEU  82           HB2      LEU  82  12.917 -17.805 -15.669
  656    HB3  LEU  82           HB3      LEU  82  14.253 -16.705 -15.372
  657    HG   LEU  82           HG       LEU  82  15.400 -18.695 -14.232
  658   HD11  LEU  82          HD11      LEU  82  13.453 -20.133 -14.050
  659   HD12  LEU  82          HD12      LEU  82  14.715 -20.900 -15.013
  660   HD13  LEU  82          HD13      LEU  82  13.311 -20.185 -15.807
  661   HD21  LEU  82          HD21      LEU  82  14.929 -18.706 -17.203
  662   HD22  LEU  82          HD22      LEU  82  16.252 -19.522 -16.367
  663   HD23  LEU  82          HD23      LEU  82  16.140 -17.763 -16.332
  664    H    GLU  83           H        GLU  83  14.550 -15.219 -13.165
  665    HA   GLU  83           HA       GLU  83  16.876 -16.345 -12.088
  666    HB2  GLU  83           HB2      GLU  83  16.484 -13.983 -13.059
  667    HB3  GLU  83           HB3      GLU  83  15.959 -13.558 -11.435
  668    HG2  GLU  83           HG2      GLU  83  18.290 -12.986 -11.770
  669    HG3  GLU  83           HG3      GLU  83  18.125 -14.248 -10.549
  670    H    LEU  84           H        LEU  84  14.064 -14.853 -10.475
  671    HA   LEU  84           HA       LEU  84  15.041 -15.346  -7.857
  672    HB2  LEU  84           HB2      LEU  84  13.268 -13.688  -8.323
  673    HB3  LEU  84           HB3      LEU  84  12.176 -14.990  -8.755
  674    HG   LEU  84           HG       LEU  84  13.397 -15.048  -6.024
  675   HD11  LEU  84          HD11      LEU  84  12.461 -12.692  -6.619
  676   HD12  LEU  84          HD12      LEU  84  12.011 -13.463  -5.101
  677   HD13  LEU  84          HD13      LEU  84  10.894 -13.489  -6.461
  678   HD21  LEU  84          HD21      LEU  84  10.678 -15.754  -7.123
  679   HD22  LEU  84          HD22      LEU  84  11.205 -15.988  -5.456
  680   HD23  LEU  84          HD23      LEU  84  11.980 -16.887  -6.761
  681    H    GLN  85           H        GLN  85  13.096 -17.188 -10.125
  682    HA   GLN  85           HA       GLN  85  12.220 -19.250  -8.482
  683    HB2  GLN  85           HB2      GLN  85  11.620 -18.826 -10.899
  684    HB3  GLN  85           HB3      GLN  85  13.147 -19.557 -11.343
  685    HG2  GLN  85           HG2      GLN  85  11.141 -21.026  -9.682
  686    HG3  GLN  85           HG3      GLN  85  11.007 -20.975 -11.432
  687   HE21  GLN  85          HE21      GLN  85  13.874 -21.112 -11.897
  688   HE22  GLN  85          HE22      GLN  85  14.360 -22.717 -11.498
  689    H    ARG  86           H        ARG  86  15.222 -19.076 -10.399
  690    HA   ARG  86           HA       ARG  86  16.271 -21.518  -9.428
  691    HB2  ARG  86           HB2      ARG  86  17.741 -19.148 -10.591
  692    HB3  ARG  86           HB3      ARG  86  18.400 -20.765 -10.396
  693    HG2  ARG  86           HG2      ARG  86  16.597 -21.595 -11.909
  694    HG3  ARG  86           HG3      ARG  86  16.158 -19.913 -12.211
  695    HD2  ARG  86           HD2      ARG  86  18.812 -21.222 -12.791
  696    HD3  ARG  86           HD3      ARG  86  17.605 -20.725 -13.974
  697    HE   ARG  86           HE       ARG  86  18.348 -18.486 -12.451
  698   HH11  ARG  86          HH11      ARG  86  19.695 -20.670 -14.831
  699   HH12  ARG  86          HH12      ARG  86  20.812 -19.503 -15.460
  700   HH21  ARG  86          HH21      ARG  86  19.813 -16.946 -13.252
  701   HH22  ARG  86          HH22      ARG  86  20.874 -17.370 -14.568
  702    H    LEU  87           H        LEU  87  16.548 -18.193  -8.304
  703    HA   LEU  87           HA       LEU  87  18.678 -18.667  -6.477
  704    HB2  LEU  87           HB2      LEU  87  17.969 -16.443  -7.453
  705    HB3  LEU  87           HB3      LEU  87  16.624 -16.469  -6.329
  706    HG   LEU  87           HG       LEU  87  18.303 -16.595  -4.458
  707   HD11  LEU  87          HD11      LEU  87  20.596 -15.910  -4.966
  708   HD12  LEU  87          HD12      LEU  87  20.227 -15.960  -6.689
  709   HD13  LEU  87          HD13      LEU  87  20.190 -17.443  -5.736
  710   HD21  LEU  87          HD21      LEU  87  18.462 -14.189  -6.262
  711   HD22  LEU  87          HD22      LEU  87  18.838 -14.226  -4.541
  712   HD23  LEU  87          HD23      LEU  87  17.188 -14.515  -5.089
  713    H    PHE  88           H        PHE  88  15.172 -18.372  -6.104
  714    HA   PHE  88           HA       PHE  88  14.757 -18.737  -3.456
  715    HB2  PHE  88           HB2      PHE  88  12.853 -18.416  -4.736
  716    HB3  PHE  88           HB3      PHE  88  13.317 -19.629  -5.917
  717    HD1  PHE  88           HD1      PHE  88  12.710 -21.907  -5.657
  718    HD2  PHE  88           HD2      PHE  88  11.804 -19.072  -2.617
  719    HE1  PHE  88           HE1      PHE  88  11.178 -23.520  -4.619
  720    HE2  PHE  88           HE2      PHE  88  10.266 -20.687  -1.573
  721    HZ   PHE  88           HZ       PHE  88   9.955 -22.908  -2.583
  722    H    GLU  89           H        GLU  89  15.356 -21.329  -5.809
  723    HA   GLU  89           HA       GLU  89  15.120 -23.478  -3.994
  724    HB2  GLU  89           HB2      GLU  89  16.799 -23.282  -6.485
  725    HB3  GLU  89           HB3      GLU  89  16.328 -24.769  -5.683
  726    HG2  GLU  89           HG2      GLU  89  14.041 -24.428  -6.258
  727    HG3  GLU  89           HG3      GLU  89  14.386 -22.800  -6.850
  728    H    GLU  90           H        GLU  90  17.844 -21.527  -5.025
  729    HA   GLU  90           HA       GLU  90  19.802 -23.310  -3.989
  730    HB2  GLU  90           HB2      GLU  90  19.862 -20.561  -5.170
  731    HB3  GLU  90           HB3      GLU  90  21.324 -21.324  -4.544
  732    HG2  GLU  90           HG2      GLU  90  19.545 -22.405  -6.714
  733    HG3  GLU  90           HG3      GLU  90  21.110 -21.625  -6.949
  734    H    PHE  91           H        PHE  91  18.472 -20.215  -2.877
  735    HA   PHE  91           HA       PHE  91  20.136 -20.437  -0.473
  736    HB2  PHE  91           HB2      PHE  91  18.599 -18.155  -1.688
  737    HB3  PHE  91           HB3      PHE  91  19.153 -18.095  -0.017
  738    HD1  PHE  91           HD1      PHE  91  20.215 -18.204  -3.530
  739    HD2  PHE  91           HD2      PHE  91  21.466 -17.832   0.520
  740    HE1  PHE  91           HE1      PHE  91  22.436 -17.465  -4.287
  741    HE2  PHE  91           HE2      PHE  91  23.685 -17.084  -0.230
  742    HZ   PHE  91           HZ       PHE  91  24.173 -16.902  -2.637
  743    H    ARG  92           H        ARG  92  17.598 -21.963  -1.182
  744    HA   ARG  92           HA       ARG  92  15.640 -21.111   0.726
  745    HB2  ARG  92           HB2      ARG  92  15.270 -22.464  -1.434
  746    HB3  ARG  92           HB3      ARG  92  15.785 -23.855  -0.491
  747    HG2  ARG  92           HG2      ARG  92  13.963 -23.562   1.039
  748    HG3  ARG  92           HG3      ARG  92  13.498 -22.055   0.253
  749    HD2  ARG  92           HD2      ARG  92  12.939 -23.241  -1.781
  750    HD3  ARG  92           HD3      ARG  92  13.506 -24.756  -1.085
  751    HE   ARG  92           HE       ARG  92  11.397 -23.426   0.384
  752   HH11  ARG  92          HH11      ARG  92  12.185 -25.771  -2.082
  753   HH12  ARG  92          HH12      ARG  92  10.737 -26.698  -1.841
  754   HH21  ARG  92          HH21      ARG  92   9.473 -24.642   0.693
  755   HH22  ARG  92          HH22      ARG  92   9.214 -26.076  -0.254
  756    H    ASP  93           H        ASP  93  18.535 -22.773   0.940
  757    HA   ASP  93           HA       ASP  93  17.958 -24.479   3.157
  758    HB2  ASP  93           HB2      ASP  93  19.837 -24.885   1.614
  759    HB3  ASP  93           HB3      ASP  93  20.607 -23.398   2.153
  760    H    SER  94           H        SER  94  17.697 -21.311   3.013
  761    HA   SER  94           HA       SER  94  18.930 -20.741   5.613
  762    HB2  SER  94           HB2      SER  94  17.629 -18.755   3.742
  763    HB3  SER  94           HB3      SER  94  18.764 -18.427   5.052
  764    HG   SER  94           HG       SER  94  19.240 -19.538   2.508
  765    H    ASP  95           H        ASP  95  17.572 -19.482   7.147
  766    HA   ASP  95           HA       ASP  95  15.090 -20.772   7.559
  767    HB2  ASP  95           HB2      ASP  95  16.722 -19.620   9.243
  768    HB3  ASP  95           HB3      ASP  95  15.779 -18.180   8.888
  769    H    ASP  96           H        ASP  96  15.883 -17.422   6.675
  770    HA   ASP  96           HA       ASP  96  13.233 -17.180   5.427
  771    HB2  ASP  96           HB2      ASP  96  15.298 -15.094   6.161
  772    HB3  ASP  96           HB3      ASP  96  13.906 -14.742   5.147
  773    H    VAL  97           H        VAL  97  13.473 -18.201   3.439
  774    HA   VAL  97           HA       VAL  97  15.823 -17.992   1.885
  775    HB   VAL  97           HB       VAL  97  14.233 -19.808   1.476
  776   HG11  VAL  97          HG11      VAL  97  12.420 -17.741   0.251
  777   HG12  VAL  97          HG12      VAL  97  12.142 -18.542   1.800
  778   HG13  VAL  97          HG13      VAL  97  12.153 -19.485   0.307
  779   HG21  VAL  97          HG21      VAL  97  14.648 -18.013  -0.906
  780   HG22  VAL  97          HG22      VAL  97  14.253 -19.730  -0.981
  781   HG23  VAL  97          HG23      VAL  97  15.787 -19.206  -0.285
  782    H    LEU  98           H        LEU  98  12.843 -16.108   1.961
  783    HA   LEU  98           HA       LEU  98  13.287 -14.535  -0.304
  784    HB2  LEU  98           HB2      LEU  98  11.960 -13.653   2.258
  785    HB3  LEU  98           HB3      LEU  98  11.790 -12.893   0.690
  786    HG   LEU  98           HG       LEU  98  10.968 -15.461   0.177
  787   HD11  LEU  98          HD11      LEU  98  10.999 -16.137   2.463
  788   HD12  LEU  98          HD12      LEU  98   9.313 -15.917   1.980
  789   HD13  LEU  98          HD13      LEU  98  10.124 -14.688   2.952
  790   HD21  LEU  98          HD21      LEU  98   9.887 -13.444  -0.604
  791   HD22  LEU  98          HD22      LEU  98   9.327 -13.083   1.027
  792   HD23  LEU  98          HD23      LEU  98   8.709 -14.498   0.175
  793    H    GLY  99           H        GLY  99  14.381 -14.159   3.028
  794    HA2  GLY  99           HA2      GLY  99  15.421 -11.601   2.933
  795    HA3  GLY  99           HA3      GLY  99  16.060 -12.897   3.939
  796    H    HIS 100           H        HIS 100  17.027 -14.629   1.982
  797    HA   HIS 100           HA       HIS 100  19.427 -13.192   1.263
  798    HB2  HIS 100           HB2      HIS 100  18.634 -16.092   1.084
  799    HB3  HIS 100           HB3      HIS 100  20.121 -15.491   0.352
  800    HD1  HIS 100           HD1      HIS 100  22.079 -15.019   1.889
  801    HD2  HIS 100           HD2      HIS 100  18.577 -15.920   3.940
  802    HE1  HIS 100           HE1      HIS 100  22.741 -15.240   4.296
  803    HE2  HIS 100           HE2      HIS 100  20.574 -15.544   5.537
  804    H    ILE 101           H        ILE 101  16.567 -14.366  -0.296
  805    HA   ILE 101           HA       ILE 101  17.354 -14.098  -2.972
  806    HB   ILE 101           HB       ILE 101  14.667 -13.671  -1.655
  807   HG12  ILE 101          HG12      ILE 101  15.749 -15.898  -3.404
  808   HG13  ILE 101          HG13      ILE 101  15.523 -15.978  -1.660
  809   HG21  ILE 101          HG21      ILE 101  13.682 -13.688  -3.902
  810   HG22  ILE 101          HG22      ILE 101  15.297 -13.679  -4.607
  811   HG23  ILE 101          HG23      ILE 101  14.741 -12.300  -3.660
  812   HD11  ILE 101          HD11      ILE 101  13.112 -15.708  -1.969
  813   HD12  ILE 101          HD12      ILE 101  13.731 -17.120  -2.822
  814   HD13  ILE 101          HD13      ILE 101  13.349 -15.649  -3.715
  815    H    MET 102           H        MET 102  15.775 -11.747  -0.813
  816    HA   MET 102           HA       MET 102  15.744  -9.629  -2.692
  817    HB2  MET 102           HB2      MET 102  15.816  -9.159   0.279
  818    HB3  MET 102           HB3      MET 102  14.948  -8.263  -0.959
  819    HG2  MET 102           HG2      MET 102  13.278  -9.913  -1.130
  820    HG3  MET 102           HG3      MET 102  14.241 -11.089  -0.262
  821    HE1  MET 102           HE1      MET 102  12.052  -7.514   1.597
  822    HE2  MET 102           HE2      MET 102  11.845  -8.086  -0.061
  823    HE3  MET 102           HE3      MET 102  13.360  -7.322   0.429
  824    H    LYS 103           H        LYS 103  18.110 -10.822  -0.495
  825    HA   LYS 103           HA       LYS 103  19.694  -8.452  -0.299
  826    HB2  LYS 103           HB2      LYS 103  19.615 -10.285   1.409
  827    HB3  LYS 103           HB3      LYS 103  20.473 -11.316   0.278
  828    HG2  LYS 103           HG2      LYS 103  22.096 -10.517   1.769
  829    HG3  LYS 103           HG3      LYS 103  22.314  -9.586   0.289
  830    HD2  LYS 103           HD2      LYS 103  22.467  -8.112   2.194
  831    HD3  LYS 103           HD3      LYS 103  20.992  -7.752   1.293
  832    HE2  LYS 103           HE2      LYS 103  19.647  -8.913   2.898
  833    HE3  LYS 103           HE3      LYS 103  21.077  -9.539   3.719
  834    HZ1  LYS 103           HZ1      LYS 103  20.285  -6.688   3.552
  835    HZ2  LYS 103           HZ2      LYS 103  21.658  -7.277   4.336
  836    HZ3  LYS 103           HZ3      LYS 103  20.121  -7.679   4.910
  837    H    ASN 104           H        ASN 104  19.850 -11.416  -2.242
  838    HA   ASN 104           HA       ASN 104  22.390 -10.485  -3.398
  839    HB2  ASN 104           HB2      ASN 104  21.189 -13.245  -3.183
  840    HB3  ASN 104           HB3      ASN 104  22.606 -12.893  -4.162
  841   HD21  ASN 104          HD21      ASN 104  23.906 -14.245  -2.957
  842   HD22  ASN 104          HD22      ASN 104  24.427 -13.853  -1.355
  843    H    ILE 105           H        ILE 105  19.219 -10.354  -4.208
  844    HA   ILE 105           HA       ILE 105  19.582 -11.194  -6.974
  845    HB   ILE 105           HB       ILE 105  17.487 -11.742  -5.720
  846   HG12  ILE 105          HG12      ILE 105  15.946 -11.168  -7.602
  847   HG13  ILE 105          HG13      ILE 105  17.224 -10.162  -8.274
  848   HG21  ILE 105          HG21      ILE 105  16.917  -8.809  -6.070
  849   HG22  ILE 105          HG22      ILE 105  17.194  -9.637  -4.538
  850   HG23  ILE 105          HG23      ILE 105  15.767 -10.020  -5.501
  851   HD11  ILE 105          HD11      ILE 105  18.647 -12.114  -8.522
  852   HD12  ILE 105          HD12      ILE 105  17.114 -12.337  -9.360
  853   HD13  ILE 105          HD13      ILE 105  17.393 -13.130  -7.811
  854    H    THR 106           H        THR 106  18.908  -9.799  -8.717
  855    HA   THR 106           HA       THR 106  20.336  -7.360  -8.607
  856    HB   THR 106           HB       THR 106  20.158  -8.948 -10.548
  857    HG1  THR 106           HG1      THR 106  20.330  -7.278 -12.046
  858   HG21  THR 106          HG21      THR 106  17.472  -7.621 -10.865
  859   HG22  THR 106          HG22      THR 106  17.781  -9.330 -10.564
  860   HG23  THR 106          HG23      THR 106  18.261  -8.604 -12.098
  861    H    ALA 107           H        ALA 107  16.886  -8.162  -8.595
  862    HA   ALA 107           HA       ALA 107  16.199  -5.317  -8.684
  863    HB1  ALA 107           HB1      ALA 107  14.372  -7.704  -8.765
  864    HB2  ALA 107           HB2      ALA 107  14.977  -6.846 -10.184
  865    HB3  ALA 107           HB3      ALA 107  13.917  -6.023  -9.037
  866    H    LYS 108           H        LYS 108  15.626  -4.252  -6.914
  867    HA   LYS 108           HA       LYS 108  15.519  -5.755  -4.430
  868    HB2  LYS 108           HB2      LYS 108  15.349  -2.759  -4.672
  869    HB3  LYS 108           HB3      LYS 108  15.894  -3.713  -3.301
  870    HG2  LYS 108           HG2      LYS 108  17.342  -3.126  -5.863
  871    HG3  LYS 108           HG3      LYS 108  17.837  -2.780  -4.210
  872    HD2  LYS 108           HD2      LYS 108  17.620  -5.528  -5.440
  873    HD3  LYS 108           HD3      LYS 108  19.115  -4.632  -5.189
  874    HE2  LYS 108           HE2      LYS 108  17.237  -5.456  -2.983
  875    HE3  LYS 108           HE3      LYS 108  18.653  -6.380  -3.479
  876    HZ1  LYS 108           HZ1      LYS 108  19.111  -4.968  -1.564
  877    HZ2  LYS 108           HZ2      LYS 108  18.705  -3.591  -2.456
  878    HZ3  LYS 108           HZ3      LYS 108  20.050  -4.517  -2.896
  879    H    ARG 109           H        ARG 109  13.635  -6.538  -3.888
  880    HA   ARG 109           HA       ARG 109  11.207  -4.954  -4.360
  881    HB2  ARG 109           HB2      ARG 109  10.047  -6.962  -5.158
  882    HB3  ARG 109           HB3      ARG 109  11.434  -6.603  -6.178
  883    HG2  ARG 109           HG2      ARG 109  12.732  -8.297  -4.901
  884    HG3  ARG 109           HG3      ARG 109  11.246  -8.721  -4.053
  885    HD2  ARG 109           HD2      ARG 109  11.386 -10.294  -5.767
  886    HD3  ARG 109           HD3      ARG 109  10.246  -9.098  -6.378
  887    HE   ARG 109           HE       ARG 109  11.877  -8.353  -7.904
  888   HH11  ARG 109          HH11      ARG 109  13.075 -10.959  -5.907
  889   HH12  ARG 109          HH12      ARG 109  14.286 -11.453  -7.040
  890   HH21  ARG 109          HH21      ARG 109  13.475  -9.011  -9.423
  891   HH22  ARG 109          HH22      ARG 109  14.521 -10.339  -9.044
  892    H    SER 110           H        SER 110   9.313  -6.010  -3.134
  893    HA   SER 110           HA       SER 110  10.267  -6.445  -0.414
  894    HB2  SER 110           HB2      SER 110   7.394  -6.066  -1.236
  895    HB3  SER 110           HB3      SER 110   8.157  -5.673   0.304
  896    HG   SER 110           HG       SER 110   9.379  -4.067  -0.880
  897    H    ARG 111           H        ARG 111   9.056  -7.976   0.971
  898    HA   ARG 111           HA       ARG 111   9.275 -10.557  -0.176
  899    HB2  ARG 111           HB2      ARG 111   8.382  -9.582   2.515
  900    HB3  ARG 111           HB3      ARG 111   8.333 -11.289   2.085
  901    HG2  ARG 111           HG2      ARG 111  10.775 -11.074   1.497
  902    HG3  ARG 111           HG3      ARG 111  10.725  -9.492   2.275
  903    HD2  ARG 111           HD2      ARG 111  10.038 -10.489   4.353
  904    HD3  ARG 111           HD3      ARG 111   9.931 -12.075   3.589
  905    HE   ARG 111           HE       ARG 111  12.532 -10.932   3.314
  906   HH11  ARG 111          HH11      ARG 111  10.402 -12.706   5.451
  907   HH12  ARG 111          HH12      ARG 111  11.686 -13.377   6.417
  908   HH21  ARG 111          HH21      ARG 111  14.244 -11.720   4.665
  909   HH22  ARG 111          HH22      ARG 111  13.862 -12.778   5.987
  910    H    ALA 112           H        ALA 112   6.473  -8.655   0.887
  911    HA   ALA 112           HA       ALA 112   4.526 -10.619   0.573
  912    HB1  ALA 112           HB1      ALA 112   2.920  -8.798   0.370
  913    HB2  ALA 112           HB2      ALA 112   4.226  -7.663   0.037
  914    HB3  ALA 112           HB3      ALA 112   4.108  -8.430   1.621
  915    H    ARG 113           H        ARG 113   6.204  -8.677  -1.752
  916    HA   ARG 113           HA       ARG 113   4.461  -9.315  -3.954
  917    HB2  ARG 113           HB2      ARG 113   6.310  -7.338  -3.447
  918    HB3  ARG 113           HB3      ARG 113   7.166  -8.364  -4.586
  919    HG2  ARG 113           HG2      ARG 113   4.438  -7.183  -5.048
  920    HG3  ARG 113           HG3      ARG 113   5.953  -6.501  -5.640
  921    HD2  ARG 113           HD2      ARG 113   5.078  -7.710  -7.447
  922    HD3  ARG 113           HD3      ARG 113   6.334  -8.735  -6.778
  923    HE   ARG 113           HE       ARG 113   4.752 -10.297  -6.255
  924   HH11  ARG 113          HH11      ARG 113   3.115  -7.237  -6.753
  925   HH12  ARG 113          HH12      ARG 113   1.548  -7.970  -6.940
  926   HH21  ARG 113          HH21      ARG 113   2.660 -11.239  -6.480
  927   HH22  ARG 113          HH22      ARG 113   1.295 -10.213  -6.771
  928    H    ILE 114           H        ILE 114   7.480 -10.469  -2.611
  929    HA   ILE 114           HA       ILE 114   8.159 -12.234  -4.746
  930    HB   ILE 114           HB       ILE 114   9.002 -12.205  -1.842
  931   HG12  ILE 114          HG12      ILE 114  10.494 -11.316  -4.308
  932   HG13  ILE 114          HG13      ILE 114   9.640 -10.229  -3.217
  933   HG21  ILE 114          HG21      ILE 114   9.280 -14.435  -2.735
  934   HG22  ILE 114          HG22      ILE 114  10.855 -13.666  -2.528
  935   HG23  ILE 114          HG23      ILE 114  10.140 -13.796  -4.137
  936   HD11  ILE 114          HD11      ILE 114  11.993 -11.978  -2.506
  937   HD12  ILE 114          HD12      ILE 114  11.125 -10.931  -1.380
  938   HD13  ILE 114          HD13      ILE 114  12.016 -10.229  -2.734
  939    H    VAL 115           H        VAL 115   6.551 -12.576  -1.638
  940    HA   VAL 115           HA       VAL 115   6.226 -15.305  -1.470
  941    HB   VAL 115           HB       VAL 115   4.533 -13.017  -0.520
  942   HG11  VAL 115          HG11      VAL 115   2.986 -14.832  -0.784
  943   HG12  VAL 115          HG12      VAL 115   3.347 -14.642   0.931
  944   HG13  VAL 115          HG13      VAL 115   4.095 -15.946   0.012
  945   HG21  VAL 115          HG21      VAL 115   6.368 -14.949   0.890
  946   HG22  VAL 115          HG22      VAL 115   5.411 -13.695   1.678
  947   HG23  VAL 115          HG23      VAL 115   6.687 -13.249   0.546
  948    H    ASP 116           H        ASP 116   3.881 -12.980  -2.847
  949    HA   ASP 116           HA       ASP 116   2.045 -14.881  -3.775
  950    HB2  ASP 116           HB2      ASP 116   1.495 -12.508  -3.659
  951    HB3  ASP 116           HB3      ASP 116   2.688 -12.147  -4.898
  952    H    LYS 117           H        LYS 117   4.978 -13.610  -5.202
  953    HA   LYS 117           HA       LYS 117   4.619 -14.619  -7.802
  954    HB2  LYS 117           HB2      LYS 117   6.232 -12.864  -7.281
  955    HB3  LYS 117           HB3      LYS 117   7.151 -13.972  -6.280
  956    HG2  LYS 117           HG2      LYS 117   8.185 -13.558  -8.462
  957    HG3  LYS 117           HG3      LYS 117   7.800 -15.256  -8.199
  958    HD2  LYS 117           HD2      LYS 117   7.292 -14.418 -10.483
  959    HD3  LYS 117           HD3      LYS 117   5.907 -15.125  -9.654
  960    HE2  LYS 117           HE2      LYS 117   5.140 -12.846  -9.099
  961    HE3  LYS 117           HE3      LYS 117   6.509 -12.189  -9.997
  962    HZ1  LYS 117           HZ1      LYS 117   4.702 -12.159 -11.477
  963    HZ2  LYS 117           HZ2      LYS 117   4.200 -13.711 -11.048
  964    HZ3  LYS 117           HZ3      LYS 117   5.619 -13.507 -11.950
  965    H    LEU 118           H        LEU 118   6.001 -16.071  -4.873
  966    HA   LEU 118           HA       LEU 118   6.969 -18.431  -6.101
  967    HB2  LEU 118           HB2      LEU 118   5.890 -18.065  -3.311
  968    HB3  LEU 118           HB3      LEU 118   6.766 -19.471  -3.873
  969    HG   LEU 118           HG       LEU 118   7.812 -16.708  -3.353
  970   HD11  LEU 118          HD11      LEU 118   8.478 -19.484  -2.392
  971   HD12  LEU 118          HD12      LEU 118   7.725 -18.181  -1.467
  972   HD13  LEU 118          HD13      LEU 118   9.406 -18.036  -1.984
  973   HD21  LEU 118          HD21      LEU 118   9.959 -17.439  -4.272
  974   HD22  LEU 118          HD22      LEU 118   8.712 -17.397  -5.518
  975   HD23  LEU 118          HD23      LEU 118   9.215 -18.941  -4.823
  976    H    LEU 119           H        LEU 119   3.887 -17.609  -4.607
  977    HA   LEU 119           HA       LEU 119   2.648 -20.124  -4.852
  978    HB2  LEU 119           HB2      LEU 119   1.663 -17.316  -4.527
  979    HB3  LEU 119           HB3      LEU 119   0.518 -18.602  -4.840
  980    HG   LEU 119           HG       LEU 119   0.698 -18.067  -2.436
  981   HD11  LEU 119          HD11      LEU 119   1.670 -20.808  -3.209
  982   HD12  LEU 119          HD12      LEU 119  -0.009 -20.272  -3.114
  983   HD13  LEU 119          HD13      LEU 119   0.972 -20.369  -1.651
  984   HD21  LEU 119          HD21      LEU 119   3.046 -17.437  -2.309
  985   HD22  LEU 119          HD22      LEU 119   3.529 -19.090  -2.695
  986   HD23  LEU 119          HD23      LEU 119   2.694 -18.744  -1.179
  987    H    ALA 120           H        ALA 120   3.076 -17.480  -7.033
  988    HA   ALA 120           HA       ALA 120   1.107 -18.291  -8.935
  989    HB1  ALA 120           HB1      ALA 120   3.459 -16.457  -9.345
  990    HB2  ALA 120           HB2      ALA 120   1.924 -15.967  -8.625
  991    HB3  ALA 120           HB3      ALA 120   1.976 -16.526 -10.300
  992    H    LEU 121           H        LEU 121   4.623 -18.680  -8.654
  993    HA   LEU 121           HA       LEU 121   4.900 -20.164 -11.083
  994    HB2  LEU 121           HB2      LEU 121   6.616 -19.604  -8.704
  995    HB3  LEU 121           HB3      LEU 121   7.082 -20.889  -9.798
  996    HG   LEU 121           HG       LEU 121   7.258 -19.315 -11.629
  997   HD11  LEU 121          HD11      LEU 121   7.013 -16.915 -11.287
  998   HD12  LEU 121          HD12      LEU 121   6.456 -17.206  -9.639
  999   HD13  LEU 121          HD13      LEU 121   5.492 -17.763 -11.007
 1000   HD21  LEU 121          HD21      LEU 121   9.150 -17.985 -10.766
 1001   HD22  LEU 121          HD22      LEU 121   9.210 -19.675 -10.259
 1002   HD23  LEU 121          HD23      LEU 121   8.679 -18.433  -9.125
 1003    H    GLY 122           H        GLY 122   3.971 -20.907  -7.855
 1004    HA2  GLY 122           HA2      GLY 122   3.251 -22.912  -6.943
 1005    HA3  GLY 122           HA3      GLY 122   3.640 -23.711  -8.464
 1006    H    LEU 123           H        LEU 123   5.896 -21.694  -6.728
 1007    HA   LEU 123           HA       LEU 123   7.798 -23.835  -6.504
 1008    HB2  LEU 123           HB2      LEU 123   7.782 -20.981  -5.551
 1009    HB3  LEU 123           HB3      LEU 123   9.115 -22.078  -5.236
 1010    HG   LEU 123           HG       LEU 123   8.146 -21.232  -7.969
 1011   HD11  LEU 123          HD11      LEU 123   9.252 -19.414  -6.822
 1012   HD12  LEU 123          HD12      LEU 123  10.304 -20.053  -8.084
 1013   HD13  LEU 123          HD13      LEU 123  10.602 -20.468  -6.396
 1014   HD21  LEU 123          HD21      LEU 123  10.497 -22.931  -7.147
 1015   HD22  LEU 123          HD22      LEU 123  10.138 -22.393  -8.785
 1016   HD23  LEU 123          HD23      LEU 123   9.043 -23.499  -7.965
 1017    H    VAL 124           H        VAL 124   5.386 -22.374  -4.626
 1018    HA   VAL 124           HA       VAL 124   5.826 -24.340  -2.497
 1019    HB   VAL 124           HB       VAL 124   5.227 -22.703  -0.781
 1020   HG11  VAL 124          HG11      VAL 124   7.589 -23.083  -1.235
 1021   HG12  VAL 124          HG12      VAL 124   7.311 -21.402  -0.783
 1022   HG13  VAL 124          HG13      VAL 124   7.568 -21.829  -2.474
 1023   HG21  VAL 124          HG21      VAL 124   5.193 -20.286  -1.352
 1024   HG22  VAL 124          HG22      VAL 124   3.872 -21.195  -2.082
 1025   HG23  VAL 124          HG23      VAL 124   5.263 -20.727  -3.059
 1026    H    ALA 125           H        ALA 125   3.772 -24.285  -1.040
 1027    HA   ALA 125           HA       ALA 125   1.437 -24.163  -2.835
 1028    HB1  ALA 125           HB1      ALA 125   2.012 -26.444  -2.188
 1029    HB2  ALA 125           HB2      ALA 125   0.460 -25.965  -1.503
 1030    HB3  ALA 125           HB3      ALA 125   1.900 -25.998  -0.486
 1031    H    GLU 126           H        GLU 126   2.881 -22.709  -0.267
 1032    HA   GLU 126           HA       GLU 126   0.645 -21.162   0.524
 1033    HB2  GLU 126           HB2      GLU 126   0.492 -21.973   2.853
 1034    HB3  GLU 126           HB3      GLU 126   0.008 -23.208   1.695
 1035    HG2  GLU 126           HG2      GLU 126   2.331 -24.132   1.861
 1036    HG3  GLU 126           HG3      GLU 126   2.602 -23.022   3.200
 1037    H    ARG 127           H        ARG 127   1.306 -19.905   2.636
 1038    HA   ARG 127           HA       ARG 127   3.917 -18.833   2.107
 1039    HB2  ARG 127           HB2      ARG 127   1.689 -18.096   3.962
 1040    HB3  ARG 127           HB3      ARG 127   3.286 -17.404   4.203
 1041    HG2  ARG 127           HG2      ARG 127   2.036 -15.869   2.910
 1042    HG3  ARG 127           HG3      ARG 127   3.212 -16.615   1.842
 1043    HD2  ARG 127           HD2      ARG 127   1.547 -18.026   0.884
 1044    HD3  ARG 127           HD3      ARG 127   0.348 -17.510   2.069
 1045    HE   ARG 127           HE       ARG 127   1.251 -15.241   0.713
 1046   HH11  ARG 127          HH11      ARG 127  -0.615 -18.137   0.057
 1047   HH12  ARG 127          HH12      ARG 127  -1.520 -17.412  -1.232
 1048   HH21  ARG 127          HH21      ARG 127   0.051 -14.285  -0.968
 1049   HH22  ARG 127          HH22      ARG 127  -1.139 -15.223  -1.820
 1050    H    ARG 128           H        ARG 128   2.628 -21.148   4.245
 1051    HA   ARG 128           HA       ARG 128   4.315 -20.987   6.459
 1052    HB2  ARG 128           HB2      ARG 128   2.286 -22.424   6.240
 1053    HB3  ARG 128           HB3      ARG 128   3.195 -23.486   5.177
 1054    HG2  ARG 128           HG2      ARG 128   4.844 -23.642   7.169
 1055    HG3  ARG 128           HG3      ARG 128   3.470 -23.066   8.114
 1056    HD2  ARG 128           HD2      ARG 128   3.717 -25.591   6.508
 1057    HD3  ARG 128           HD3      ARG 128   3.371 -25.416   8.225
 1058    HE   ARG 128           HE       ARG 128   1.422 -24.410   6.275
 1059   HH11  ARG 128          HH11      ARG 128   2.303 -26.806   8.680
 1060   HH12  ARG 128          HH12      ARG 128   0.692 -27.426   8.836
 1061   HH21  ARG 128          HH21      ARG 128  -0.684 -25.222   6.468
 1062   HH22  ARG 128          HH22      ARG 128  -1.023 -26.498   7.595
 1063    H    GLU 129           H        GLU 129   4.830 -22.290   3.279
 1064    HA   GLU 129           HA       GLU 129   7.074 -23.919   4.055
 1065    HB2  GLU 129           HB2      GLU 129   5.833 -23.371   1.363
 1066    HB3  GLU 129           HB3      GLU 129   7.060 -24.578   1.684
 1067    HG2  GLU 129           HG2      GLU 129   4.253 -24.511   2.758
 1068    HG3  GLU 129           HG3      GLU 129   4.907 -25.637   1.572
 1069    H    LEU 130           H        LEU 130   6.772 -20.691   3.347
 1070    HA   LEU 130           HA       LEU 130   9.106 -20.442   1.645
 1071    HB2  LEU 130           HB2      LEU 130   8.046 -18.045   3.016
 1072    HB3  LEU 130           HB3      LEU 130   8.532 -18.259   1.348
 1073    HG   LEU 130           HG       LEU 130   5.905 -19.026   2.595
 1074   HD11  LEU 130          HD11      LEU 130   6.118 -16.687   2.080
 1075   HD12  LEU 130          HD12      LEU 130   5.010 -17.459   0.945
 1076   HD13  LEU 130          HD13      LEU 130   6.656 -17.068   0.443
 1077   HD21  LEU 130          HD21      LEU 130   6.769 -19.497  -0.251
 1078   HD22  LEU 130          HD22      LEU 130   5.205 -19.881   0.477
 1079   HD23  LEU 130          HD23      LEU 130   6.652 -20.751   0.990
 1080    H    TYR 131           H        TYR 131   8.457 -20.782   4.882
 1081    HA   TYR 131           HA       TYR 131  11.082 -19.703   5.660
 1082    HB2  TYR 131           HB2      TYR 131   8.674 -19.920   7.483
 1083    HB3  TYR 131           HB3      TYR 131  10.169 -19.037   7.774
 1084    HD1  TYR 131           HD1      TYR 131  10.479 -16.813   6.911
 1085    HD2  TYR 131           HD2      TYR 131   6.982 -19.024   5.905
 1086    HE1  TYR 131           HE1      TYR 131   9.443 -14.770   6.023
 1087    HE2  TYR 131           HE2      TYR 131   5.934 -16.986   5.015
 1088    HH   TYR 131           HH       TYR 131   7.741 -14.016   4.654
 1089    H    LYS 132           H        LYS 132  12.393 -21.395   6.118
 1090    HA   LYS 132           HA       LYS 132  11.458 -24.001   5.858
 1091    HB2  LYS 132           HB2      LYS 132  13.637 -24.706   6.061
 1092    HB3  LYS 132           HB3      LYS 132  13.880 -23.017   5.646
 1093    HG2  LYS 132           HG2      LYS 132  14.271 -22.472   7.978
 1094    HG3  LYS 132           HG3      LYS 132  13.978 -24.149   8.433
 1095    HD2  LYS 132           HD2      LYS 132  15.877 -24.801   6.939
 1096    HD3  LYS 132           HD3      LYS 132  16.222 -23.083   6.727
 1097    HE2  LYS 132           HE2      LYS 132  16.187 -24.552   9.362
 1098    HE3  LYS 132           HE3      LYS 132  17.634 -24.121   8.453
 1099    HZ1  LYS 132           HZ1      LYS 132  17.134 -22.556  10.250
 1100    HZ2  LYS 132           HZ2      LYS 132  15.660 -22.162   9.514
 1101    HZ3  LYS 132           HZ3      LYS 132  17.124 -21.810   8.736
 1102    H    LYS 133           H        LYS 133  10.618 -25.429   7.159
 1103    HA   LYS 133           HA       LYS 133  10.572 -24.867  10.048
 1104    HB2  LYS 133           HB2      LYS 133   8.407 -24.417   8.771
 1105    HB3  LYS 133           HB3      LYS 133   8.342 -26.144   8.454
 1106    HG2  LYS 133           HG2      LYS 133   8.174 -26.616  10.813
 1107    HG3  LYS 133           HG3      LYS 133   8.358 -24.904  11.199
 1108    HD2  LYS 133           HD2      LYS 133   6.271 -24.401  10.065
 1109    HD3  LYS 133           HD3      LYS 133   6.106 -26.090   9.582
 1110    HE2  LYS 133           HE2      LYS 133   6.001 -26.740  11.948
 1111    HE3  LYS 133           HE3      LYS 133   6.122 -25.043  12.409
 1112    HZ1  LYS 133           HZ1      LYS 133   3.940 -26.183  10.753
 1113    HZ2  LYS 133           HZ2      LYS 133   4.030 -24.604  11.349
 1114    HZ3  LYS 133           HZ3      LYS 133   3.830 -25.900  12.415
 1115    H    ARG 134           H        ARG 134  10.141 -26.914  11.336
 1116    HA   ARG 134           HA       ARG 134  11.654 -29.099  10.264
 1117    HB2  ARG 134           HB2      ARG 134  10.334 -28.528  12.876
 1118    HB3  ARG 134           HB3      ARG 134  10.697 -30.203  12.478
 1119    HG2  ARG 134           HG2      ARG 134  12.475 -29.111  13.798
 1120    HG3  ARG 134           HG3      ARG 134  13.037 -29.692  12.232
 1121    HD2  ARG 134           HD2      ARG 134  12.458 -27.254  11.468
 1122    HD3  ARG 134           HD3      ARG 134  12.615 -26.897  13.186
 1123    HE   ARG 134           HE       ARG 134  14.894 -27.484  13.083
 1124   HH11  ARG 134          HH11      ARG 134  13.313 -27.672   9.956
 1125   HH12  ARG 134          HH12      ARG 134  14.801 -27.647   9.065
 1126   HH21  ARG 134          HH21      ARG 134  16.849 -27.454  11.898
 1127   HH22  ARG 134          HH22      ARG 134  16.803 -27.545  10.166
 1128    H    GLN 135           H        GLN 135  10.658 -29.832   8.521
 1129    HA   GLN 135           HA       GLN 135   7.882 -30.283   8.250
 1130    HB2  GLN 135           HB2      GLN 135  10.113 -31.569   6.665
 1131    HB3  GLN 135           HB3      GLN 135   8.453 -31.314   6.142
 1132    HG2  GLN 135           HG2      GLN 135  10.399 -29.106   6.764
 1133    HG3  GLN 135           HG3      GLN 135  10.095 -29.743   5.148
 1134   HE21  GLN 135          HE21      GLN 135   8.224 -29.206   4.094
 1135   HE22  GLN 135          HE22      GLN 135   7.147 -27.969   4.647
 1136    H    LYS 136           H        LYS 136   6.998 -32.477   7.651
 1137    HA   LYS 136           HA       LYS 136   7.402 -34.377   9.725
 1138    HB2  LYS 136           HB2      LYS 136   5.845 -35.788   8.460
 1139    HB3  LYS 136           HB3      LYS 136   5.246 -34.144   8.585
 1140    HG2  LYS 136           HG2      LYS 136   5.954 -33.694   6.298
 1141    HG3  LYS 136           HG3      LYS 136   6.605 -35.328   6.171
 1142    HD2  LYS 136           HD2      LYS 136   4.365 -36.243   6.540
 1143    HD3  LYS 136           HD3      LYS 136   3.720 -34.605   6.658
 1144    HE2  LYS 136           HE2      LYS 136   4.409 -34.162   4.354
 1145    HE3  LYS 136           HE3      LYS 136   5.077 -35.790   4.238
 1146    HZ1  LYS 136           HZ1      LYS 136   2.890 -35.671   3.240
 1147    HZ2  LYS 136           HZ2      LYS 136   2.222 -35.118   4.688
 1148    HZ3  LYS 136           HZ3      LYS 136   2.858 -36.683   4.595
 1149    H    LYS 137           H        LYS 137   7.549 -36.874   8.650
 1150    HA   LYS 137           HA       LYS 137  10.310 -37.034   7.909
 1151    HB2  LYS 137           HB2      LYS 137   9.923 -39.470   7.821
 1152    HB3  LYS 137           HB3      LYS 137   9.295 -38.768   9.303
 1153    HG2  LYS 137           HG2      LYS 137   7.296 -39.651   8.888
 1154    HG3  LYS 137           HG3      LYS 137   7.210 -38.757   7.364
 1155    HD2  LYS 137           HD2      LYS 137   8.964 -40.917   6.924
 1156    HD3  LYS 137           HD3      LYS 137   7.576 -41.572   7.792
 1157    HE2  LYS 137           HE2      LYS 137   7.295 -39.772   5.385
 1158    HE3  LYS 137           HE3      LYS 137   7.421 -41.535   5.254
 1159    HZ1  LYS 137           HZ1      LYS 137   5.128 -40.893   5.253
 1160    HZ2  LYS 137           HZ2      LYS 137   5.311 -40.018   6.686
 1161    HZ3  LYS 137           HZ3      LYS 137   5.454 -41.701   6.701
 1162    H    LEU 138           H        LEU 138  10.201 -35.740   5.934
 1163    HA   LEU 138           HA       LEU 138   9.773 -37.532   3.693
 1164    HB2  LEU 138           HB2      LEU 138   7.721 -36.056   4.183
 1165    HB3  LEU 138           HB3      LEU 138   8.682 -34.742   3.505
 1166    HG   LEU 138           HG       LEU 138   8.876 -36.056   1.392
 1167   HD11  LEU 138          HD11      LEU 138   7.206 -37.942   1.155
 1168   HD12  LEU 138          HD12      LEU 138   7.081 -37.932   2.920
 1169   HD13  LEU 138          HD13      LEU 138   8.625 -38.288   2.143
 1170   HD21  LEU 138          HD21      LEU 138   6.073 -35.508   2.361
 1171   HD22  LEU 138          HD22      LEU 138   6.557 -35.697   0.675
 1172   HD23  LEU 138          HD23      LEU 138   7.170 -34.339   1.621
 1173    H    ALA 139           H        ALA 139  10.764 -36.609   1.664
 1174    HA   ALA 139           HA       ALA 139  13.341 -35.572   2.110
 1175    HB1  ALA 139           HB1      ALA 139  12.657 -36.864   0.096
 1176    HB2  ALA 139           HB2      ALA 139  13.501 -35.365  -0.285
 1177    HB3  ALA 139           HB3      ALA 139  11.748 -35.455  -0.453
 1178    H    SER 140           H        SER 140  14.146 -33.501   2.003
 1179    HA   SER 140           HA       SER 140  12.601 -31.318   2.708
 1180    HB2  SER 140           HB2      SER 140  15.172 -31.216   1.110
 1181    HB3  SER 140           HB3      SER 140  14.540 -29.967   2.183
 1182    HG   SER 140           HG       SER 140  15.997 -31.041   3.401
 1183    H    SER 141           H        SER 141  11.358 -29.872   1.597
 1184    HA   SER 141           HA       SER 141  11.343 -29.818  -1.281
 1185    HB2  SER 141           HB2      SER 141  10.153 -31.930  -0.881
 1186    HB3  SER 141           HB3      SER 141   9.053 -31.114   0.227
 1187    HG   SER 141           HG       SER 141   8.596 -29.716  -1.702
  Start of MODEL   13
    1    H1   ASP   1           HT1      ASP   1 -33.897  12.703  -9.714
    2    H2   ASP   1           HT2      ASP   1 -33.305  13.294  -8.244
    3    H3   ASP   1           HT3      ASP   1 -34.314  11.940  -8.263
    4    HA   ASP   1           HA       ASP   1 -32.663  10.661  -9.421
    5    HB2  ASP   1           HB2      ASP   1 -31.105  13.242  -9.273
    6    HB3  ASP   1           HB3      ASP   1 -30.353  11.683  -9.603
    7    HA   PRO   2           HA       PRO   2 -31.632   9.875  -5.120
    8    HB2  PRO   2           HB2      PRO   2 -30.747   7.258  -6.041
    9    HB3  PRO   2           HB3      PRO   2 -32.114   7.661  -5.003
   10    HG2  PRO   2           HG2      PRO   2 -32.406   6.713  -7.527
   11    HG3  PRO   2           HG3      PRO   2 -33.577   7.801  -6.759
   12    HD2  PRO   2           HD2      PRO   2 -31.424   8.426  -8.748
   13    HD3  PRO   2           HD3      PRO   2 -33.090   9.041  -8.651
   14    H    SER   3           H        SER   3 -29.614   9.607  -7.910
   15    HA   SER   3           HA       SER   3 -27.240   8.806  -6.483
   16    HB2  SER   3           HB2      SER   3 -26.233   9.064  -8.816
   17    HB3  SER   3           HB3      SER   3 -27.507   7.859  -8.632
   18    HG   SER   3           HG       SER   3 -27.538  10.299  -9.985
   19    H    ARG   4           H        ARG   4 -28.145  11.242  -5.477
   20    HA   ARG   4           HA       ARG   4 -26.263  13.207  -6.576
   21    HB2  ARG   4           HB2      ARG   4 -28.522  13.524  -4.592
   22    HB3  ARG   4           HB3      ARG   4 -27.421  14.817  -5.039
   23    HG2  ARG   4           HG2      ARG   4 -28.154  14.484  -7.418
   24    HG3  ARG   4           HG3      ARG   4 -29.401  13.403  -6.801
   25    HD2  ARG   4           HD2      ARG   4 -29.053  16.295  -6.035
   26    HD3  ARG   4           HD3      ARG   4 -30.242  15.679  -7.177
   27    HE   ARG   4           HE       ARG   4 -30.570  14.322  -4.754
   28   HH11  ARG   4          HH11      ARG   4 -30.912  17.561  -6.031
   29   HH12  ARG   4          HH12      ARG   4 -32.216  17.981  -4.971
   30   HH21  ARG   4          HH21      ARG   4 -32.290  14.875  -3.349
   31   HH22  ARG   4          HH22      ARG   4 -32.997  16.455  -3.446
   32    H    ARG   5           H        ARG   5 -25.796  14.703  -4.272
   33    HA   ARG   5           HA       ARG   5 -23.504  13.744  -3.235
   34    HB2  ARG   5           HB2      ARG   5 -24.208  15.993  -2.789
   35    HB3  ARG   5           HB3      ARG   5 -25.586  15.436  -1.853
   36    HG2  ARG   5           HG2      ARG   5 -23.805  16.300  -0.426
   37    HG3  ARG   5           HG3      ARG   5 -24.106  14.588  -0.127
   38    HD2  ARG   5           HD2      ARG   5 -21.708  15.106  -0.174
   39    HD3  ARG   5           HD3      ARG   5 -22.167  13.985  -1.454
   40    HE   ARG   5           HE       ARG   5 -22.199  16.703  -2.333
   41   HH11  ARG   5          HH11      ARG   5 -20.061  13.996  -1.679
   42   HH12  ARG   5          HH12      ARG   5 -18.873  14.503  -2.838
   43   HH21  ARG   5          HH21      ARG   5 -20.647  17.368  -3.838
   44   HH22  ARG   5          HH22      ARG   5 -19.197  16.437  -4.052
   45    H    ALA   6           H        ALA   6 -23.122  11.797  -2.466
   46    HA   ALA   6           HA       ALA   6 -24.959  10.206  -1.042
   47    HB1  ALA   6           HB1      ALA   6 -23.164   9.186  -2.303
   48    HB2  ALA   6           HB2      ALA   6 -23.029   8.730  -0.601
   49    HB3  ALA   6           HB3      ALA   6 -21.960   9.964  -1.274
   50    HA   PRO   7           HA       PRO   7 -24.867  11.850   3.055
   51    HB2  PRO   7           HB2      PRO   7 -25.028   9.316   4.269
   52    HB3  PRO   7           HB3      PRO   7 -26.372  10.390   3.886
   53    HG2  PRO   7           HG2      PRO   7 -25.341   8.028   2.418
   54    HG3  PRO   7           HG3      PRO   7 -26.993   8.665   2.513
   55    HD2  PRO   7           HD2      PRO   7 -25.486   8.960   0.318
   56    HD3  PRO   7           HD3      PRO   7 -26.624  10.218   0.843
   57    H    THR   8           H        THR   8 -23.397  12.210   4.616
   58    HA   THR   8           HA       THR   8 -20.773  11.187   4.513
   59    HB   THR   8           HB       THR   8 -22.177  12.455   6.877
   60    HG1  THR   8           HG1      THR   8 -21.067  13.519   4.513
   61   HG21  THR   8          HG21      THR   8 -20.027  11.427   7.433
   62   HG22  THR   8          HG22      THR   8 -19.927  13.186   7.518
   63   HG23  THR   8          HG23      THR   8 -19.251  12.331   6.131
   64    H    TRP   9           H        TRP   9 -19.904   9.380   5.393
   65    HA   TRP   9           HA       TRP   9 -21.496   7.230   6.085
   66    HB2  TRP   9           HB2      TRP   9 -18.575   7.764   6.579
   67    HB3  TRP   9           HB3      TRP   9 -19.340   6.242   7.025
   68    HD1  TRP   9           HD1      TRP   9 -18.167   8.226   4.003
   69    HE1  TRP   9           HE1      TRP   9 -18.283   6.718   1.923
   70    HE3  TRP   9           HE3      TRP   9 -20.604   4.225   6.039
   71    HZ2  TRP   9           HZ2      TRP   9 -19.272   4.162   1.241
   72    HZ3  TRP   9           HZ3      TRP   9 -21.098   2.286   4.605
   73    HH2  TRP   9           HH2      TRP   9 -20.445   2.259   2.254
   74    H    SER  10           H        SER  10 -22.630   6.776   7.770
   75    HA   SER  10           HA       SER  10 -22.205   8.242  10.258
   76    HB2  SER  10           HB2      SER  10 -24.521   6.458   9.476
   77    HB3  SER  10           HB3      SER  10 -24.490   7.688  10.742
   78    HG   SER  10           HG       SER  10 -23.782   8.745   8.352
   79    HA   PRO  11           HA       PRO  11 -20.521   5.120  12.837
   80    HB2  PRO  11           HB2      PRO  11 -23.182   4.890  14.188
   81    HB3  PRO  11           HB3      PRO  11 -21.568   5.014  14.902
   82    HG2  PRO  11           HG2      PRO  11 -23.150   7.142  14.798
   83    HG3  PRO  11           HG3      PRO  11 -21.415   7.293  14.479
   84    HD2  PRO  11           HD2      PRO  11 -23.699   7.397  12.585
   85    HD3  PRO  11           HD3      PRO  11 -22.117   8.195  12.495
   86    H    GLU  12           H        GLU  12 -23.936   4.180  12.324
   87    HA   GLU  12           HA       GLU  12 -23.360   1.398  12.427
   88    HB2  GLU  12           HB2      GLU  12 -25.560   2.401  13.011
   89    HB3  GLU  12           HB3      GLU  12 -25.806   2.792  11.319
   90    HG2  GLU  12           HG2      GLU  12 -27.037   0.811  11.908
   91    HG3  GLU  12           HG3      GLU  12 -25.761   0.415  10.761
   92    H    GLU  13           H        GLU  13 -23.451   3.760   9.908
   93    HA   GLU  13           HA       GLU  13 -23.823   1.968   7.724
   94    HB2  GLU  13           HB2      GLU  13 -24.287   4.495   7.853
   95    HB3  GLU  13           HB3      GLU  13 -22.568   4.700   7.562
   96    HG2  GLU  13           HG2      GLU  13 -22.706   3.898   5.398
   97    HG3  GLU  13           HG3      GLU  13 -24.217   3.036   5.707
   98    H    GLU  14           H        GLU  14 -20.999   3.552   9.189
   99    HA   GLU  14           HA       GLU  14 -19.067   2.405   7.459
  100    HB2  GLU  14           HB2      GLU  14 -18.774   3.337  10.323
  101    HB3  GLU  14           HB3      GLU  14 -17.440   2.960   9.241
  102    HG2  GLU  14           HG2      GLU  14 -18.208   4.760   7.735
  103    HG3  GLU  14           HG3      GLU  14 -19.451   5.173   8.917
  104    H    ALA  15           H        ALA  15 -20.570   1.326  10.459
  105    HA   ALA  15           HA       ALA  15 -18.912  -0.948  10.838
  106    HB1  ALA  15           HB1      ALA  15 -20.233   0.020  12.653
  107    HB2  ALA  15           HB2      ALA  15 -20.606  -1.688  12.421
  108    HB3  ALA  15           HB3      ALA  15 -21.718  -0.455  11.827
  109    H    HIS  16           H        HIS  16 -22.072  -0.492   9.338
  110    HA   HIS  16           HA       HIS  16 -22.560  -3.092   8.503
  111    HB2  HIS  16           HB2      HIS  16 -24.148  -1.103   8.446
  112    HB3  HIS  16           HB3      HIS  16 -23.337  -0.605   6.971
  113    HD1  HIS  16           HD1      HIS  16 -26.122  -1.005   6.456
  114    HD2  HIS  16           HD2      HIS  16 -23.560  -4.272   6.585
  115    HE1  HIS  16           HE1      HIS  16 -27.295  -2.846   5.210
  116    HE2  HIS  16           HE2      HIS  16 -25.812  -4.856   5.474
  117    H    LEU  17           H        LEU  17 -20.497  -0.600   7.199
  118    HA   LEU  17           HA       LEU  17 -20.030  -1.702   4.657
  119    HB2  LEU  17           HB2      LEU  17 -19.392   0.605   5.508
  120    HB3  LEU  17           HB3      LEU  17 -18.023  -0.162   6.291
  121    HG   LEU  17           HG       LEU  17 -17.190  -0.907   4.101
  122   HD11  LEU  17          HD11      LEU  17 -19.614   0.557   3.092
  123   HD12  LEU  17          HD12      LEU  17 -19.194  -1.138   2.846
  124   HD13  LEU  17          HD13      LEU  17 -18.239   0.130   2.079
  125   HD21  LEU  17          HD21      LEU  17 -16.418   1.206   5.023
  126   HD22  LEU  17          HD22      LEU  17 -17.772   2.044   4.262
  127   HD23  LEU  17          HD23      LEU  17 -16.530   1.287   3.265
  128    H    ARG  18           H        ARG  18 -18.170  -2.021   7.693
  129    HA   ARG  18           HA       ARG  18 -16.466  -4.050   6.653
  130    HB2  ARG  18           HB2      ARG  18 -15.676  -4.348   8.912
  131    HB3  ARG  18           HB3      ARG  18 -15.881  -2.625   8.635
  132    HG2  ARG  18           HG2      ARG  18 -17.995  -2.674   9.838
  133    HG3  ARG  18           HG3      ARG  18 -17.809  -4.407  10.098
  134    HD2  ARG  18           HD2      ARG  18 -15.749  -3.972  11.373
  135    HD3  ARG  18           HD3      ARG  18 -15.995  -2.240  11.146
  136    HE   ARG  18           HE       ARG  18 -18.250  -3.577  12.332
  137   HH11  ARG  18          HH11      ARG  18 -15.159  -2.073  13.013
  138   HH12  ARG  18          HH12      ARG  18 -15.581  -1.649  14.641
  139   HH21  ARG  18          HH21      ARG  18 -18.809  -3.013  14.478
  140   HH22  ARG  18          HH22      ARG  18 -17.655  -2.181  15.474
  141    H    GLU  19           H        GLU  19 -19.524  -3.945   8.342
  142    HA   GLU  19           HA       GLU  19 -19.878  -6.478   9.249
  143    HB2  GLU  19           HB2      GLU  19 -21.494  -4.655   9.537
  144    HB3  GLU  19           HB3      GLU  19 -21.948  -4.804   7.847
  145    HG2  GLU  19           HG2      GLU  19 -23.565  -5.875   9.314
  146    HG3  GLU  19           HG3      GLU  19 -22.788  -7.036   8.240
  147    H    LEU  20           H        LEU  20 -20.628  -5.268   6.038
  148    HA   LEU  20           HA       LEU  20 -21.514  -7.734   4.971
  149    HB2  LEU  20           HB2      LEU  20 -21.320  -5.006   4.185
  150    HB3  LEU  20           HB3      LEU  20 -20.617  -5.989   2.919
  151    HG   LEU  20           HG       LEU  20 -23.312  -6.673   4.029
  152   HD11  LEU  20          HD11      LEU  20 -22.760  -4.714   1.803
  153   HD12  LEU  20          HD12      LEU  20 -23.370  -4.296   3.402
  154   HD13  LEU  20          HD13      LEU  20 -24.342  -5.293   2.322
  155   HD21  LEU  20          HD21      LEU  20 -21.966  -7.080   1.361
  156   HD22  LEU  20          HD22      LEU  20 -23.587  -7.628   1.790
  157   HD23  LEU  20          HD23      LEU  20 -22.180  -8.298   2.618
  158    H    TYR  21           H        TYR  21 -18.403  -6.089   5.022
  159    HA   TYR  21           HA       TYR  21 -17.133  -7.745   3.092
  160    HB2  TYR  21           HB2      TYR  21 -16.185  -5.569   3.647
  161    HB3  TYR  21           HB3      TYR  21 -15.975  -6.056   5.325
  162    HD1  TYR  21           HD1      TYR  21 -14.804  -6.715   1.868
  163    HD2  TYR  21           HD2      TYR  21 -14.049  -7.217   6.020
  164    HE1  TYR  21           HE1      TYR  21 -12.550  -7.552   1.351
  165    HE2  TYR  21           HE2      TYR  21 -11.796  -8.059   5.519
  166    HH   TYR  21           HH       TYR  21 -10.344  -7.730   2.497
  167    H    LEU  22           H        LEU  22 -17.104  -7.667   6.618
  168    HA   LEU  22           HA       LEU  22 -15.344  -9.789   7.043
  169    HB2  LEU  22           HB2      LEU  22 -17.631  -8.958   8.825
  170    HB3  LEU  22           HB3      LEU  22 -16.176  -9.799   9.308
  171    HG   LEU  22           HG       LEU  22 -16.242  -6.982   8.236
  172   HD11  LEU  22          HD11      LEU  22 -17.340  -7.096  10.393
  173   HD12  LEU  22          HD12      LEU  22 -15.782  -6.286  10.528
  174   HD13  LEU  22          HD13      LEU  22 -15.958  -7.954  11.072
  175   HD21  LEU  22          HD21      LEU  22 -14.004  -8.529   9.530
  176   HD22  LEU  22          HD22      LEU  22 -13.945  -6.850   8.986
  177   HD23  LEU  22          HD23      LEU  22 -14.138  -8.152   7.814
  178    H    ALA  23           H        ALA  23 -18.704  -9.793   6.182
  179    HA   ALA  23           HA       ALA  23 -19.137 -12.531   7.000
  180    HB1  ALA  23           HB1      ALA  23 -20.899 -10.716   5.358
  181    HB2  ALA  23           HB2      ALA  23 -20.953 -10.885   7.113
  182    HB3  ALA  23           HB3      ALA  23 -21.369 -12.255   6.082
  183    H    ASN  24           H        ASN  24 -19.055 -10.825   3.846
  184    HA   ASN  24           HA       ASN  24 -19.283 -13.379   2.488
  185    HB2  ASN  24           HB2      ASN  24 -19.227 -10.556   1.415
  186    HB3  ASN  24           HB3      ASN  24 -19.503 -11.998   0.448
  187   HD21  ASN  24          HD21      ASN  24 -20.827  -9.846   2.837
  188   HD22  ASN  24          HD22      ASN  24 -22.462 -10.400   2.713
  189    H    LYS  25           H        LYS  25 -16.706 -11.965   3.772
  190    HA   LYS  25           HA       LYS  25 -14.897 -11.749   1.591
  191    HB2  LYS  25           HB2      LYS  25 -13.128 -11.716   3.303
  192    HB3  LYS  25           HB3      LYS  25 -14.436 -10.603   3.679
  193    HG2  LYS  25           HG2      LYS  25 -15.315 -12.107   5.335
  194    HG3  LYS  25           HG3      LYS  25 -14.145 -13.350   4.879
  195    HD2  LYS  25           HD2      LYS  25 -12.320 -11.857   5.583
  196    HD3  LYS  25           HD3      LYS  25 -13.509 -10.652   6.078
  197    HE2  LYS  25           HE2      LYS  25 -12.704 -11.943   7.988
  198    HE3  LYS  25           HE3      LYS  25 -14.425 -12.211   7.714
  199    HZ1  LYS  25           HZ1      LYS  25 -13.940 -14.312   6.677
  200    HZ2  LYS  25           HZ2      LYS  25 -13.185 -14.265   8.193
  201    HZ3  LYS  25           HZ3      LYS  25 -12.272 -14.035   6.791
  202    H    ASP  26           H        ASP  26 -16.165 -14.450   3.239
  203    HA   ASP  26           HA       ASP  26 -13.856 -16.128   2.615
  204    HB2  ASP  26           HB2      ASP  26 -16.338 -16.635   4.256
  205    HB3  ASP  26           HB3      ASP  26 -15.160 -17.891   3.883
  206    H    VAL  27           H        VAL  27 -16.332 -15.063   0.909
  207    HA   VAL  27           HA       VAL  27 -17.185 -17.581  -0.254
  208    HB   VAL  27           HB       VAL  27 -17.911 -14.777  -1.119
  209   HG11  VAL  27          HG11      VAL  27 -19.231 -17.434  -1.682
  210   HG12  VAL  27          HG12      VAL  27 -18.274 -16.492  -2.827
  211   HG13  VAL  27          HG13      VAL  27 -19.804 -15.855  -2.224
  212   HG21  VAL  27          HG21      VAL  27 -19.997 -15.106   0.131
  213   HG22  VAL  27          HG22      VAL  27 -18.590 -15.141   1.193
  214   HG23  VAL  27          HG23      VAL  27 -19.386 -16.646   0.735
  215    H    GLU  28           H        GLU  28 -16.121 -18.489  -1.871
  216    HA   GLU  28           HA       GLU  28 -13.929 -16.991  -3.064
  217    HB2  GLU  28           HB2      GLU  28 -14.582 -19.935  -3.140
  218    HB3  GLU  28           HB3      GLU  28 -13.131 -19.195  -3.805
  219    HG2  GLU  28           HG2      GLU  28 -12.477 -18.453  -1.578
  220    HG3  GLU  28           HG3      GLU  28 -13.936 -19.177  -0.901
  221    H    GLY  29           H        GLY  29 -13.699 -16.546  -5.183
  222    HA2  GLY  29           HA2      GLY  29 -14.136 -16.588  -7.475
  223    HA3  GLY  29           HA3      GLY  29 -15.441 -17.730  -7.181
  224    H    GLN  30           H        GLN  30 -15.554 -15.140  -5.095
  225    HA   GLN  30           HA       GLN  30 -17.638 -13.850  -6.712
  226    HB2  GLN  30           HB2      GLN  30 -18.851 -14.914  -5.043
  227    HB3  GLN  30           HB3      GLN  30 -17.578 -14.725  -3.852
  228    HG2  GLN  30           HG2      GLN  30 -18.890 -12.248  -4.793
  229    HG3  GLN  30           HG3      GLN  30 -19.853 -13.340  -3.798
  230   HE21  GLN  30          HE21      GLN  30 -19.891 -11.765  -2.137
  231   HE22  GLN  30          HE22      GLN  30 -18.506 -11.480  -1.150
  232    H    ASP  31           H        ASP  31 -17.804 -11.610  -6.592
  233    HA   ASP  31           HA       ASP  31 -15.471 -10.172  -5.689
  234    HB2  ASP  31           HB2      ASP  31 -18.086  -9.262  -6.892
  235    HB3  ASP  31           HB3      ASP  31 -16.797  -8.155  -6.434
  236    H    VAL  32           H        VAL  32 -15.303 -10.043  -3.508
  237    HA   VAL  32           HA       VAL  32 -17.481  -9.886  -1.734
  238    HB   VAL  32           HB       VAL  32 -15.090 -10.473  -1.107
  239   HG11  VAL  32          HG11      VAL  32 -13.637  -8.615  -0.396
  240   HG12  VAL  32          HG12      VAL  32 -14.785  -7.475  -1.103
  241   HG13  VAL  32          HG13      VAL  32 -13.927  -8.618  -2.135
  242   HG21  VAL  32          HG21      VAL  32 -16.794 -10.183   0.582
  243   HG22  VAL  32          HG22      VAL  32 -16.550  -8.435   0.567
  244   HG23  VAL  32          HG23      VAL  32 -15.268  -9.500   1.149
  245    H    VAL  33           H        VAL  33 -15.662  -7.512  -3.492
  246    HA   VAL  33           HA       VAL  33 -16.537  -5.147  -2.323
  247    HB   VAL  33           HB       VAL  33 -16.282  -5.322  -5.288
  248   HG11  VAL  33          HG11      VAL  33 -15.082  -3.226  -5.006
  249   HG12  VAL  33          HG12      VAL  33 -15.220  -3.378  -3.254
  250   HG13  VAL  33          HG13      VAL  33 -16.671  -3.170  -4.239
  251   HG21  VAL  33          HG21      VAL  33 -14.049  -5.824  -3.350
  252   HG22  VAL  33          HG22      VAL  33 -13.767  -5.216  -4.980
  253   HG23  VAL  33          HG23      VAL  33 -14.534  -6.788  -4.745
  254    H    GLU  34           H        GLU  34 -17.817  -6.829  -5.175
  255    HA   GLU  34           HA       GLU  34 -20.007  -5.210  -5.684
  256    HB2  GLU  34           HB2      GLU  34 -18.975  -7.206  -7.015
  257    HB3  GLU  34           HB3      GLU  34 -20.112  -8.183  -6.100
  258    HG2  GLU  34           HG2      GLU  34 -20.906  -5.853  -7.830
  259    HG3  GLU  34           HG3      GLU  34 -20.880  -7.529  -8.372
  260    H    ALA  35           H        ALA  35 -19.658  -7.978  -3.545
  261    HA   ALA  35           HA       ALA  35 -22.330  -8.266  -2.752
  262    HB1  ALA  35           HB1      ALA  35 -20.569  -9.886  -2.211
  263    HB2  ALA  35           HB2      ALA  35 -21.452  -9.382  -0.771
  264    HB3  ALA  35           HB3      ALA  35 -19.847  -8.725  -1.099
  265    H    ILE  36           H        ILE  36 -19.710  -6.350  -1.314
  266    HA   ILE  36           HA       ILE  36 -21.276  -5.259   0.766
  267    HB   ILE  36           HB       ILE  36 -18.803  -4.053  -0.469
  268   HG12  ILE  36          HG12      ILE  36 -18.950  -5.907   1.907
  269   HG13  ILE  36          HG13      ILE  36 -18.639  -6.486   0.274
  270   HG21  ILE  36          HG21      ILE  36 -18.513  -3.053   1.762
  271   HG22  ILE  36          HG22      ILE  36 -20.048  -3.760   2.266
  272   HG23  ILE  36          HG23      ILE  36 -20.015  -2.534   0.999
  273   HD11  ILE  36          HD11      ILE  36 -16.586  -6.247   1.481
  274   HD12  ILE  36          HD12      ILE  36 -16.959  -4.567   1.856
  275   HD13  ILE  36          HD13      ILE  36 -16.649  -5.052   0.190
  276    H    LEU  37           H        LEU  37 -20.152  -3.831  -2.307
  277    HA   LEU  37           HA       LEU  37 -21.207  -1.288  -2.058
  278    HB2  LEU  37           HB2      LEU  37 -21.361  -2.754  -4.668
  279    HB3  LEU  37           HB3      LEU  37 -21.082  -1.058  -4.403
  280    HG   LEU  37           HG       LEU  37 -19.059  -3.140  -3.610
  281   HD11  LEU  37          HD11      LEU  37 -17.930  -2.595  -5.743
  282   HD12  LEU  37          HD12      LEU  37 -19.367  -1.693  -6.230
  283   HD13  LEU  37          HD13      LEU  37 -19.467  -3.430  -5.972
  284   HD21  LEU  37          HD21      LEU  37 -18.856  -0.904  -2.636
  285   HD22  LEU  37          HD22      LEU  37 -18.839  -0.208  -4.256
  286   HD23  LEU  37          HD23      LEU  37 -17.528  -1.269  -3.737
  287    H    ALA  38           H        ALA  38 -22.837  -4.218  -3.117
  288    HA   ALA  38           HA       ALA  38 -25.185  -2.745  -3.973
  289    HB1  ALA  38           HB1      ALA  38 -24.257  -4.554  -5.340
  290    HB2  ALA  38           HB2      ALA  38 -25.942  -4.830  -4.896
  291    HB3  ALA  38           HB3      ALA  38 -24.654  -5.699  -4.060
  292    H    HIS  39           H        HIS  39 -24.299  -4.913  -1.324
  293    HA   HIS  39           HA       HIS  39 -27.060  -5.435  -0.682
  294    HB2  HIS  39           HB2      HIS  39 -24.466  -6.226   0.580
  295    HB3  HIS  39           HB3      HIS  39 -25.979  -6.455   1.450
  296    HD1  HIS  39           HD1      HIS  39 -27.366  -8.481   0.822
  297    HD2  HIS  39           HD2      HIS  39 -24.246  -7.763  -1.827
  298    HE1  HIS  39           HE1      HIS  39 -27.275 -10.492  -0.683
  299    HE2  HIS  39           HE2      HIS  39 -25.260 -10.119  -2.134
  300    H    LEU  40           H        LEU  40 -24.919  -2.893   0.053
  301    HA   LEU  40           HA       LEU  40 -26.876  -2.038   2.066
  302    HB2  LEU  40           HB2      LEU  40 -25.018  -0.278   2.633
  303    HB3  LEU  40           HB3      LEU  40 -25.005  -1.877   3.336
  304    HG   LEU  40           HG       LEU  40 -23.342  -2.516   1.523
  305   HD11  LEU  40          HD11      LEU  40 -22.019  -0.654   0.587
  306   HD12  LEU  40          HD12      LEU  40 -23.240   0.475   1.179
  307   HD13  LEU  40          HD13      LEU  40 -23.664  -0.724  -0.047
  308   HD21  LEU  40          HD21      LEU  40 -22.686  -2.173   3.819
  309   HD22  LEU  40          HD22      LEU  40 -22.608  -0.430   3.565
  310   HD23  LEU  40          HD23      LEU  40 -21.466  -1.492   2.741
  311    H    ASN  41           H        ASN  41 -28.299  -1.415   0.416
  312    HA   ASN  41           HA       ASN  41 -27.524   0.717  -1.377
  313    HB2  ASN  41           HB2      ASN  41 -30.080  -0.790  -0.890
  314    HB3  ASN  41           HB3      ASN  41 -30.060   0.656  -1.894
  315   HD21  ASN  41          HD21      ASN  41 -30.566  -2.211  -2.500
  316   HD22  ASN  41          HD22      ASN  41 -29.484  -2.590  -3.794
  317    H    THR  42           H        THR  42 -27.155   1.311   1.294
  318    HA   THR  42           HA       THR  42 -29.222   3.245   1.996
  319    HB   THR  42           HB       THR  42 -28.396   1.870   3.827
  320    HG1  THR  42           HG1      THR  42 -27.048   4.174   4.548
  321   HG21  THR  42          HG21      THR  42 -26.191   1.315   2.912
  322   HG22  THR  42          HG22      THR  42 -26.067   1.918   4.562
  323   HG23  THR  42          HG23      THR  42 -25.654   2.966   3.207
  324    H    VAL  43           H        VAL  43 -26.427   3.003   0.206
  325    HA   VAL  43           HA       VAL  43 -26.033   5.904   0.215
  326    HB   VAL  43           HB       VAL  43 -23.558   5.498  -0.041
  327   HG11  VAL  43          HG11      VAL  43 -24.443   6.362   2.026
  328   HG12  VAL  43          HG12      VAL  43 -23.155   5.209   2.374
  329   HG13  VAL  43          HG13      VAL  43 -24.843   4.736   2.572
  330   HG21  VAL  43          HG21      VAL  43 -23.629   3.123  -0.594
  331   HG22  VAL  43          HG22      VAL  43 -24.272   2.762   1.007
  332   HG23  VAL  43          HG23      VAL  43 -22.638   3.405   0.838
  333    HA   PRO  44           HA       PRO  44 -25.945   5.039  -4.229
  334    HB2  PRO  44           HB2      PRO  44 -25.804   7.907  -4.583
  335    HB3  PRO  44           HB3      PRO  44 -27.127   6.816  -4.995
  336    HG2  PRO  44           HG2      PRO  44 -27.252   8.695  -3.005
  337    HG3  PRO  44           HG3      PRO  44 -28.226   7.215  -3.034
  338    HD2  PRO  44           HD2      PRO  44 -25.747   7.826  -1.483
  339    HD3  PRO  44           HD3      PRO  44 -27.183   6.899  -0.999
  340    H    ARG  45           H        ARG  45 -23.800   4.211  -4.113
  341    HA   ARG  45           HA       ARG  45 -21.705   6.214  -4.537
  342    HB2  ARG  45           HB2      ARG  45 -21.655   3.996  -2.499
  343    HB3  ARG  45           HB3      ARG  45 -20.198   4.816  -3.055
  344    HG2  ARG  45           HG2      ARG  45 -21.116   6.950  -2.305
  345    HG3  ARG  45           HG3      ARG  45 -22.562   6.128  -1.730
  346    HD2  ARG  45           HD2      ARG  45 -21.550   5.424   0.147
  347    HD3  ARG  45           HD3      ARG  45 -20.050   5.024  -0.694
  348    HE   ARG  45           HE       ARG  45 -19.388   7.301  -0.517
  349   HH11  ARG  45          HH11      ARG  45 -22.199   6.474   1.401
  350   HH12  ARG  45          HH12      ARG  45 -22.171   7.951   2.310
  351   HH21  ARG  45          HH21      ARG  45 -19.379   9.270   0.671
  352   HH22  ARG  45          HH22      ARG  45 -20.578   9.522   1.904
  353    H    THR  46           H        THR  46 -19.604   5.127  -5.153
  354    HA   THR  46           HA       THR  46 -20.237   3.063  -7.144
  355    HB   THR  46           HB       THR  46 -19.481   5.270  -8.042
  356    HG1  THR  46           HG1      THR  46 -19.060   3.583  -9.398
  357   HG21  THR  46          HG21      THR  46 -16.881   4.559  -6.676
  358   HG22  THR  46          HG22      THR  46 -17.933   5.914  -6.273
  359   HG23  THR  46          HG23      THR  46 -17.100   5.876  -7.829
  360    H    ARG  47           H        ARG  47 -17.762   2.195  -7.790
  361    HA   ARG  47           HA       ARG  47 -17.377   0.198  -5.844
  362    HB2  ARG  47           HB2      ARG  47 -15.318   0.907  -7.923
  363    HB3  ARG  47           HB3      ARG  47 -15.697  -0.673  -7.258
  364    HG2  ARG  47           HG2      ARG  47 -17.291   0.931  -9.238
  365    HG3  ARG  47           HG3      ARG  47 -16.521  -0.636  -9.473
  366    HD2  ARG  47           HD2      ARG  47 -18.067  -1.570  -7.760
  367    HD3  ARG  47           HD3      ARG  47 -18.901  -0.015  -7.727
  368    HE   ARG  47           HE       ARG  47 -18.648  -1.303 -10.323
  369   HH11  ARG  47          HH11      ARG  47 -20.675  -0.619  -7.545
  370   HH12  ARG  47          HH12      ARG  47 -22.134  -1.111  -8.330
  371   HH21  ARG  47          HH21      ARG  47 -20.568  -1.945 -11.362
  372   HH22  ARG  47          HH22      ARG  47 -22.076  -1.862 -10.509
  373    H    LYS  48           H        LYS  48 -15.418   2.976  -6.753
  374    HA   LYS  48           HA       LYS  48 -13.170   2.529  -5.203
  375    HB2  LYS  48           HB2      LYS  48 -13.367   4.209  -6.992
  376    HB3  LYS  48           HB3      LYS  48 -14.427   5.166  -5.969
  377    HG2  LYS  48           HG2      LYS  48 -12.508   5.275  -4.323
  378    HG3  LYS  48           HG3      LYS  48 -11.499   4.622  -5.612
  379    HD2  LYS  48           HD2      LYS  48 -11.289   7.006  -5.653
  380    HD3  LYS  48           HD3      LYS  48 -12.245   6.522  -7.055
  381    HE2  LYS  48           HE2      LYS  48 -14.305   7.064  -5.803
  382    HE3  LYS  48           HE3      LYS  48 -13.311   7.604  -4.450
  383    HZ1  LYS  48           HZ1      LYS  48 -12.361   9.311  -5.876
  384    HZ2  LYS  48           HZ2      LYS  48 -14.043   9.457  -5.810
  385    HZ3  LYS  48           HZ3      LYS  48 -13.310   8.787  -7.175
  386    H    GLN  49           H        GLN  49 -16.202   4.075  -4.337
  387    HA   GLN  49           HA       GLN  49 -15.455   5.384  -2.005
  388    HB2  GLN  49           HB2      GLN  49 -17.967   4.463  -3.214
  389    HB3  GLN  49           HB3      GLN  49 -18.024   4.639  -1.469
  390    HG2  GLN  49           HG2      GLN  49 -18.789   6.658  -2.411
  391    HG3  GLN  49           HG3      GLN  49 -17.191   6.966  -1.752
  392   HE21  GLN  49          HE21      GLN  49 -18.728   8.376  -3.782
  393   HE22  GLN  49          HE22      GLN  49 -17.722   8.429  -5.188
  394    H    ILE  50           H        ILE  50 -17.130   2.255  -2.210
  395    HA   ILE  50           HA       ILE  50 -17.026   1.714   0.533
  396    HB   ILE  50           HB       ILE  50 -17.481   0.035  -1.892
  397   HG12  ILE  50          HG12      ILE  50 -19.641  -0.391  -0.456
  398   HG13  ILE  50          HG13      ILE  50 -19.113   1.046   0.407
  399   HG21  ILE  50          HG21      ILE  50 -17.957  -1.920  -0.446
  400   HG22  ILE  50          HG22      ILE  50 -17.220  -1.053   0.899
  401   HG23  ILE  50          HG23      ILE  50 -16.252  -1.479  -0.510
  402   HD11  ILE  50          HD11      ILE  50 -19.849   0.819  -2.504
  403   HD12  ILE  50          HD12      ILE  50 -19.114   2.262  -1.779
  404   HD13  ILE  50          HD13      ILE  50 -20.698   1.707  -1.233
  405    H    ILE  51           H        ILE  51 -14.939   0.639  -2.110
  406    HA   ILE  51           HA       ILE  51 -13.274  -1.123  -0.763
  407    HB   ILE  51           HB       ILE  51 -12.593   0.776  -3.005
  408   HG12  ILE  51          HG12      ILE  51 -13.192  -2.177  -3.130
  409   HG13  ILE  51          HG13      ILE  51 -14.421  -0.934  -3.354
  410   HG21  ILE  51          HG21      ILE  51 -10.682  -0.696  -3.476
  411   HG22  ILE  51          HG22      ILE  51 -11.037  -1.615  -2.014
  412   HG23  ILE  51          HG23      ILE  51 -10.543   0.076  -1.895
  413   HD11  ILE  51          HD11      ILE  51 -13.261  -0.089  -5.286
  414   HD12  ILE  51          HD12      ILE  51 -13.543  -1.822  -5.467
  415   HD13  ILE  51          HD13      ILE  51 -11.944  -1.229  -5.021
  416    H    HIS  52           H        HIS  52 -12.843   2.344  -1.275
  417    HA   HIS  52           HA       HIS  52 -10.322   2.531  -0.137
  418    HB2  HIS  52           HB2      HIS  52 -12.457   4.437  -0.854
  419    HB3  HIS  52           HB3      HIS  52 -11.268   5.009   0.315
  420    HD1  HIS  52           HD1      HIS  52  -9.724   6.445  -0.964
  421    HD2  HIS  52           HD2      HIS  52 -10.570   2.917  -3.016
  422    HE1  HIS  52           HE1      HIS  52  -8.242   6.463  -2.974
  423    HE2  HIS  52           HE2      HIS  52  -8.760   4.330  -4.210
  424    H    HIS  53           H        HIS  53 -13.499   2.860   1.443
  425    HA   HIS  53           HA       HIS  53 -12.336   3.722   3.914
  426    HB2  HIS  53           HB2      HIS  53 -15.077   2.534   3.484
  427    HB3  HIS  53           HB3      HIS  53 -14.551   3.484   4.868
  428    HD1  HIS  53           HD1      HIS  53 -13.296   5.894   3.620
  429    HD2  HIS  53           HD2      HIS  53 -16.757   4.129   2.140
  430    HE1  HIS  53           HE1      HIS  53 -14.348   7.624   2.126
  431    HE2  HIS  53           HE2      HIS  53 -16.379   6.505   1.169
  432    H    LEU  54           H        LEU  54 -12.851   0.669   2.451
  433    HA   LEU  54           HA       LEU  54 -12.833  -0.879   4.862
  434    HB2  LEU  54           HB2      LEU  54 -12.437  -1.596   1.964
  435    HB3  LEU  54           HB3      LEU  54 -12.335  -2.780   3.250
  436    HG   LEU  54           HG       LEU  54 -14.790  -1.109   2.721
  437   HD11  LEU  54          HD11      LEU  54 -14.258  -2.536   0.796
  438   HD12  LEU  54          HD12      LEU  54 -15.720  -3.064   1.628
  439   HD13  LEU  54          HD13      LEU  54 -14.208  -3.941   1.861
  440   HD21  LEU  54          HD21      LEU  54 -15.913  -2.737   4.134
  441   HD22  LEU  54          HD22      LEU  54 -14.561  -2.021   5.012
  442   HD23  LEU  54          HD23      LEU  54 -14.414  -3.642   4.334
  443    H    VAL  55           H        VAL  55 -10.477  -0.140   2.324
  444    HA   VAL  55           HA       VAL  55  -8.339  -1.499   3.652
  445    HB   VAL  55           HB       VAL  55  -6.907  -0.677   1.925
  446   HG11  VAL  55          HG11      VAL  55  -8.158  -1.329  -0.102
  447   HG12  VAL  55          HG12      VAL  55  -9.657  -1.256   0.827
  448   HG13  VAL  55          HG13      VAL  55  -8.415  -2.436   1.247
  449   HG21  VAL  55          HG21      VAL  55  -7.622   1.005   0.282
  450   HG22  VAL  55          HG22      VAL  55  -7.560   1.668   1.915
  451   HG23  VAL  55          HG23      VAL  55  -9.113   1.251   1.191
  452    H    GLN  56           H        GLN  56  -9.675   1.677   3.717
  453    HA   GLN  56           HA       GLN  56  -7.453   2.895   5.055
  454    HB2  GLN  56           HB2      GLN  56 -10.240   3.740   4.360
  455    HB3  GLN  56           HB3      GLN  56  -9.291   4.699   5.473
  456    HG2  GLN  56           HG2      GLN  56  -7.586   5.025   3.767
  457    HG3  GLN  56           HG3      GLN  56  -8.491   4.002   2.649
  458   HE21  GLN  56          HE21      GLN  56  -8.755   5.579   1.133
  459   HE22  GLN  56          HE22      GLN  56  -9.772   6.960   1.374
  460    H    MET  57           H        MET  57 -10.279   1.127   5.994
  461    HA   MET  57           HA       MET  57 -10.287   2.089   8.706
  462    HB2  MET  57           HB2      MET  57 -12.257   1.100   7.306
  463    HB3  MET  57           HB3      MET  57 -11.625  -0.449   7.842
  464    HG2  MET  57           HG2      MET  57 -11.879   0.274  10.175
  465    HG3  MET  57           HG3      MET  57 -12.562   1.797   9.613
  466    HE1  MET  57           HE1      MET  57 -14.208   0.410   6.992
  467    HE2  MET  57           HE2      MET  57 -14.737   1.806   7.933
  468    HE3  MET  57           HE3      MET  57 -15.806   0.417   7.737
  469    H    GLY  58           H        GLY  58  -8.397  -0.052   6.989
  470    HA2  GLY  58           HA2      GLY  58  -6.495  -1.124   7.814
  471    HA3  GLY  58           HA3      GLY  58  -7.121  -0.925   9.444
  472    H    LEU  59           H        LEU  59  -9.612  -2.128   7.698
  473    HA   LEU  59           HA       LEU  59  -9.147  -4.793   8.752
  474    HB2  LEU  59           HB2      LEU  59 -11.487  -5.234   8.104
  475    HB3  LEU  59           HB3      LEU  59 -11.310  -3.870   9.188
  476    HG   LEU  59           HG       LEU  59 -11.387  -2.453   6.997
  477   HD11  LEU  59          HD11      LEU  59 -12.695  -3.413   5.227
  478   HD12  LEU  59          HD12      LEU  59 -12.825  -4.940   6.101
  479   HD13  LEU  59          HD13      LEU  59 -11.259  -4.402   5.492
  480   HD21  LEU  59          HD21      LEU  59 -13.054  -2.364   8.752
  481   HD22  LEU  59          HD22      LEU  59 -13.811  -3.831   8.134
  482   HD23  LEU  59          HD23      LEU  59 -13.829  -2.354   7.170
  483    H    ALA  60           H        ALA  60  -8.972  -3.105   5.808
  484    HA   ALA  60           HA       ALA  60  -8.350  -5.635   4.423
  485    HB1  ALA  60           HB1      ALA  60  -8.949  -4.500   2.311
  486    HB2  ALA  60           HB2      ALA  60  -9.491  -3.104   3.241
  487    HB3  ALA  60           HB3      ALA  60 -10.317  -4.652   3.414
  488    H    ASP  61           H        ASP  61  -6.775  -5.181   2.530
  489    HA   ASP  61           HA       ASP  61  -4.551  -3.754   3.733
  490    HB2  ASP  61           HB2      ASP  61  -4.184  -6.021   2.829
  491    HB3  ASP  61           HB3      ASP  61  -4.587  -5.426   1.218
  492    H    SER  62           H        SER  62  -5.846  -3.875   0.387
  493    HA   SER  62           HA       SER  62  -5.661  -1.015   0.166
  494    HB2  SER  62           HB2      SER  62  -3.274  -1.820  -0.047
  495    HB3  SER  62           HB3      SER  62  -3.779  -2.658  -1.516
  496    HG   SER  62           HG       SER  62  -3.398   0.050  -1.045
  497    H    VAL  63           H        VAL  63  -5.892  -0.374  -2.211
  498    HA   VAL  63           HA       VAL  63  -8.313  -1.394  -3.230
  499    HB   VAL  63           HB       VAL  63  -6.201   0.363  -4.496
  500   HG11  VAL  63          HG11      VAL  63  -9.004  -0.192  -5.462
  501   HG12  VAL  63          HG12      VAL  63  -7.507  -0.694  -6.252
  502   HG13  VAL  63          HG13      VAL  63  -7.908   1.020  -6.127
  503   HG21  VAL  63          HG21      VAL  63  -8.840   1.031  -3.198
  504   HG22  VAL  63          HG22      VAL  63  -7.751   2.184  -3.974
  505   HG23  VAL  63          HG23      VAL  63  -7.238   1.326  -2.522
  506    H    LYS  64           H        LYS  64  -5.026  -2.235  -3.691
  507    HA   LYS  64           HA       LYS  64  -5.085  -3.415  -6.222
  508    HB2  LYS  64           HB2      LYS  64  -3.404  -4.137  -3.829
  509    HB3  LYS  64           HB3      LYS  64  -3.064  -4.599  -5.487
  510    HG2  LYS  64           HG2      LYS  64  -2.861  -2.211  -6.077
  511    HG3  LYS  64           HG3      LYS  64  -3.108  -1.802  -4.379
  512    HD2  LYS  64           HD2      LYS  64  -0.860  -3.497  -5.470
  513    HD3  LYS  64           HD3      LYS  64  -0.728  -1.806  -4.988
  514    HE2  LYS  64           HE2      LYS  64  -1.314  -2.401  -2.696
  515    HE3  LYS  64           HE3      LYS  64  -1.502  -4.087  -3.172
  516    HZ1  LYS  64           HZ1      LYS  64   0.632  -3.734  -2.142
  517    HZ2  LYS  64           HZ2      LYS  64   1.016  -2.525  -3.258
  518    HZ3  LYS  64           HZ3      LYS  64   0.849  -4.125  -3.774
  519    H    ASP  65           H        ASP  65  -6.268  -4.530  -3.183
  520    HA   ASP  65           HA       ASP  65  -6.402  -7.304  -4.034
  521    HB2  ASP  65           HB2      ASP  65  -5.772  -6.657  -1.709
  522    HB3  ASP  65           HB3      ASP  65  -7.391  -6.012  -1.483
  523    H    PHE  66           H        PHE  66  -8.226  -4.570  -4.465
  524    HA   PHE  66           HA       PHE  66 -10.780  -6.044  -4.520
  525    HB2  PHE  66           HB2      PHE  66 -10.215  -3.107  -4.105
  526    HB3  PHE  66           HB3      PHE  66 -11.823  -3.745  -4.412
  527    HD1  PHE  66           HD1      PHE  66  -8.948  -4.220  -2.087
  528    HD2  PHE  66           HD2      PHE  66 -13.165  -4.252  -2.625
  529    HE1  PHE  66           HE1      PHE  66  -9.248  -4.575   0.323
  530    HE2  PHE  66           HE2      PHE  66 -13.476  -4.619  -0.215
  531    HZ   PHE  66           HZ       PHE  66 -11.517  -4.772   1.271
  532    H    GLN  67           H        GLN  67  -8.848  -3.610  -6.242
  533    HA   GLN  67           HA       GLN  67 -10.614  -3.961  -8.562
  534    HB2  GLN  67           HB2      GLN  67  -9.112  -1.533  -7.611
  535    HB3  GLN  67           HB3      GLN  67  -9.827  -1.644  -9.221
  536    HG2  GLN  67           HG2      GLN  67 -11.321  -1.894  -6.627
  537    HG3  GLN  67           HG3      GLN  67 -11.209  -0.426  -7.588
  538   HE21  GLN  67          HE21      GLN  67 -12.654  -3.551  -7.275
  539   HE22  GLN  67          HE22      GLN  67 -13.839  -3.359  -8.519
  540    H    ARG  68           H        ARG  68  -7.398  -2.555  -8.223
  541    HA   ARG  68           HA       ARG  68  -6.446  -4.414 -10.297
  542    HB2  ARG  68           HB2      ARG  68  -5.328  -2.677 -11.493
  543    HB3  ARG  68           HB3      ARG  68  -6.985  -2.140 -11.255
  544    HG2  ARG  68           HG2      ARG  68  -6.385  -0.475  -9.798
  545    HG3  ARG  68           HG3      ARG  68  -4.925  -1.315  -9.268
  546    HD2  ARG  68           HD2      ARG  68  -3.927  -0.873 -11.492
  547    HD3  ARG  68           HD3      ARG  68  -5.353   0.067 -11.913
  548    HE   ARG  68           HE       ARG  68  -4.174   1.013  -9.510
  549   HH11  ARG  68          HH11      ARG  68  -3.818   1.048 -12.999
  550   HH12  ARG  68          HH12      ARG  68  -2.909   2.524 -13.017
  551   HH21  ARG  68          HH21      ARG  68  -2.961   2.964  -9.541
  552   HH22  ARG  68          HH22      ARG  68  -2.442   3.617 -11.065
  553    H    LYS  69           H        LYS  69  -4.247  -4.974 -10.188
  554    HA   LYS  69           HA       LYS  69  -3.013  -4.607  -7.613
  555    HB2  LYS  69           HB2      LYS  69  -2.163  -6.056 -10.106
  556    HB3  LYS  69           HB3      LYS  69  -1.074  -5.846  -8.744
  557    HG2  LYS  69           HG2      LYS  69  -2.092  -8.015  -8.616
  558    HG3  LYS  69           HG3      LYS  69  -2.706  -7.014  -7.302
  559    HD2  LYS  69           HD2      LYS  69  -4.736  -6.566  -8.645
  560    HD3  LYS  69           HD3      LYS  69  -4.120  -7.656  -9.888
  561    HE2  LYS  69           HE2      LYS  69  -5.748  -8.759  -8.421
  562    HE3  LYS  69           HE3      LYS  69  -4.154  -9.505  -8.329
  563    HZ1  LYS  69           HZ1      LYS  69  -5.243  -7.556  -6.368
  564    HZ2  LYS  69           HZ2      LYS  69  -3.740  -8.330  -6.278
  565    HZ3  LYS  69           HZ3      LYS  69  -5.161  -9.232  -6.143
  566    H    GLY  70           H        GLY  70  -3.187  -2.215  -8.088
  567    HA2  GLY  70           HA2      GLY  70  -0.522  -1.277  -8.701
  568    HA3  GLY  70           HA3      GLY  70  -1.780  -0.690  -9.786
  569    H    THR  71           H        THR  71  -0.061   0.620  -7.674
  570    HA   THR  71           HA       THR  71  -1.913   1.315  -5.584
  571    HB   THR  71           HB       THR  71  -0.014   2.950  -4.975
  572    HG1  THR  71           HG1      THR  71   2.010   1.857  -6.033
  573   HG21  THR  71          HG21      THR  71   0.545  -0.015  -5.050
  574   HG22  THR  71          HG22      THR  71  -0.364   0.848  -3.804
  575   HG23  THR  71          HG23      THR  71   1.357   1.168  -4.018
  576    H    HIS  72           H        HIS  72  -1.439   3.938  -5.124
  577    HA   HIS  72           HA       HIS  72  -3.015   5.323  -7.065
  578    HB2  HIS  72           HB2      HIS  72  -2.927   7.140  -5.574
  579    HB3  HIS  72           HB3      HIS  72  -2.692   5.774  -4.485
  580    HD1  HIS  72           HD1      HIS  72  -0.907   8.685  -5.995
  581    HD2  HIS  72           HD2      HIS  72  -0.084   5.515  -3.439
  582    HE1  HIS  72           HE1      HIS  72   1.440   9.055  -5.182
  583    HE2  HIS  72           HE2      HIS  72   1.949   7.059  -3.748
  584    H    ILE  73           H        ILE  73   0.030   4.250  -7.364
  585    HA   ILE  73           HA       ILE  73   2.015   5.754  -7.000
  586    HB   ILE  73           HB       ILE  73   1.495   4.054  -9.269
  587   HG12  ILE  73          HG12      ILE  73   2.757   3.496  -7.204
  588   HG13  ILE  73          HG13      ILE  73   3.663   3.176  -8.681
  589   HG21  ILE  73          HG21      ILE  73   2.147   5.729 -10.761
  590   HG22  ILE  73          HG22      ILE  73   3.624   4.805 -10.471
  591   HG23  ILE  73          HG23      ILE  73   3.372   6.350  -9.658
  592   HD11  ILE  73          HD11      ILE  73   4.006   5.580  -6.897
  593   HD12  ILE  73          HD12      ILE  73   4.929   5.232  -8.358
  594   HD13  ILE  73          HD13      ILE  73   5.067   4.173  -6.957
  595    H    VAL  74           H        VAL  74   2.606   7.638  -6.944
  596    HA   VAL  74           HA       VAL  74   1.550   9.867  -8.187
  597    HB   VAL  74           HB       VAL  74   2.878  10.323  -6.314
  598   HG11  VAL  74          HG11      VAL  74   4.078   8.240  -6.155
  599   HG12  VAL  74          HG12      VAL  74   5.226   9.576  -6.066
  600   HG13  VAL  74          HG13      VAL  74   5.059   8.656  -7.561
  601   HG21  VAL  74          HG21      VAL  74   4.755  11.706  -7.057
  602   HG22  VAL  74          HG22      VAL  74   3.328  11.961  -8.062
  603   HG23  VAL  74          HG23      VAL  74   4.663  10.972  -8.657
  604    H    LEU  75           H        LEU  75   2.091  11.000  -9.989
  605    HA   LEU  75           HA       LEU  75   2.597   9.667 -12.308
  606    HB2  LEU  75           HB2      LEU  75   3.208  12.035 -13.164
  607    HB3  LEU  75           HB3      LEU  75   1.596  11.724 -12.544
  608    HG   LEU  75           HG       LEU  75   2.959  12.542 -10.287
  609   HD11  LEU  75          HD11      LEU  75   4.108  14.602 -10.883
  610   HD12  LEU  75          HD12      LEU  75   3.845  14.282 -12.597
  611   HD13  LEU  75          HD13      LEU  75   4.887  13.219 -11.650
  612   HD21  LEU  75          HD21      LEU  75   0.693  13.176 -10.923
  613   HD22  LEU  75          HD22      LEU  75   1.321  14.207 -12.211
  614   HD23  LEU  75          HD23      LEU  75   1.649  14.603 -10.524
  615    H    TRP  76           H        TRP  76   4.361   8.338 -12.401
  616    HA   TRP  76           HA       TRP  76   7.004   9.585 -12.173
  617    HB2  TRP  76           HB2      TRP  76   6.101   6.712 -12.139
  618    HB3  TRP  76           HB3      TRP  76   7.785   7.138 -12.421
  619    HD1  TRP  76           HD1      TRP  76   5.337   6.569  -9.693
  620    HE1  TRP  76           HE1      TRP  76   6.399   7.086  -7.409
  621    HE3  TRP  76           HE3      TRP  76   9.551   8.915 -11.307
  622    HZ2  TRP  76           HZ2      TRP  76   8.721   8.338  -6.425
  623    HZ3  TRP  76           HZ3      TRP  76  11.145   9.747  -9.632
  624    HH2  TRP  76           HH2      TRP  76  10.734   9.467  -7.243
  625    H    THR  77           H        THR  77   7.676  10.454 -13.976
  626    HA   THR  77           HA       THR  77   7.129   9.120 -16.537
  627    HB   THR  77           HB       THR  77   7.533  11.298 -17.590
  628    HG1  THR  77           HG1      THR  77   8.133  13.063 -16.406
  629   HG21  THR  77          HG21      THR  77   5.246  10.823 -16.878
  630   HG22  THR  77          HG22      THR  77   5.603  12.540 -16.683
  631   HG23  THR  77          HG23      THR  77   5.597  11.476 -15.276
  632    H    GLY  78           H        GLY  78   9.017   9.912 -18.175
  633    HA2  GLY  78           HA2      GLY  78  11.379   8.605 -17.417
  634    HA3  GLY  78           HA3      GLY  78  11.223   9.706 -18.779
  635    H    ASP  79           H        ASP  79  10.529  12.031 -17.363
  636    HA   ASP  79           HA       ASP  79  13.139  12.812 -16.427
  637    HB2  ASP  79           HB2      ASP  79  12.176  15.080 -16.260
  638    HB3  ASP  79           HB3      ASP  79  11.901  14.357 -17.841
  639    H    GLN  80           H        GLN  80   9.902  12.460 -14.996
  640    HA   GLN  80           HA       GLN  80  10.501  13.446 -12.441
  641    HB2  GLN  80           HB2      GLN  80   8.295  12.291 -13.716
  642    HB3  GLN  80           HB3      GLN  80   8.635  11.213 -12.368
  643    HG2  GLN  80           HG2      GLN  80   8.533  14.144 -11.862
  644    HG3  GLN  80           HG3      GLN  80   7.024  13.276 -12.127
  645   HE21  GLN  80          HE21      GLN  80   7.715  10.843 -10.876
  646   HE22  GLN  80          HE22      GLN  80   7.854  11.140  -9.184
  647    H    GLU  81           H        GLU  81  11.031  10.339 -13.931
  648    HA   GLU  81           HA       GLU  81  11.854   8.875 -11.669
  649    HB2  GLU  81           HB2      GLU  81  11.330   8.092 -14.088
  650    HB3  GLU  81           HB3      GLU  81  13.007   8.496 -14.422
  651    HG2  GLU  81           HG2      GLU  81  13.074   6.234 -13.951
  652    HG3  GLU  81           HG3      GLU  81  13.554   6.978 -12.425
  653    H    LEU  82           H        LEU  82  13.717  10.650 -14.122
  654    HA   LEU  82           HA       LEU  82  16.263  10.176 -13.054
  655    HB2  LEU  82           HB2      LEU  82  15.924  11.002 -15.320
  656    HB3  LEU  82           HB3      LEU  82  15.273  12.507 -14.696
  657    HG   LEU  82           HG       LEU  82  17.531  12.859 -13.576
  658   HD11  LEU  82          HD11      LEU  82  18.307  10.665 -15.486
  659   HD12  LEU  82          HD12      LEU  82  18.369  10.597 -13.725
  660   HD13  LEU  82          HD13      LEU  82  19.429  11.701 -14.603
  661   HD21  LEU  82          HD21      LEU  82  16.835  14.132 -15.502
  662   HD22  LEU  82          HD22      LEU  82  17.346  12.834 -16.581
  663   HD23  LEU  82          HD23      LEU  82  18.545  13.721 -15.638
  664    H    GLU  83           H        GLU  83  13.949  12.783 -12.507
  665    HA   GLU  83           HA       GLU  83  15.551  14.442 -10.939
  666    HB2  GLU  83           HB2      GLU  83  12.566  13.990 -10.901
  667    HB3  GLU  83           HB3      GLU  83  13.366  15.263  -9.991
  668    HG2  GLU  83           HG2      GLU  83  13.574  14.969 -12.975
  669    HG3  GLU  83           HG3      GLU  83  12.370  15.972 -12.170
  670    H    LEU  84           H        LEU  84  13.799  11.522 -10.129
  671    HA   LEU  84           HA       LEU  84  14.189  11.746  -7.303
  672    HB2  LEU  84           HB2      LEU  84  12.414  10.376  -8.282
  673    HB3  LEU  84           HB3      LEU  84  13.604   9.348  -9.045
  674    HG   LEU  84           HG       LEU  84  12.429   8.472  -6.946
  675   HD11  LEU  84          HD11      LEU  84  14.458   7.367  -6.122
  676   HD12  LEU  84          HD12      LEU  84  15.432   8.471  -7.091
  677   HD13  LEU  84          HD13      LEU  84  14.331   7.340  -7.881
  678   HD21  LEU  84          HD21      LEU  84  14.401  10.309  -5.600
  679   HD22  LEU  84          HD22      LEU  84  13.373   9.115  -4.811
  680   HD23  LEU  84          HD23      LEU  84  12.650  10.513  -5.604
  681    H    GLN  85           H        GLN  85  15.866  10.072  -9.932
  682    HA   GLN  85           HA       GLN  85  17.685   8.628  -8.386
  683    HB2  GLN  85           HB2      GLN  85  17.232   8.230 -10.783
  684    HB3  GLN  85           HB3      GLN  85  18.077   9.718 -11.178
  685    HG2  GLN  85           HG2      GLN  85  19.531   7.659  -9.612
  686    HG3  GLN  85           HG3      GLN  85  19.245   7.356 -11.323
  687   HE21  GLN  85          HE21      GLN  85  20.219   8.697 -12.850
  688   HE22  GLN  85          HE22      GLN  85  21.557   9.712 -12.444
  689    H    ARG  86           H        ARG  86  18.223  11.747 -10.056
  690    HA   ARG  86           HA       ARG  86  20.824  12.193  -9.129
  691    HB2  ARG  86           HB2      ARG  86  18.770  14.358  -9.603
  692    HB3  ARG  86           HB3      ARG  86  20.516  14.498  -9.738
  693    HG2  ARG  86           HG2      ARG  86  20.452  12.937 -11.652
  694    HG3  ARG  86           HG3      ARG  86  18.692  12.928 -11.543
  695    HD2  ARG  86           HD2      ARG  86  19.334  14.503 -13.234
  696    HD3  ARG  86           HD3      ARG  86  18.716  15.392 -11.842
  697    HE   ARG  86           HE       ARG  86  21.603  15.052 -12.359
  698   HH11  ARG  86          HH11      ARG  86  18.861  17.067 -11.500
  699   HH12  ARG  86          HH12      ARG  86  19.824  18.481 -11.238
  700   HH21  ARG  86          HH21      ARG  86  22.870  16.920 -12.032
  701   HH22  ARG  86          HH22      ARG  86  22.111  18.400 -11.525
  702    H    LEU  87           H        LEU  87  17.743  13.256  -7.845
  703    HA   LEU  87           HA       LEU  87  18.450  14.689  -5.603
  704    HB2  LEU  87           HB2      LEU  87  16.210  14.189  -6.716
  705    HB3  LEU  87           HB3      LEU  87  16.197  12.705  -5.799
  706    HG   LEU  87           HG       LEU  87  16.149  14.035  -3.707
  707   HD11  LEU  87          HD11      LEU  87  15.594  16.424  -3.855
  708   HD12  LEU  87          HD12      LEU  87  15.825  16.365  -5.603
  709   HD13  LEU  87          HD13      LEU  87  17.196  16.096  -4.524
  710   HD21  LEU  87          HD21      LEU  87  14.126  13.170  -4.773
  711   HD22  LEU  87          HD22      LEU  87  14.004  14.644  -5.733
  712   HD23  LEU  87          HD23      LEU  87  13.825  14.715  -3.987
  713    H    PHE  88           H        PHE  88  17.720  11.227  -5.785
  714    HA   PHE  88           HA       PHE  88  18.300  10.504  -3.194
  715    HB2  PHE  88           HB2      PHE  88  17.057   9.016  -4.536
  716    HB3  PHE  88           HB3      PHE  88  18.297   8.978  -5.784
  717    HD1  PHE  88           HD1      PHE  88  17.657   8.014  -2.256
  718    HD2  PHE  88           HD2      PHE  88  19.855   7.279  -5.817
  719    HE1  PHE  88           HE1      PHE  88  18.618   5.999  -1.233
  720    HE2  PHE  88           HE2      PHE  88  20.805   5.253  -4.820
  721    HZ   PHE  88           HZ       PHE  88  20.198   4.610  -2.526
  722    H    GLU  89           H        GLU  89  20.451   9.882  -6.011
  723    HA   GLU  89           HA       GLU  89  22.435   8.715  -4.399
  724    HB2  GLU  89           HB2      GLU  89  22.727   9.956  -7.131
  725    HB3  GLU  89           HB3      GLU  89  23.896   8.895  -6.367
  726    HG2  GLU  89           HG2      GLU  89  22.075   7.151  -6.289
  727    HG3  GLU  89           HG3      GLU  89  21.141   8.225  -7.327
  728    H    GLU  90           H        GLU  90  21.950  12.023  -5.398
  729    HA   GLU  90           HA       GLU  90  24.649  12.778  -4.789
  730    HB2  GLU  90           HB2      GLU  90  22.244  14.104  -5.895
  731    HB3  GLU  90           HB3      GLU  90  23.507  15.130  -5.211
  732    HG2  GLU  90           HG2      GLU  90  23.900  13.065  -7.371
  733    HG3  GLU  90           HG3      GLU  90  23.753  14.804  -7.631
  734    H    PHE  91           H        PHE  91  21.700  12.639  -2.989
  735    HA   PHE  91           HA       PHE  91  23.001  14.275  -0.902
  736    HB2  PHE  91           HB2      PHE  91  20.066  13.990  -1.535
  737    HB3  PHE  91           HB3      PHE  91  20.688  14.789  -0.096
  738    HD1  PHE  91           HD1      PHE  91  19.974  15.104  -3.615
  739    HD2  PHE  91           HD2      PHE  91  22.067  16.854  -0.349
  740    HE1  PHE  91           HE1      PHE  91  20.160  17.213  -4.868
  741    HE2  PHE  91           HE2      PHE  91  22.254  18.967  -1.594
  742    HZ   PHE  91           HZ       PHE  91  21.301  19.147  -3.856
  743    H    ARG  92           H        ARG  92  22.598  11.178  -1.550
  744    HA   ARG  92           HA       ARG  92  21.065  10.291   0.691
  745    HB2  ARG  92           HB2      ARG  92  21.453   8.070  -0.039
  746    HB3  ARG  92           HB3      ARG  92  21.226   9.046  -1.484
  747    HG2  ARG  92           HG2      ARG  92  23.542   9.025  -1.969
  748    HG3  ARG  92           HG3      ARG  92  23.913   8.372  -0.376
  749    HD2  ARG  92           HD2      ARG  92  22.305   6.904  -2.456
  750    HD3  ARG  92           HD3      ARG  92  24.042   6.698  -2.234
  751    HE   ARG  92           HE       ARG  92  22.245   6.237   0.045
  752   HH11  ARG  92          HH11      ARG  92  24.428   4.918  -2.364
  753   HH12  ARG  92          HH12      ARG  92  24.643   3.417  -1.524
  754   HH21  ARG  92          HH21      ARG  92  22.521   4.267   1.142
  755   HH22  ARG  92          HH22      ARG  92  23.544   3.026   0.466
  756    H    ASP  93           H        ASP  93  24.291  11.264   0.421
  757    HA   ASP  93           HA       ASP  93  25.443   9.483   2.331
  758    HB2  ASP  93           HB2      ASP  93  26.846  10.749   0.763
  759    HB3  ASP  93           HB3      ASP  93  26.334  12.257   1.511
  760    H    SER  94           H        SER  94  23.571  12.370   2.506
  761    HA   SER  94           HA       SER  94  23.948  12.494   5.420
  762    HB2  SER  94           HB2      SER  94  24.405  14.599   4.140
  763    HB3  SER  94           HB3      SER  94  22.738  14.582   3.572
  764    HG   SER  94           HG       SER  94  22.320  15.657   5.326
  765    H    ASP  95           H        ASP  95  21.776  13.378   6.450
  766    HA   ASP  95           HA       ASP  95  19.759  11.430   6.147
  767    HB2  ASP  95           HB2      ASP  95  20.005  12.655   8.232
  768    HB3  ASP  95           HB3      ASP  95  19.698  14.181   7.419
  769    H    ASP  96           H        ASP  96  20.499  14.272   4.412
  770    HA   ASP  96           HA       ASP  96  17.736  14.903   3.802
  771    HB2  ASP  96           HB2      ASP  96  20.194  16.243   2.687
  772    HB3  ASP  96           HB3      ASP  96  18.587  16.922   2.894
  773    H    VAL  97           H        VAL  97  18.793  12.359   2.564
  774    HA   VAL  97           HA       VAL  97  18.303  13.192  -0.173
  775    HB   VAL  97           HB       VAL  97  19.553  11.274  -0.380
  776   HG11  VAL  97          HG11      VAL  97  19.348   9.236   0.879
  777   HG12  VAL  97          HG12      VAL  97  17.940   9.874   1.738
  778   HG13  VAL  97          HG13      VAL  97  19.528  10.600   1.990
  779   HG21  VAL  97          HG21      VAL  97  16.783  10.095  -0.363
  780   HG22  VAL  97          HG22      VAL  97  18.171   9.602  -1.339
  781   HG23  VAL  97          HG23      VAL  97  17.396  11.158  -1.630
  782    H    LEU  98           H        LEU  98  16.623  11.159   2.182
  783    HA   LEU  98           HA       LEU  98  14.330  10.944   0.510
  784    HB2  LEU  98           HB2      LEU  98  15.407   9.415   2.460
  785    HB3  LEU  98           HB3      LEU  98  14.127  10.204   3.360
  786    HG   LEU  98           HG       LEU  98  12.520   9.414   1.618
  787   HD11  LEU  98          HD11      LEU  98  13.274   7.500   0.228
  788   HD12  LEU  98          HD12      LEU  98  14.934   7.904   0.680
  789   HD13  LEU  98          HD13      LEU  98  13.962   9.060  -0.228
  790   HD21  LEU  98          HD21      LEU  98  12.403   7.148   2.468
  791   HD22  LEU  98          HD22      LEU  98  12.821   8.261   3.770
  792   HD23  LEU  98          HD23      LEU  98  14.068   7.254   3.036
  793    H    GLY  99           H        GLY  99  14.927  12.469   3.656
  794    HA2  GLY  99           HA2      GLY  99  12.448  13.722   3.934
  795    HA3  GLY  99           HA3      GLY  99  13.953  14.287   4.651
  796    H    HIS 100           H        HIS 100  15.394  14.829   2.299
  797    HA   HIS 100           HA       HIS 100  14.349  17.425   1.769
  798    HB2  HIS 100           HB2      HIS 100  16.815  15.975   1.049
  799    HB3  HIS 100           HB3      HIS 100  16.307  17.236  -0.072
  800    HD1  HIS 100           HD1      HIS 100  18.072  18.954   0.507
  801    HD2  HIS 100           HD2      HIS 100  15.967  17.609   3.828
  802    HE1  HIS 100           HE1      HIS 100  18.782  20.437   2.409
  803    HE2  HIS 100           HE2      HIS 100  17.685  19.440   4.437
  804    H    ILE 101           H        ILE 101  13.990  14.374   0.196
  805    HA   ILE 101           HA       ILE 101  13.104  15.286  -2.305
  806    HB   ILE 101           HB       ILE 101  11.996  12.973  -0.691
  807   HG12  ILE 101          HG12      ILE 101  14.130  13.003  -2.831
  808   HG13  ILE 101          HG13      ILE 101  14.398  12.741  -1.113
  809   HG21  ILE 101          HG21      ILE 101  10.468  13.659  -2.461
  810   HG22  ILE 101          HG22      ILE 101  11.194  12.096  -2.831
  811   HG23  ILE 101          HG23      ILE 101  11.772  13.549  -3.644
  812   HD11  ILE 101          HD11      ILE 101  13.093  10.701  -1.204
  813   HD12  ILE 101          HD12      ILE 101  14.429  10.654  -2.357
  814   HD13  ILE 101          HD13      ILE 101  12.784  10.965  -2.919
  815    H    MET 102           H        MET 102  11.189  14.406   0.503
  816    HA   MET 102           HA       MET 102   8.792  15.458  -0.559
  817    HB2  MET 102           HB2      MET 102   8.442  15.224   2.201
  818    HB3  MET 102           HB3      MET 102   8.037  14.040   0.961
  819    HG2  MET 102           HG2      MET 102  10.126  12.927   1.228
  820    HG3  MET 102           HG3      MET 102  10.739  14.189   2.286
  821    HE1  MET 102           HE1      MET 102   7.382  11.256   3.297
  822    HE2  MET 102           HE2      MET 102   8.398  11.157   1.858
  823    HE3  MET 102           HE3      MET 102   7.289  12.518   2.061
  824    H    LYS 103           H        LYS 103  11.391  16.944   1.036
  825    HA   LYS 103           HA       LYS 103   9.777  19.245   1.810
  826    HB2  LYS 103           HB2      LYS 103  12.397  18.211   2.550
  827    HB3  LYS 103           HB3      LYS 103  12.438  19.932   2.205
  828    HG2  LYS 103           HG2      LYS 103  12.058  19.702   4.527
  829    HG3  LYS 103           HG3      LYS 103  10.530  20.209   3.810
  830    HD2  LYS 103           HD2      LYS 103   9.943  18.522   5.328
  831    HD3  LYS 103           HD3      LYS 103   9.933  17.725   3.756
  832    HE2  LYS 103           HE2      LYS 103  11.016  16.290   5.348
  833    HE3  LYS 103           HE3      LYS 103  12.220  16.893   4.211
  834    HZ1  LYS 103           HZ1      LYS 103  11.753  17.913   6.960
  835    HZ2  LYS 103           HZ2      LYS 103  12.883  18.538   5.873
  836    HZ3  LYS 103           HZ3      LYS 103  13.057  16.962   6.461
  837    H    ASN 104           H        ASN 104  12.429  18.465  -0.475
  838    HA   ASN 104           HA       ASN 104  12.259  21.252  -1.402
  839    HB2  ASN 104           HB2      ASN 104  14.614  19.430  -1.054
  840    HB3  ASN 104           HB3      ASN 104  14.701  20.845  -2.094
  841   HD21  ASN 104          HD21      ASN 104  12.943  22.454  -0.410
  842   HD22  ASN 104          HD22      ASN 104  13.877  22.875   0.984
  843    H    ILE 105           H        ILE 105  11.638  18.119  -2.569
  844    HA   ILE 105           HA       ILE 105  12.462  18.898  -5.263
  845    HB   ILE 105           HB       ILE 105  12.716  16.501  -4.485
  846   HG12  ILE 105          HG12      ILE 105  12.064  15.540  -6.670
  847   HG13  ILE 105          HG13      ILE 105  11.152  17.004  -7.019
  848   HG21  ILE 105          HG21      ILE 105  10.596  16.130  -3.401
  849   HG22  ILE 105          HG22      ILE 105  10.732  15.036  -4.780
  850   HG23  ILE 105          HG23      ILE 105   9.735  16.485  -4.899
  851   HD11  ILE 105          HD11      ILE 105  13.170  18.304  -7.067
  852   HD12  ILE 105          HD12      ILE 105  13.359  16.907  -8.123
  853   HD13  ILE 105          HD13      ILE 105  14.118  16.921  -6.532
  854    H    THR 106           H        THR 106  10.970  18.833  -7.021
  855    HA   THR 106           HA       THR 106   8.864  20.576  -6.709
  856    HB   THR 106           HB       THR 106  10.115  20.054  -8.807
  857    HG1  THR 106           HG1      THR 106   8.388  21.237  -9.317
  858   HG21  THR 106          HG21      THR 106   9.261  18.214 -10.217
  859   HG22  THR 106          HG22      THR 106   8.288  17.659  -8.854
  860   HG23  THR 106          HG23      THR 106  10.047  17.645  -8.745
  861    H    ALA 107           H        ALA 107   8.877  17.088  -6.405
  862    HA   ALA 107           HA       ALA 107   5.929  17.097  -6.400
  863    HB1  ALA 107           HB1      ALA 107   6.053  14.694  -6.785
  864    HB2  ALA 107           HB2      ALA 107   7.815  14.768  -6.727
  865    HB3  ALA 107           HB3      ALA 107   6.939  15.578  -8.029
  866    H    LYS 108           H        LYS 108   4.892  16.796  -4.526
  867    HA   LYS 108           HA       LYS 108   6.477  16.138  -2.194
  868    HB2  LYS 108           HB2      LYS 108   3.830  17.355  -2.671
  869    HB3  LYS 108           HB3      LYS 108   3.953  16.355  -1.228
  870    HG2  LYS 108           HG2      LYS 108   4.429  18.712  -0.772
  871    HG3  LYS 108           HG3      LYS 108   5.806  17.671  -0.418
  872    HD2  LYS 108           HD2      LYS 108   6.227  18.393  -3.045
  873    HD3  LYS 108           HD3      LYS 108   5.553  19.860  -2.327
  874    HE2  LYS 108           HE2      LYS 108   7.228  19.618  -0.482
  875    HE3  LYS 108           HE3      LYS 108   7.959  18.299  -1.405
  876    HZ1  LYS 108           HZ1      LYS 108   8.506  19.804  -3.158
  877    HZ2  LYS 108           HZ2      LYS 108   9.036  20.510  -1.710
  878    HZ3  LYS 108           HZ3      LYS 108   7.622  21.062  -2.451
  879    H    ARG 109           H        ARG 109   6.970  14.110  -2.068
  880    HA   ARG 109           HA       ARG 109   4.906  12.089  -2.600
  881    HB2  ARG 109           HB2      ARG 109   7.882  11.617  -2.567
  882    HB3  ARG 109           HB3      ARG 109   6.633  10.579  -3.233
  883    HG2  ARG 109           HG2      ARG 109   6.237  12.142  -5.033
  884    HG3  ARG 109           HG3      ARG 109   7.395  13.277  -4.336
  885    HD2  ARG 109           HD2      ARG 109   9.120  11.439  -4.543
  886    HD3  ARG 109           HD3      ARG 109   7.946  10.562  -5.513
  887    HE   ARG 109           HE       ARG 109   7.996  12.674  -6.966
  888   HH11  ARG 109          HH11      ARG 109  10.750  11.485  -5.162
  889   HH12  ARG 109          HH12      ARG 109  11.914  12.090  -6.290
  890   HH21  ARG 109          HH21      ARG 109   9.531  13.463  -8.466
  891   HH22  ARG 109          HH22      ARG 109  11.226  13.216  -8.170
  892    H    SER 110           H        SER 110   4.872  10.256  -1.200
  893    HA   SER 110           HA       SER 110   5.724  10.886   1.518
  894    HB2  SER 110           HB2      SER 110   3.872   8.688   0.560
  895    HB3  SER 110           HB3      SER 110   4.146   9.178   2.232
  896    HG   SER 110           HG       SER 110   3.470  11.371   1.080
  897    H    ARG 111           H        ARG 111   6.457   8.929   2.825
  898    HA   ARG 111           HA       ARG 111   8.950   8.247   1.808
  899    HB2  ARG 111           HB2      ARG 111   7.376   7.093   4.099
  900    HB3  ARG 111           HB3      ARG 111   9.046   6.658   3.765
  901    HG2  ARG 111           HG2      ARG 111   8.113   9.474   4.266
  902    HG3  ARG 111           HG3      ARG 111   8.766   8.408   5.509
  903    HD2  ARG 111           HD2      ARG 111  10.858   8.240   4.313
  904    HD3  ARG 111           HD3      ARG 111  10.213   9.199   2.987
  905    HE   ARG 111           HE       ARG 111  10.158  11.098   4.504
  906   HH11  ARG 111          HH11      ARG 111  12.000   8.316   5.572
  907   HH12  ARG 111          HH12      ARG 111  13.082   9.247   6.556
  908   HH21  ARG 111          HH21      ARG 111  11.588  12.331   5.822
  909   HH22  ARG 111          HH22      ARG 111  12.844  11.522   6.703
  910    H    ALA 112           H        ALA 112   6.104   6.128   2.174
  911    HA   ALA 112           HA       ALA 112   7.342   3.745   1.461
  912    HB1  ALA 112           HB1      ALA 112   5.118   2.866   1.035
  913    HB2  ALA 112           HB2      ALA 112   4.465   4.502   0.980
  914    HB3  ALA 112           HB3      ALA 112   5.124   3.867   2.486
  915    H    ARG 113           H        ARG 113   5.809   6.146  -0.661
  916    HA   ARG 113           HA       ARG 113   5.955   4.435  -2.959
  917    HB2  ARG 113           HB2      ARG 113   5.117   6.315  -4.226
  918    HB3  ARG 113           HB3      ARG 113   4.223   6.191  -2.719
  919    HG2  ARG 113           HG2      ARG 113   5.831   7.947  -1.816
  920    HG3  ARG 113           HG3      ARG 113   6.298   8.203  -3.500
  921    HD2  ARG 113           HD2      ARG 113   4.580   9.787  -2.886
  922    HD3  ARG 113           HD3      ARG 113   3.940   8.633  -4.057
  923    HE   ARG 113           HE       ARG 113   3.255   7.514  -1.699
  924   HH11  ARG 113          HH11      ARG 113   2.776  10.724  -3.031
  925   HH12  ARG 113          HH12      ARG 113   1.375  11.046  -2.063
  926   HH21  ARG 113          HH21      ARG 113   1.384   7.930  -0.461
  927   HH22  ARG 113          HH22      ARG 113   0.577   9.459  -0.621
  928    H    ILE 114           H        ILE 114   8.024   6.810  -1.502
  929    HA   ILE 114           HA       ILE 114   9.768   7.131  -3.752
  930    HB   ILE 114           HB       ILE 114  10.261   7.627  -0.809
  931   HG12  ILE 114          HG12      ILE 114   9.653   9.604  -3.010
  932   HG13  ILE 114          HG13      ILE 114   8.444   8.988  -1.886
  933   HG21  ILE 114          HG21      ILE 114  12.338   7.285  -2.046
  934   HG22  ILE 114          HG22      ILE 114  12.163   8.964  -1.537
  935   HG23  ILE 114          HG23      ILE 114  11.849   8.516  -3.212
  936   HD11  ILE 114          HD11      ILE 114   9.257  11.188  -1.204
  937   HD12  ILE 114          HD12      ILE 114  10.902  10.562  -1.127
  938   HD13  ILE 114          HD13      ILE 114   9.677   9.959  -0.011
  939    H    VAL 115           H        VAL 115   9.828   5.313  -0.741
  940    HA   VAL 115           HA       VAL 115  12.257   3.992  -1.053
  941    HB   VAL 115           HB       VAL 115   9.734   3.103   0.349
  942   HG11  VAL 115          HG11      VAL 115  12.535   2.027   0.632
  943   HG12  VAL 115          HG12      VAL 115  11.168   1.185  -0.098
  944   HG13  VAL 115          HG13      VAL 115  11.146   1.576   1.622
  945   HG21  VAL 115          HG21      VAL 115  10.928   3.889   2.369
  946   HG22  VAL 115          HG22      VAL 115  10.591   5.180   1.214
  947   HG23  VAL 115          HG23      VAL 115  12.216   4.506   1.330
  948    H    ASP 116           H        ASP 116   8.981   2.928  -1.950
  949    HA   ASP 116           HA       ASP 116   9.659   0.454  -3.040
  950    HB2  ASP 116           HB2      ASP 116   7.342   1.146  -2.602
  951    HB3  ASP 116           HB3      ASP 116   7.455   2.334  -3.896
  952    H    LYS 117           H        LYS 117   9.885   3.684  -4.408
  953    HA   LYS 117           HA       LYS 117  10.223   2.750  -7.089
  954    HB2  LYS 117           HB2      LYS 117   9.534   5.148  -6.119
  955    HB3  LYS 117           HB3      LYS 117  11.258   5.432  -6.340
  956    HG2  LYS 117           HG2      LYS 117  10.119   6.139  -8.319
  957    HG3  LYS 117           HG3      LYS 117  11.018   4.670  -8.696
  958    HD2  LYS 117           HD2      LYS 117   8.684   3.571  -7.969
  959    HD3  LYS 117           HD3      LYS 117   8.091   5.127  -8.554
  960    HE2  LYS 117           HE2      LYS 117   9.873   3.264 -10.121
  961    HE3  LYS 117           HE3      LYS 117   8.122   3.347 -10.286
  962    HZ1  LYS 117           HZ1      LYS 117   8.329   5.637 -10.992
  963    HZ2  LYS 117           HZ2      LYS 117   9.256   4.632 -11.984
  964    HZ3  LYS 117           HZ3      LYS 117  10.015   5.581 -10.807
  965    H    LEU 118           H        LEU 118  12.445   3.654  -4.475
  966    HA   LEU 118           HA       LEU 118  14.822   3.529  -5.989
  967    HB2  LEU 118           HB2      LEU 118  14.519   2.646  -3.130
  968    HB3  LEU 118           HB3      LEU 118  16.003   3.087  -3.937
  969    HG   LEU 118           HG       LEU 118  13.780   4.905  -3.052
  970   HD11  LEU 118          HD11      LEU 118  15.379   4.291  -1.369
  971   HD12  LEU 118          HD12      LEU 118  15.677   5.961  -1.856
  972   HD13  LEU 118          HD13      LEU 118  16.723   4.664  -2.451
  973   HD21  LEU 118          HD21      LEU 118  14.499   5.562  -5.315
  974   HD22  LEU 118          HD22      LEU 118  16.170   5.618  -4.753
  975   HD23  LEU 118          HD23      LEU 118  14.978   6.737  -4.092
  976    H    LEU 119           H        LEU 119  12.982   1.081  -4.275
  977    HA   LEU 119           HA       LEU 119  14.767  -1.067  -4.695
  978    HB2  LEU 119           HB2      LEU 119  11.871  -0.817  -3.965
  979    HB3  LEU 119           HB3      LEU 119  12.535  -2.396  -4.348
  980    HG   LEU 119           HG       LEU 119  12.471  -1.978  -1.916
  981   HD11  LEU 119          HD11      LEU 119  14.117  -3.516  -2.831
  982   HD12  LEU 119          HD12      LEU 119  14.757  -2.668  -1.422
  983   HD13  LEU 119          HD13      LEU 119  15.259  -2.188  -3.045
  984   HD21  LEU 119          HD21      LEU 119  12.840   0.432  -1.894
  985   HD22  LEU 119          HD22      LEU 119  14.481   0.202  -2.492
  986   HD23  LEU 119          HD23      LEU 119  14.037  -0.389  -0.893
  987    H    ALA 120           H        ALA 120  12.454   0.493  -6.667
  988    HA   ALA 120           HA       ALA 120  12.145  -1.698  -8.527
  989    HB1  ALA 120           HB1      ALA 120  11.222   1.155  -8.801
  990    HB2  ALA 120           HB2      ALA 120  10.313  -0.112  -7.979
  991    HB3  ALA 120           HB3      ALA 120  10.645  -0.244  -9.711
  992    H    LEU 121           H        LEU 121  13.648   1.527  -8.525
  993    HA   LEU 121           HA       LEU 121  14.978   1.244 -11.023
  994    HB2  LEU 121           HB2      LEU 121  15.336   3.002  -8.625
  995    HB3  LEU 121           HB3      LEU 121  16.556   2.983  -9.878
  996    HG   LEU 121           HG       LEU 121  14.946   3.786 -11.511
  997   HD11  LEU 121          HD11      LEU 121  12.702   4.470 -10.848
  998   HD12  LEU 121          HD12      LEU 121  12.972   3.795  -9.242
  999   HD13  LEU 121          HD13      LEU 121  12.926   2.733 -10.646
 1000   HD21  LEU 121          HD21      LEU 121  14.580   6.013 -10.553
 1001   HD22  LEU 121          HD22      LEU 121  16.196   5.401 -10.196
 1002   HD23  LEU 121          HD23      LEU 121  14.949   5.372  -8.949
 1003    H    GLY 122           H        GLY 122  15.536   0.075  -7.858
 1004    HA2  GLY 122           HA2      GLY 122  17.150  -1.286  -6.987
 1005    HA3  GLY 122           HA3      GLY 122  17.868  -1.404  -8.594
 1006    H    LEU 123           H        LEU 123  17.216   1.567  -6.844
 1007    HA   LEU 123           HA       LEU 123  19.965   2.393  -7.051
 1008    HB2  LEU 123           HB2      LEU 123  17.539   3.640  -5.762
 1009    HB3  LEU 123           HB3      LEU 123  19.127   4.389  -5.745
 1010    HG   LEU 123           HG       LEU 123  17.451   3.799  -8.187
 1011   HD11  LEU 123          HD11      LEU 123  17.391   6.232  -8.425
 1012   HD12  LEU 123          HD12      LEU 123  18.279   6.400  -6.910
 1013   HD13  LEU 123          HD13      LEU 123  16.657   5.707  -6.911
 1014   HD21  LEU 123          HD21      LEU 123  19.789   3.480  -8.723
 1015   HD22  LEU 123          HD22      LEU 123  20.200   5.018  -7.968
 1016   HD23  LEU 123          HD23      LEU 123  19.217   4.991  -9.429
 1017    H    VAL 124           H        VAL 124  17.904   0.890  -4.807
 1018    HA   VAL 124           HA       VAL 124  20.182   0.453  -3.016
 1019    HB   VAL 124           HB       VAL 124  18.720   0.531  -1.052
 1020   HG11  VAL 124          HG11      VAL 124  19.972   2.523  -1.649
 1021   HG12  VAL 124          HG12      VAL 124  18.421   2.955  -0.931
 1022   HG13  VAL 124          HG13      VAL 124  18.646   3.067  -2.678
 1023   HG21  VAL 124          HG21      VAL 124  16.612  -0.031  -2.121
 1024   HG22  VAL 124          HG22      VAL 124  16.614   1.511  -2.974
 1025   HG23  VAL 124          HG23      VAL 124  16.459   1.476  -1.218
 1026    H    ALA 125           H        ALA 125  19.785  -1.460  -1.634
 1027    HA   ALA 125           HA       ALA 125  18.242  -3.481  -3.114
 1028    HB1  ALA 125           HB1      ALA 125  20.542  -3.895  -1.210
 1029    HB2  ALA 125           HB2      ALA 125  20.667  -3.887  -2.969
 1030    HB3  ALA 125           HB3      ALA 125  19.729  -5.139  -2.157
 1031    H    GLU 126           H        GLU 126  18.147  -1.552  -0.468
 1032    HA   GLU 126           HA       GLU 126  16.062  -2.979   0.838
 1033    HB2  GLU 126           HB2      GLU 126  17.201  -3.357   2.958
 1034    HB3  GLU 126           HB3      GLU 126  18.001  -4.246   1.669
 1035    HG2  GLU 126           HG2      GLU 126  19.653  -2.394   1.511
 1036    HG3  GLU 126           HG3      GLU 126  18.909  -1.674   2.936
 1037    H    ARG 127           H        ARG 127  15.683  -1.791   3.090
 1038    HA   ARG 127           HA       ARG 127  15.350   0.961   2.329
 1039    HB2  ARG 127           HB2      ARG 127  14.363  -0.732   4.575
 1040    HB3  ARG 127           HB3      ARG 127  14.282   1.016   4.719
 1041    HG2  ARG 127           HG2      ARG 127  12.187   0.250   3.893
 1042    HG3  ARG 127           HG3      ARG 127  13.018   1.076   2.581
 1043    HD2  ARG 127           HD2      ARG 127  12.001  -0.921   1.721
 1044    HD3  ARG 127           HD3      ARG 127  13.751  -1.126   1.721
 1045    HE   ARG 127           HE       ARG 127  13.041  -2.239   4.070
 1046   HH11  ARG 127          HH11      ARG 127  11.756  -2.617   0.841
 1047   HH12  ARG 127          HH12      ARG 127  11.332  -4.286   1.057
 1048   HH21  ARG 127          HH21      ARG 127  12.491  -4.445   4.369
 1049   HH22  ARG 127          HH22      ARG 127  11.761  -5.328   3.066
 1050    H    ARG 128           H        ARG 128  17.493  -0.795   4.402
 1051    HA   ARG 128           HA       ARG 128  18.315   1.110   6.213
 1052    HB2  ARG 128           HB2      ARG 128  19.141  -1.090   6.449
 1053    HB3  ARG 128           HB3      ARG 128  19.813  -1.101   4.826
 1054    HG2  ARG 128           HG2      ARG 128  20.984   1.015   6.370
 1055    HG3  ARG 128           HG3      ARG 128  21.132  -0.523   7.217
 1056    HD2  ARG 128           HD2      ARG 128  21.890  -0.139   4.328
 1057    HD3  ARG 128           HD3      ARG 128  23.030   0.049   5.659
 1058    HE   ARG 128           HE       ARG 128  21.808  -2.445   5.930
 1059   HH11  ARG 128          HH11      ARG 128  23.871  -0.811   3.605
 1060   HH12  ARG 128          HH12      ARG 128  24.738  -2.263   3.189
 1061   HH21  ARG 128          HH21      ARG 128  22.932  -4.347   5.347
 1062   HH22  ARG 128          HH22      ARG 128  24.183  -4.274   4.136
 1063    H    GLU 129           H        GLU 129  19.187   0.843   2.832
 1064    HA   GLU 129           HA       GLU 129  21.500   2.483   2.978
 1065    HB2  GLU 129           HB2      GLU 129  19.823   1.468   0.701
 1066    HB3  GLU 129           HB3      GLU 129  21.264   2.446   0.458
 1067    HG2  GLU 129           HG2      GLU 129  21.241  -0.142   1.980
 1068    HG3  GLU 129           HG3      GLU 129  21.615  -0.014   0.260
 1069    H    LEU 130           H        LEU 130  18.220   3.278   2.996
 1070    HA   LEU 130           HA       LEU 130  18.770   5.937   1.871
 1071    HB2  LEU 130           HB2      LEU 130  16.124   5.950   1.861
 1072    HB3  LEU 130           HB3      LEU 130  17.064   5.286   0.541
 1073    HG   LEU 130           HG       LEU 130  16.194   3.447   2.727
 1074   HD11  LEU 130          HD11      LEU 130  14.179   4.691   2.196
 1075   HD12  LEU 130          HD12      LEU 130  14.097   3.047   1.559
 1076   HD13  LEU 130          HD13      LEU 130  14.441   4.395   0.477
 1077   HD21  LEU 130          HD21      LEU 130  17.640   2.545   1.032
 1078   HD22  LEU 130          HD22      LEU 130  16.616   3.202  -0.248
 1079   HD23  LEU 130          HD23      LEU 130  16.015   1.903   0.780
 1080    H    TYR 131           H        TYR 131  19.016   4.722   4.685
 1081    HA   TYR 131           HA       TYR 131  17.620   6.927   6.048
 1082    HB2  TYR 131           HB2      TYR 131  18.187   4.173   7.176
 1083    HB3  TYR 131           HB3      TYR 131  17.495   5.516   8.077
 1084    HD1  TYR 131           HD1      TYR 131  15.575   6.579   6.074
 1085    HD2  TYR 131           HD2      TYR 131  16.492   2.577   7.192
 1086    HE1  TYR 131           HE1      TYR 131  13.326   5.873   5.375
 1087    HE2  TYR 131           HE2      TYR 131  14.248   1.864   6.502
 1088    HH   TYR 131           HH       TYR 131  12.218   3.776   4.616
 1089    H    LYS 132           H        LYS 132  18.878   8.256   7.186
 1090    HA   LYS 132           HA       LYS 132  21.593   8.383   6.918
 1091    HB2  LYS 132           HB2      LYS 132  21.614   9.848   8.941
 1092    HB3  LYS 132           HB3      LYS 132  20.418  10.289   7.733
 1093    HG2  LYS 132           HG2      LYS 132  18.644   9.405   9.046
 1094    HG3  LYS 132           HG3      LYS 132  19.775   8.650  10.171
 1095    HD2  LYS 132           HD2      LYS 132  20.512  10.794  10.963
 1096    HD3  LYS 132           HD3      LYS 132  19.581  11.623   9.718
 1097    HE2  LYS 132           HE2      LYS 132  18.457   9.982  11.982
 1098    HE3  LYS 132           HE3      LYS 132  18.449  11.742  11.866
 1099    HZ1  LYS 132           HZ1      LYS 132  17.191  11.356   9.691
 1100    HZ2  LYS 132           HZ2      LYS 132  16.352  11.124  11.145
 1101    HZ3  LYS 132           HZ3      LYS 132  16.916   9.785  10.276
 1102    H    LYS 133           H        LYS 133  22.759   6.602   7.209
 1103    HA   LYS 133           HA       LYS 133  23.038   5.627   9.968
 1104    HB2  LYS 133           HB2      LYS 133  21.911   3.952   8.541
 1105    HB3  LYS 133           HB3      LYS 133  23.246   4.024   7.405
 1106    HG2  LYS 133           HG2      LYS 133  24.742   3.062   9.034
 1107    HG3  LYS 133           HG3      LYS 133  23.474   3.099  10.264
 1108    HD2  LYS 133           HD2      LYS 133  22.131   1.553   8.932
 1109    HD3  LYS 133           HD3      LYS 133  23.378   1.530   7.687
 1110    HE2  LYS 133           HE2      LYS 133  23.783   0.638  10.536
 1111    HE3  LYS 133           HE3      LYS 133  23.421  -0.445   9.194
 1112    HZ1  LYS 133           HZ1      LYS 133  25.832   1.252   9.509
 1113    HZ2  LYS 133           HZ2      LYS 133  25.472   0.368   8.112
 1114    HZ3  LYS 133           HZ3      LYS 133  25.762  -0.436   9.571
 1115    H    ARG 134           H        ARG 134  24.918   6.479  10.641
 1116    HA   ARG 134           HA       ARG 134  26.933   7.209   8.734
 1117    HB2  ARG 134           HB2      ARG 134  26.725   7.503  11.716
 1118    HB3  ARG 134           HB3      ARG 134  28.232   7.835  10.879
 1119    HG2  ARG 134           HG2      ARG 134  27.126   9.903  11.146
 1120    HG3  ARG 134           HG3      ARG 134  26.972   9.459   9.448
 1121    HD2  ARG 134           HD2      ARG 134  24.707   8.593   9.913
 1122    HD3  ARG 134           HD3      ARG 134  24.866   9.141  11.581
 1123    HE   ARG 134           HE       ARG 134  25.144  11.097   9.414
 1124   HH11  ARG 134          HH11      ARG 134  23.301   9.811  12.099
 1125   HH12  ARG 134          HH12      ARG 134  22.271  11.198  12.233
 1126   HH21  ARG 134          HH21      ARG 134  23.765  12.933   9.571
 1127   HH22  ARG 134          HH22      ARG 134  22.529  12.969  10.787
 1128    H    GLN 135           H        GLN 135  27.317   5.190   7.889
 1129    HA   GLN 135           HA       GLN 135  28.944   3.397   9.544
 1130    HB2  GLN 135           HB2      GLN 135  28.560   1.736   7.746
 1131    HB3  GLN 135           HB3      GLN 135  27.055   2.313   8.447
 1132    HG2  GLN 135           HG2      GLN 135  26.872   3.903   6.521
 1133    HG3  GLN 135           HG3      GLN 135  28.251   3.081   5.794
 1134   HE21  GLN 135          HE21      GLN 135  27.039   2.410   4.021
 1135   HE22  GLN 135          HE22      GLN 135  25.842   1.168   4.138
 1136    H    LYS 136           H        LYS 136  30.882   2.498   8.490
 1137    HA   LYS 136           HA       LYS 136  32.423   4.546   7.236
 1138    HB2  LYS 136           HB2      LYS 136  33.019   1.631   7.775
 1139    HB3  LYS 136           HB3      LYS 136  34.195   2.782   7.148
 1140    HG2  LYS 136           HG2      LYS 136  34.064   4.103   9.142
 1141    HG3  LYS 136           HG3      LYS 136  32.735   3.124   9.757
 1142    HD2  LYS 136           HD2      LYS 136  34.211   1.199   9.926
 1143    HD3  LYS 136           HD3      LYS 136  35.540   2.144   9.250
 1144    HE2  LYS 136           HE2      LYS 136  35.693   1.990  11.690
 1145    HE3  LYS 136           HE3      LYS 136  35.466   3.651  11.155
 1146    HZ1  LYS 136           HZ1      LYS 136  33.091   3.419  11.685
 1147    HZ2  LYS 136           HZ2      LYS 136  34.073   3.207  13.043
 1148    HZ3  LYS 136           HZ3      LYS 136  33.380   1.865  12.283
 1149    H    LYS 137           H        LYS 137  33.838   3.668   5.217
 1150    HA   LYS 137           HA       LYS 137  32.083   4.073   3.113
 1151    HB2  LYS 137           HB2      LYS 137  33.938   3.924   1.648
 1152    HB3  LYS 137           HB3      LYS 137  34.524   4.619   3.144
 1153    HG2  LYS 137           HG2      LYS 137  34.925   1.769   2.245
 1154    HG3  LYS 137           HG3      LYS 137  36.117   3.061   2.161
 1155    HD2  LYS 137           HD2      LYS 137  36.823   2.408   4.170
 1156    HD3  LYS 137           HD3      LYS 137  35.302   3.006   4.829
 1157    HE2  LYS 137           HE2      LYS 137  34.274   0.829   4.525
 1158    HE3  LYS 137           HE3      LYS 137  35.740   0.222   3.757
 1159    HZ1  LYS 137           HZ1      LYS 137  35.454   1.071   6.583
 1160    HZ2  LYS 137           HZ2      LYS 137  36.918   0.641   5.859
 1161    HZ3  LYS 137           HZ3      LYS 137  35.685  -0.504   6.016
 1162    H    LEU 138           H        LEU 138  30.415   2.614   3.063
 1163    HA   LEU 138           HA       LEU 138  31.096   0.074   1.798
 1164    HB2  LEU 138           HB2      LEU 138  30.752  -0.395   4.175
 1165    HB3  LEU 138           HB3      LEU 138  29.167   0.353   4.098
 1166    HG   LEU 138           HG       LEU 138  28.401  -1.400   2.555
 1167   HD11  LEU 138          HD11      LEU 138  29.811  -3.386   2.183
 1168   HD12  LEU 138          HD12      LEU 138  31.157  -2.553   2.958
 1169   HD13  LEU 138          HD13      LEU 138  30.486  -1.931   1.451
 1170   HD21  LEU 138          HD21      LEU 138  29.678  -2.460   5.069
 1171   HD22  LEU 138          HD22      LEU 138  28.396  -3.252   4.153
 1172   HD23  LEU 138          HD23      LEU 138  28.088  -1.706   4.949
 1173    H    ALA 139           H        ALA 139  29.754  -0.504   0.190
 1174    HA   ALA 139           HA       ALA 139  27.713   1.391  -0.621
 1175    HB1  ALA 139           HB1      ALA 139  28.682  -1.127  -1.970
 1176    HB2  ALA 139           HB2      ALA 139  29.323   0.491  -2.251
 1177    HB3  ALA 139           HB3      ALA 139  27.656   0.113  -2.689
 1178    H    SER 140           H        SER 140  25.827  -0.119  -1.871
 1179    HA   SER 140           HA       SER 140  24.265  -1.106   0.289
 1180    HB2  SER 140           HB2      SER 140  23.792  -1.373  -2.690
 1181    HB3  SER 140           HB3      SER 140  22.589  -1.619  -1.422
 1182    HG   SER 140           HG       SER 140  23.491   0.718  -0.886
 1183    H    SER 141           H        SER 141  24.990  -2.870   1.274
 1184    HA   SER 141           HA       SER 141  25.202  -5.339  -0.239
 1185    HB2  SER 141           HB2      SER 141  27.504  -4.264  -0.130
 1186    HB3  SER 141           HB3      SER 141  27.435  -4.485   1.617
 1187    HG   SER 141           HG       SER 141  27.299  -6.525  -0.360
  Start of MODEL   14
    1    H1   ASP   1           HT1      ASP   1 -20.247  11.272  -7.299
    2    H2   ASP   1           HT2      ASP   1 -21.844  11.693  -7.658
    3    H3   ASP   1           HT3      ASP   1 -20.756  11.370  -8.907
    4    HA   ASP   1           HA       ASP   1 -20.585   9.097  -8.283
    5    HB2  ASP   1           HB2      ASP   1 -22.373   9.960  -6.006
    6    HB3  ASP   1           HB3      ASP   1 -22.185   8.270  -6.466
    7    HA   PRO   2           HA       PRO   2 -23.347   7.985 -11.300
    8    HB2  PRO   2           HB2      PRO   2 -24.723   6.028  -9.506
    9    HB3  PRO   2           HB3      PRO   2 -24.086   5.805 -11.141
   10    HG2  PRO   2           HG2      PRO   2 -22.719   4.912  -9.059
   11    HG3  PRO   2           HG3      PRO   2 -21.883   5.705 -10.409
   12    HD2  PRO   2           HD2      PRO   2 -22.507   6.750  -7.687
   13    HD3  PRO   2           HD3      PRO   2 -21.096   7.058  -8.719
   14    H    SER   3           H        SER   3 -25.575   7.517  -8.527
   15    HA   SER   3           HA       SER   3 -27.736   8.403 -10.198
   16    HB2  SER   3           HB2      SER   3 -28.027   6.534  -8.636
   17    HB3  SER   3           HB3      SER   3 -27.715   7.613  -7.278
   18    HG   SER   3           HG       SER   3 -30.024   7.082  -8.205
   19    H    ARG   4           H        ARG   4 -26.407   9.541  -7.096
   20    HA   ARG   4           HA       ARG   4 -27.157  12.262  -7.746
   21    HB2  ARG   4           HB2      ARG   4 -28.425  12.504  -5.594
   22    HB3  ARG   4           HB3      ARG   4 -29.228  11.498  -6.791
   23    HG2  ARG   4           HG2      ARG   4 -28.497   9.494  -5.633
   24    HG3  ARG   4           HG3      ARG   4 -27.608  10.475  -4.467
   25    HD2  ARG   4           HD2      ARG   4 -30.590  10.590  -4.901
   26    HD3  ARG   4           HD3      ARG   4 -29.792   9.678  -3.621
   27    HE   ARG   4           HE       ARG   4 -29.683  12.621  -3.872
   28   HH11  ARG   4          HH11      ARG   4 -29.791   9.710  -1.927
   29   HH12  ARG   4          HH12      ARG   4 -29.755  10.563  -0.422
   30   HH21  ARG   4          HH21      ARG   4 -29.660  13.744  -1.884
   31   HH22  ARG   4          HH22      ARG   4 -29.677  12.855  -0.394
   32    H    ARG   5           H        ARG   5 -26.810  13.452  -5.320
   33    HA   ARG   5           HA       ARG   5 -24.041  13.134  -4.742
   34    HB2  ARG   5           HB2      ARG   5 -26.181  14.925  -3.937
   35    HB3  ARG   5           HB3      ARG   5 -25.202  14.446  -2.558
   36    HG2  ARG   5           HG2      ARG   5 -24.218  15.742  -5.092
   37    HG3  ARG   5           HG3      ARG   5 -24.357  16.498  -3.504
   38    HD2  ARG   5           HD2      ARG   5 -22.505  14.255  -4.303
   39    HD3  ARG   5           HD3      ARG   5 -22.061  15.904  -3.880
   40    HE   ARG   5           HE       ARG   5 -23.423  14.775  -1.711
   41   HH11  ARG   5          HH11      ARG   5 -20.392  14.456  -3.424
   42   HH12  ARG   5          HH12      ARG   5 -19.541  13.810  -2.059
   43   HH21  ARG   5          HH21      ARG   5 -22.309  13.910   0.086
   44   HH22  ARG   5          HH22      ARG   5 -20.631  13.499  -0.058
   45    H    ALA   6           H        ALA   6 -23.080  11.848  -3.307
   46    HA   ALA   6           HA       ALA   6 -24.548   9.790  -2.029
   47    HB1  ALA   6           HB1      ALA   6 -22.383   9.141  -1.063
   48    HB2  ALA   6           HB2      ALA   6 -21.667  10.620  -1.707
   49    HB3  ALA   6           HB3      ALA   6 -22.294   9.390  -2.806
   50    HA   PRO   7           HA       PRO   7 -25.275  11.737   1.882
   51    HB2  PRO   7           HB2      PRO   7 -25.773   9.615   3.405
   52    HB3  PRO   7           HB3      PRO   7 -26.819  10.006   2.035
   53    HG2  PRO   7           HG2      PRO   7 -24.595   8.003   2.176
   54    HG3  PRO   7           HG3      PRO   7 -26.244   7.789   1.551
   55    HD2  PRO   7           HD2      PRO   7 -24.101   8.325  -0.045
   56    HD3  PRO   7           HD3      PRO   7 -25.756   8.826  -0.439
   57    H    THR   8           H        THR   8 -24.573  11.357   4.294
   58    HA   THR   8           HA       THR   8 -21.666  11.089   4.274
   59    HB   THR   8           HB       THR   8 -21.946  12.132   6.625
   60    HG1  THR   8           HG1      THR   8 -23.899  12.752   7.166
   61   HG21  THR   8          HG21      THR   8 -22.004  14.386   5.658
   62   HG22  THR   8          HG22      THR   8 -22.627  13.724   4.148
   63   HG23  THR   8          HG23      THR   8 -21.003  13.302   4.691
   64    H    TRP   9           H        TRP   9 -20.638   9.516   5.312
   65    HA   TRP   9           HA       TRP   9 -22.091   7.262   6.232
   66    HB2  TRP   9           HB2      TRP   9 -19.165   7.959   6.230
   67    HB3  TRP   9           HB3      TRP   9 -19.759   6.467   6.949
   68    HD1  TRP   9           HD1      TRP   9 -19.271   8.176   3.571
   69    HE1  TRP   9           HE1      TRP   9 -19.475   6.406   1.716
   70    HE3  TRP   9           HE3      TRP   9 -20.834   4.217   6.390
   71    HZ2  TRP   9           HZ2      TRP   9 -20.203   3.698   1.474
   72    HZ3  TRP   9           HZ3      TRP   9 -21.269   2.072   5.267
   73    HH2  TRP   9           HH2      TRP   9 -20.961   1.821   2.860
   74    H    SER  10           H        SER  10 -22.360   6.443   8.235
   75    HA   SER  10           HA       SER  10 -21.530   8.100  10.513
   76    HB2  SER  10           HB2      SER  10 -23.626   7.206  11.635
   77    HB3  SER  10           HB3      SER  10 -23.916   8.329  10.306
   78    HG   SER  10           HG       SER  10 -24.950   6.806   9.317
   79    HA   PRO  11           HA       PRO  11 -19.356   4.661  12.259
   80    HB2  PRO  11           HB2      PRO  11 -21.206   4.980  14.592
   81    HB3  PRO  11           HB3      PRO  11 -19.448   4.785  14.573
   82    HG2  PRO  11           HG2      PRO  11 -20.505   7.183  14.946
   83    HG3  PRO  11           HG3      PRO  11 -19.086   6.986  13.900
   84    HD2  PRO  11           HD2      PRO  11 -21.934   7.470  13.159
   85    HD3  PRO  11           HD3      PRO  11 -20.448   8.023  12.361
   86    H    GLU  12           H        GLU  12 -22.901   4.583  12.613
   87    HA   GLU  12           HA       GLU  12 -23.153   1.796  12.939
   88    HB2  GLU  12           HB2      GLU  12 -25.054   3.197  13.389
   89    HB3  GLU  12           HB3      GLU  12 -25.052   3.821  11.743
   90    HG2  GLU  12           HG2      GLU  12 -25.456   1.412  11.010
   91    HG3  GLU  12           HG3      GLU  12 -25.819   1.084  12.701
   92    H    GLU  13           H        GLU  13 -23.435   3.807  10.020
   93    HA   GLU  13           HA       GLU  13 -23.915   1.594   8.314
   94    HB2  GLU  13           HB2      GLU  13 -24.445   4.155   8.024
   95    HB3  GLU  13           HB3      GLU  13 -22.854   4.196   7.280
   96    HG2  GLU  13           HG2      GLU  13 -24.605   3.940   5.615
   97    HG3  GLU  13           HG3      GLU  13 -23.548   2.526   5.654
   98    H    GLU  14           H        GLU  14 -21.020   3.304   9.330
   99    HA   GLU  14           HA       GLU  14 -19.296   2.109   7.396
  100    HB2  GLU  14           HB2      GLU  14 -18.639   3.334  10.083
  101    HB3  GLU  14           HB3      GLU  14 -17.464   2.917   8.843
  102    HG2  GLU  14           HG2      GLU  14 -18.615   4.498   7.308
  103    HG3  GLU  14           HG3      GLU  14 -19.635   4.989   8.657
  104    H    ALA  15           H        ALA  15 -20.335   1.226  10.649
  105    HA   ALA  15           HA       ALA  15 -18.662  -1.061  10.894
  106    HB1  ALA  15           HB1      ALA  15 -20.230  -1.756  12.660
  107    HB2  ALA  15           HB2      ALA  15 -21.320  -0.452  12.184
  108    HB3  ALA  15           HB3      ALA  15 -19.727  -0.074  12.837
  109    H    HIS  16           H        HIS  16 -21.763  -0.447   9.483
  110    HA   HIS  16           HA       HIS  16 -22.435  -3.104   8.806
  111    HB2  HIS  16           HB2      HIS  16 -24.079  -1.249   8.988
  112    HB3  HIS  16           HB3      HIS  16 -23.365  -0.505   7.566
  113    HD1  HIS  16           HD1      HIS  16 -25.604  -0.642   6.311
  114    HD2  HIS  16           HD2      HIS  16 -24.059  -4.334   7.454
  115    HE1  HIS  16           HE1      HIS  16 -26.962  -2.373   5.070
  116    HE2  HIS  16           HE2      HIS  16 -25.993  -4.596   5.760
  117    H    LEU  17           H        LEU  17 -20.451  -0.631   7.401
  118    HA   LEU  17           HA       LEU  17 -20.265  -1.712   4.790
  119    HB2  LEU  17           HB2      LEU  17 -19.632   0.609   5.414
  120    HB3  LEU  17           HB3      LEU  17 -18.255  -0.030   6.290
  121    HG   LEU  17           HG       LEU  17 -17.250  -0.829   4.230
  122   HD11  LEU  17          HD11      LEU  17 -19.173  -1.490   2.979
  123   HD12  LEU  17          HD12      LEU  17 -18.333  -0.242   2.060
  124   HD13  LEU  17          HD13      LEU  17 -19.793   0.159   2.958
  125   HD21  LEU  17          HD21      LEU  17 -18.246   2.006   4.028
  126   HD22  LEU  17          HD22      LEU  17 -16.913   1.326   3.094
  127   HD23  LEU  17          HD23      LEU  17 -16.785   1.456   4.849
  128    H    ARG  18           H        ARG  18 -18.112  -1.946   7.636
  129    HA   ARG  18           HA       ARG  18 -16.525  -3.994   6.499
  130    HB2  ARG  18           HB2      ARG  18 -15.751  -4.403   8.828
  131    HB3  ARG  18           HB3      ARG  18 -15.603  -2.730   8.316
  132    HG2  ARG  18           HG2      ARG  18 -17.716  -2.245   9.538
  133    HG3  ARG  18           HG3      ARG  18 -17.674  -3.897  10.156
  134    HD2  ARG  18           HD2      ARG  18 -15.478  -1.863  10.538
  135    HD3  ARG  18           HD3      ARG  18 -16.728  -2.219  11.727
  136    HE   ARG  18           HE       ARG  18 -15.794  -4.585  11.617
  137   HH11  ARG  18          HH11      ARG  18 -13.831  -1.735  11.072
  138   HH12  ARG  18          HH12      ARG  18 -12.381  -2.462  11.684
  139   HH21  ARG  18          HH21      ARG  18 -13.879  -5.541  12.433
  140   HH22  ARG  18          HH22      ARG  18 -12.408  -4.620  12.469
  141    H    GLU  19           H        GLU  19 -19.484  -3.931   8.363
  142    HA   GLU  19           HA       GLU  19 -19.850  -6.541   9.051
  143    HB2  GLU  19           HB2      GLU  19 -21.457  -4.828   9.612
  144    HB3  GLU  19           HB3      GLU  19 -21.876  -4.635   7.917
  145    HG2  GLU  19           HG2      GLU  19 -23.592  -5.867   9.076
  146    HG3  GLU  19           HG3      GLU  19 -22.799  -6.889   7.883
  147    H    LEU  20           H        LEU  20 -20.524  -5.024   5.939
  148    HA   LEU  20           HA       LEU  20 -21.467  -7.303   4.584
  149    HB2  LEU  20           HB2      LEU  20 -21.016  -4.572   4.040
  150    HB3  LEU  20           HB3      LEU  20 -20.135  -5.466   2.822
  151    HG   LEU  20           HG       LEU  20 -22.280  -4.944   1.939
  152   HD11  LEU  20          HD11      LEU  20 -21.493  -7.123   1.317
  153   HD12  LEU  20          HD12      LEU  20 -23.239  -7.188   1.549
  154   HD13  LEU  20          HD13      LEU  20 -22.162  -7.828   2.786
  155   HD21  LEU  20          HD21      LEU  20 -23.418  -6.151   4.450
  156   HD22  LEU  20          HD22      LEU  20 -24.361  -5.698   3.031
  157   HD23  LEU  20          HD23      LEU  20 -23.497  -4.461   3.941
  158    H    TYR  21           H        TYR  21 -18.232  -5.910   4.904
  159    HA   TYR  21           HA       TYR  21 -17.035  -7.534   2.890
  160    HB2  TYR  21           HB2      TYR  21 -16.068  -5.379   3.467
  161    HB3  TYR  21           HB3      TYR  21 -15.815  -5.902   5.125
  162    HD1  TYR  21           HD1      TYR  21 -13.849  -7.047   5.747
  163    HD2  TYR  21           HD2      TYR  21 -14.724  -6.500   1.621
  164    HE1  TYR  21           HE1      TYR  21 -11.596  -7.848   5.167
  165    HE2  TYR  21           HE2      TYR  21 -12.478  -7.298   1.031
  166    HH   TYR  21           HH       TYR  21 -10.237  -7.453   2.104
  167    H    LEU  22           H        LEU  22 -17.097  -7.615   6.415
  168    HA   LEU  22           HA       LEU  22 -15.324  -9.782   6.723
  169    HB2  LEU  22           HB2      LEU  22 -17.538  -8.970   8.602
  170    HB3  LEU  22           HB3      LEU  22 -16.077  -9.845   9.006
  171    HG   LEU  22           HG       LEU  22 -16.211  -6.974   8.094
  172   HD11  LEU  22          HD11      LEU  22 -15.476  -6.461  10.370
  173   HD12  LEU  22          HD12      LEU  22 -15.634  -8.166  10.795
  174   HD13  LEU  22          HD13      LEU  22 -17.060  -7.236  10.334
  175   HD21  LEU  22          HD21      LEU  22 -14.157  -8.170   7.384
  176   HD22  LEU  22          HD22      LEU  22 -13.820  -8.514   9.080
  177   HD23  LEU  22          HD23      LEU  22 -13.865  -6.845   8.508
  178    H    ALA  23           H        ALA  23 -18.712  -9.637   5.975
  179    HA   ALA  23           HA       ALA  23 -19.187 -12.421   6.589
  180    HB1  ALA  23           HB1      ALA  23 -20.910 -10.412   5.143
  181    HB2  ALA  23           HB2      ALA  23 -20.979 -10.797   6.862
  182    HB3  ALA  23           HB3      ALA  23 -21.421 -12.016   5.667
  183    H    ASN  24           H        ASN  24 -18.720 -10.462   3.653
  184    HA   ASN  24           HA       ASN  24 -19.145 -12.824   2.007
  185    HB2  ASN  24           HB2      ASN  24 -18.854  -9.900   1.332
  186    HB3  ASN  24           HB3      ASN  24 -18.964 -11.162   0.107
  187   HD21  ASN  24          HD21      ASN  24 -20.638  -9.505   2.672
  188   HD22  ASN  24          HD22      ASN  24 -22.232 -10.019   2.233
  189    H    LYS  25           H        LYS  25 -16.541 -11.729   3.589
  190    HA   LYS  25           HA       LYS  25 -14.623 -12.218   1.472
  191    HB2  LYS  25           HB2      LYS  25 -12.907 -11.944   3.170
  192    HB3  LYS  25           HB3      LYS  25 -14.074 -10.638   3.295
  193    HG2  LYS  25           HG2      LYS  25 -15.155 -11.869   5.164
  194    HG3  LYS  25           HG3      LYS  25 -13.839 -13.041   5.090
  195    HD2  LYS  25           HD2      LYS  25 -13.511 -10.078   5.573
  196    HD3  LYS  25           HD3      LYS  25 -13.477 -11.319   6.824
  197    HE2  LYS  25           HE2      LYS  25 -11.581 -11.223   4.484
  198    HE3  LYS  25           HE3      LYS  25 -11.229 -10.530   6.063
  199    HZ1  LYS  25           HZ1      LYS  25 -10.313 -12.790   5.709
  200    HZ2  LYS  25           HZ2      LYS  25 -11.891 -13.390   5.632
  201    HZ3  LYS  25           HZ3      LYS  25 -11.328 -12.673   7.056
  202    H    ASP  26           H        ASP  26 -16.559 -14.012   3.485
  203    HA   ASP  26           HA       ASP  26 -14.822 -16.281   3.879
  204    HB2  ASP  26           HB2      ASP  26 -16.577 -15.648   5.515
  205    HB3  ASP  26           HB3      ASP  26 -17.809 -15.989   4.305
  206    H    VAL  27           H        VAL  27 -16.893 -15.139   1.438
  207    HA   VAL  27           HA       VAL  27 -17.504 -17.759   0.356
  208    HB   VAL  27           HB       VAL  27 -19.262 -15.995   0.386
  209   HG11  VAL  27          HG11      VAL  27 -19.144 -14.174  -1.229
  210   HG12  VAL  27          HG12      VAL  27 -17.498 -14.657  -1.635
  211   HG13  VAL  27          HG13      VAL  27 -17.870 -14.071  -0.015
  212   HG21  VAL  27          HG21      VAL  27 -19.452 -17.824  -1.193
  213   HG22  VAL  27          HG22      VAL  27 -18.446 -16.955  -2.350
  214   HG23  VAL  27          HG23      VAL  27 -20.037 -16.328  -1.920
  215    H    GLU  28           H        GLU  28 -16.620 -18.597  -1.471
  216    HA   GLU  28           HA       GLU  28 -14.468 -17.022  -2.708
  217    HB2  GLU  28           HB2      GLU  28 -14.703 -20.012  -2.375
  218    HB3  GLU  28           HB3      GLU  28 -13.436 -19.206  -3.289
  219    HG2  GLU  28           HG2      GLU  28 -12.735 -18.037  -1.247
  220    HG3  GLU  28           HG3      GLU  28 -13.963 -18.922  -0.339
  221    H    GLY  29           H        GLY  29 -14.332 -16.894  -4.901
  222    HA2  GLY  29           HA2      GLY  29 -14.937 -17.359  -7.130
  223    HA3  GLY  29           HA3      GLY  29 -16.262 -18.356  -6.540
  224    H    GLN  30           H        GLN  30 -16.141 -15.512  -4.836
  225    HA   GLN  30           HA       GLN  30 -18.092 -14.217  -6.603
  226    HB2  GLN  30           HB2      GLN  30 -19.478 -15.094  -4.953
  227    HB3  GLN  30           HB3      GLN  30 -18.281 -14.875  -3.686
  228    HG2  GLN  30           HG2      GLN  30 -18.620 -12.459  -3.783
  229    HG3  GLN  30           HG3      GLN  30 -19.827 -12.681  -5.044
  230   HE21  GLN  30          HE21      GLN  30 -19.798 -11.637  -2.214
  231   HE22  GLN  30          HE22      GLN  30 -21.168 -12.384  -1.499
  232    H    ASP  31           H        ASP  31 -18.115 -12.006  -6.621
  233    HA   ASP  31           HA       ASP  31 -15.803 -10.534  -5.888
  234    HB2  ASP  31           HB2      ASP  31 -18.601  -9.634  -6.602
  235    HB3  ASP  31           HB3      ASP  31 -17.210  -8.558  -6.466
  236    H    VAL  32           H        VAL  32 -15.311 -10.197  -3.735
  237    HA   VAL  32           HA       VAL  32 -17.341  -9.935  -1.755
  238    HB   VAL  32           HB       VAL  32 -14.956 -10.589  -1.242
  239   HG11  VAL  32          HG11      VAL  32 -14.500  -7.630  -1.611
  240   HG12  VAL  32          HG12      VAL  32 -13.749  -8.949  -2.516
  241   HG13  VAL  32          HG13      VAL  32 -13.370  -8.728  -0.808
  242   HG21  VAL  32          HG21      VAL  32 -16.517 -10.019   0.517
  243   HG22  VAL  32          HG22      VAL  32 -16.152  -8.304   0.322
  244   HG23  VAL  32          HG23      VAL  32 -14.911  -9.409   0.915
  245    H    VAL  33           H        VAL  33 -15.399  -7.655  -3.596
  246    HA   VAL  33           HA       VAL  33 -16.121  -5.262  -2.422
  247    HB   VAL  33           HB       VAL  33 -15.775  -5.568  -5.384
  248   HG11  VAL  33          HG11      VAL  33 -14.601  -3.415  -5.158
  249   HG12  VAL  33          HG12      VAL  33 -14.998  -3.415  -3.440
  250   HG13  VAL  33          HG13      VAL  33 -16.286  -3.357  -4.643
  251   HG21  VAL  33          HG21      VAL  33 -13.296  -5.372  -4.944
  252   HG22  VAL  33          HG22      VAL  33 -14.040  -6.932  -4.597
  253   HG23  VAL  33          HG23      VAL  33 -13.657  -5.828  -3.278
  254    H    GLU  34           H        GLU  34 -17.438  -6.741  -5.352
  255    HA   GLU  34           HA       GLU  34 -19.466  -4.807  -5.639
  256    HB2  GLU  34           HB2      GLU  34 -18.381  -6.303  -7.425
  257    HB3  GLU  34           HB3      GLU  34 -19.530  -7.530  -6.904
  258    HG2  GLU  34           HG2      GLU  34 -21.373  -6.109  -7.473
  259    HG3  GLU  34           HG3      GLU  34 -20.281  -4.785  -7.864
  260    H    ALA  35           H        ALA  35 -19.250  -7.783  -3.885
  261    HA   ALA  35           HA       ALA  35 -21.992  -8.245  -3.415
  262    HB1  ALA  35           HB1      ALA  35 -19.673  -8.688  -1.530
  263    HB2  ALA  35           HB2      ALA  35 -20.217  -9.827  -2.764
  264    HB3  ALA  35           HB3      ALA  35 -21.273  -9.425  -1.408
  265    H    ILE  36           H        ILE  36 -19.557  -6.411  -1.661
  266    HA   ILE  36           HA       ILE  36 -21.210  -5.325   0.314
  267    HB   ILE  36           HB       ILE  36 -18.752  -4.057  -0.888
  268   HG12  ILE  36          HG12      ILE  36 -18.971  -6.052   1.370
  269   HG13  ILE  36          HG13      ILE  36 -18.358  -6.398  -0.240
  270   HG21  ILE  36          HG21      ILE  36 -18.508  -3.109   1.387
  271   HG22  ILE  36          HG22      ILE  36 -20.088  -3.780   1.793
  272   HG23  ILE  36          HG23      ILE  36 -19.947  -2.554   0.537
  273   HD11  ILE  36          HD11      ILE  36 -16.534  -4.836   0.105
  274   HD12  ILE  36          HD12      ILE  36 -16.560  -6.093   1.342
  275   HD13  ILE  36          HD13      ILE  36 -17.149  -4.475   1.719
  276    H    LEU  37           H        LEU  37 -20.023  -3.884  -2.716
  277    HA   LEU  37           HA       LEU  37 -21.321  -1.422  -2.546
  278    HB2  LEU  37           HB2      LEU  37 -21.168  -2.810  -5.181
  279    HB3  LEU  37           HB3      LEU  37 -20.901  -1.128  -4.819
  280    HG   LEU  37           HG       LEU  37 -18.987  -3.346  -4.094
  281   HD11  LEU  37          HD11      LEU  37 -17.667  -2.690  -5.959
  282   HD12  LEU  37          HD12      LEU  37 -18.739  -1.341  -6.314
  283   HD13  LEU  37          HD13      LEU  37 -19.301  -2.993  -6.554
  284   HD21  LEU  37          HD21      LEU  37 -18.790  -1.410  -2.664
  285   HD22  LEU  37          HD22      LEU  37 -18.704  -0.354  -4.073
  286   HD23  LEU  37          HD23      LEU  37 -17.412  -1.513  -3.758
  287    H    ALA  38           H        ALA  38 -22.613  -4.534  -3.328
  288    HA   ALA  38           HA       ALA  38 -24.972  -3.494  -4.658
  289    HB1  ALA  38           HB1      ALA  38 -25.492  -5.818  -5.095
  290    HB2  ALA  38           HB2      ALA  38 -24.179  -6.320  -4.026
  291    HB3  ALA  38           HB3      ALA  38 -23.817  -5.463  -5.524
  292    H    HIS  39           H        HIS  39 -24.182  -5.195  -1.640
  293    HA   HIS  39           HA       HIS  39 -26.943  -5.697  -1.016
  294    HB2  HIS  39           HB2      HIS  39 -24.382  -6.024   0.521
  295    HB3  HIS  39           HB3      HIS  39 -25.938  -6.229   1.311
  296    HD1  HIS  39           HD1      HIS  39 -27.183  -8.409   0.909
  297    HD2  HIS  39           HD2      HIS  39 -23.757  -8.028  -1.416
  298    HE1  HIS  39           HE1      HIS  39 -26.776 -10.682  -0.081
  299    HE2  HIS  39           HE2      HIS  39 -24.611 -10.469  -1.344
  300    H    LEU  40           H        LEU  40 -24.625  -3.216  -0.336
  301    HA   LEU  40           HA       LEU  40 -26.196  -1.966   1.726
  302    HB2  LEU  40           HB2      LEU  40 -23.926  -0.819   0.111
  303    HB3  LEU  40           HB3      LEU  40 -24.570  -0.186   1.612
  304    HG   LEU  40           HG       LEU  40 -23.392  -2.931   1.535
  305   HD11  LEU  40          HD11      LEU  40 -21.241  -1.896   2.164
  306   HD12  LEU  40          HD12      LEU  40 -21.919  -0.316   1.763
  307   HD13  LEU  40          HD13      LEU  40 -21.733  -1.545   0.506
  308   HD21  LEU  40          HD21      LEU  40 -22.890  -2.394   3.870
  309   HD22  LEU  40          HD22      LEU  40 -24.614  -2.245   3.529
  310   HD23  LEU  40          HD23      LEU  40 -23.612  -0.799   3.658
  311    H    ASN  41           H        ASN  41 -28.204  -1.825   0.517
  312    HA   ASN  41           HA       ASN  41 -28.269   0.154  -1.614
  313    HB2  ASN  41           HB2      ASN  41 -30.433  -1.490  -0.274
  314    HB3  ASN  41           HB3      ASN  41 -30.768  -0.285  -1.512
  315   HD21  ASN  41          HD21      ASN  41 -29.443  -3.420  -0.846
  316   HD22  ASN  41          HD22      ASN  41 -29.261  -3.923  -2.489
  317    H    THR  42           H        THR  42 -27.278   0.946   0.885
  318    HA   THR  42           HA       THR  42 -29.311   2.837   1.828
  319    HB   THR  42           HB       THR  42 -28.485   1.459   3.627
  320    HG1  THR  42           HG1      THR  42 -27.423   3.167   4.932
  321   HG21  THR  42          HG21      THR  42 -25.701   2.379   2.904
  322   HG22  THR  42          HG22      THR  42 -26.360   0.777   2.574
  323   HG23  THR  42          HG23      THR  42 -26.139   1.312   4.241
  324    H    VAL  43           H        VAL  43 -26.190   2.499   0.326
  325    HA   VAL  43           HA       VAL  43 -25.866   5.422   0.326
  326    HB   VAL  43           HB       VAL  43 -23.350   4.911   0.193
  327   HG11  VAL  43          HG11      VAL  43 -24.438   5.952   2.119
  328   HG12  VAL  43          HG12      VAL  43 -23.119   4.886   2.597
  329   HG13  VAL  43          HG13      VAL  43 -24.793   4.353   2.776
  330   HG21  VAL  43          HG21      VAL  43 -23.465   2.527  -0.191
  331   HG22  VAL  43          HG22      VAL  43 -24.333   2.295   1.327
  332   HG23  VAL  43          HG23      VAL  43 -22.656   2.840   1.346
  333    HA   PRO  44           HA       PRO  44 -25.655   4.503  -4.126
  334    HB2  PRO  44           HB2      PRO  44 -26.309   7.330  -4.407
  335    HB3  PRO  44           HB3      PRO  44 -27.214   5.922  -4.969
  336    HG2  PRO  44           HG2      PRO  44 -28.081   7.522  -2.953
  337    HG3  PRO  44           HG3      PRO  44 -28.461   5.794  -3.047
  338    HD2  PRO  44           HD2      PRO  44 -26.398   7.191  -1.386
  339    HD3  PRO  44           HD3      PRO  44 -27.476   5.848  -0.949
  340    H    ARG  45           H        ARG  45 -23.380   4.290  -3.928
  341    HA   ARG  45           HA       ARG  45 -21.882   6.763  -4.466
  342    HB2  ARG  45           HB2      ARG  45 -20.787   4.550  -2.722
  343    HB3  ARG  45           HB3      ARG  45 -20.131   6.165  -2.960
  344    HG2  ARG  45           HG2      ARG  45 -22.066   7.108  -1.789
  345    HG3  ARG  45           HG3      ARG  45 -22.691   5.481  -1.534
  346    HD2  ARG  45           HD2      ARG  45 -21.620   6.047   0.474
  347    HD3  ARG  45           HD3      ARG  45 -20.483   4.988  -0.360
  348    HE   ARG  45           HE       ARG  45 -19.074   6.808  -0.706
  349   HH11  ARG  45          HH11      ARG  45 -22.014   7.755   0.909
  350   HH12  ARG  45          HH12      ARG  45 -21.460   9.350   1.308
  351   HH21  ARG  45          HH21      ARG  45 -18.306   8.935  -0.191
  352   HH22  ARG  45          HH22      ARG  45 -19.348  10.016   0.682
  353    H    THR  46           H        THR  46 -19.521   6.031  -5.185
  354    HA   THR  46           HA       THR  46 -19.988   4.139  -7.344
  355    HB   THR  46           HB       THR  46 -18.729   6.334  -7.678
  356    HG1  THR  46           HG1      THR  46 -18.631   4.777  -9.283
  357   HG21  THR  46          HG21      THR  46 -17.251   6.219  -5.747
  358   HG22  THR  46          HG22      THR  46 -16.304   6.256  -7.236
  359   HG23  THR  46          HG23      THR  46 -16.528   4.738  -6.366
  360    H    ARG  47           H        ARG  47 -17.862   2.757  -7.816
  361    HA   ARG  47           HA       ARG  47 -18.042   0.693  -5.882
  362    HB2  ARG  47           HB2      ARG  47 -15.895   0.829  -7.991
  363    HB3  ARG  47           HB3      ARG  47 -16.695  -0.591  -7.334
  364    HG2  ARG  47           HG2      ARG  47 -17.824   1.427  -9.261
  365    HG3  ARG  47           HG3      ARG  47 -17.484  -0.276  -9.553
  366    HD2  ARG  47           HD2      ARG  47 -19.259  -0.951  -8.100
  367    HD3  ARG  47           HD3      ARG  47 -19.511   0.704  -7.549
  368    HE   ARG  47           HE       ARG  47 -19.873   0.199 -10.391
  369   HH11  ARG  47          HH11      ARG  47 -21.370   0.601  -7.244
  370   HH12  ARG  47          HH12      ARG  47 -22.942   0.930  -7.891
  371   HH21  ARG  47          HH21      ARG  47 -21.937   0.637 -11.244
  372   HH22  ARG  47          HH22      ARG  47 -23.269   0.941 -10.171
  373    H    LYS  48           H        LYS  48 -15.541   2.998  -6.734
  374    HA   LYS  48           HA       LYS  48 -13.476   2.166  -5.073
  375    HB2  LYS  48           HB2      LYS  48 -12.840   3.759  -6.606
  376    HB3  LYS  48           HB3      LYS  48 -14.281   4.732  -6.350
  377    HG2  LYS  48           HG2      LYS  48 -13.404   5.581  -4.282
  378    HG3  LYS  48           HG3      LYS  48 -12.010   4.527  -4.391
  379    HD2  LYS  48           HD2      LYS  48 -11.292   6.656  -5.109
  380    HD3  LYS  48           HD3      LYS  48 -11.462   5.673  -6.567
  381    HE2  LYS  48           HE2      LYS  48 -13.745   6.612  -6.838
  382    HE3  LYS  48           HE3      LYS  48 -13.402   7.691  -5.492
  383    HZ1  LYS  48           HZ1      LYS  48 -11.891   7.592  -8.047
  384    HZ2  LYS  48           HZ2      LYS  48 -11.571   8.632  -6.752
  385    HZ3  LYS  48           HZ3      LYS  48 -13.015   8.778  -7.615
  386    H    GLN  49           H        GLN  49 -16.340   4.022  -4.297
  387    HA   GLN  49           HA       GLN  49 -15.392   5.313  -2.005
  388    HB2  GLN  49           HB2      GLN  49 -17.948   4.926  -3.316
  389    HB3  GLN  49           HB3      GLN  49 -18.105   4.952  -1.562
  390    HG2  GLN  49           HG2      GLN  49 -18.366   7.171  -2.345
  391    HG3  GLN  49           HG3      GLN  49 -16.810   7.055  -1.547
  392   HE21  GLN  49          HE21      GLN  49 -18.485   7.792  -4.411
  393   HE22  GLN  49          HE22      GLN  49 -17.098   8.215  -5.360
  394    H    ILE  50           H        ILE  50 -17.227   2.271  -2.268
  395    HA   ILE  50           HA       ILE  50 -17.205   1.656   0.477
  396    HB   ILE  50           HB       ILE  50 -17.488   0.016  -2.007
  397   HG12  ILE  50          HG12      ILE  50 -19.641  -0.594  -0.609
  398   HG13  ILE  50          HG13      ILE  50 -19.241   0.889   0.250
  399   HG21  ILE  50          HG21      ILE  50 -16.175  -1.435  -0.609
  400   HG22  ILE  50          HG22      ILE  50 -17.837  -2.021  -0.659
  401   HG23  ILE  50          HG23      ILE  50 -17.251  -1.149   0.759
  402   HD11  ILE  50          HD11      ILE  50 -19.259   2.064  -1.965
  403   HD12  ILE  50          HD12      ILE  50 -20.816   1.428  -1.435
  404   HD13  ILE  50          HD13      ILE  50 -19.892   0.569  -2.671
  405    H    ILE  51           H        ILE  51 -15.025   0.747  -2.138
  406    HA   ILE  51           HA       ILE  51 -13.299  -0.962  -0.813
  407    HB   ILE  51           HB       ILE  51 -12.638   1.019  -2.998
  408   HG12  ILE  51          HG12      ILE  51 -13.382  -1.909  -3.144
  409   HG13  ILE  51          HG13      ILE  51 -14.445  -0.568  -3.554
  410   HG21  ILE  51          HG21      ILE  51 -11.119  -1.437  -2.124
  411   HG22  ILE  51          HG22      ILE  51 -10.616   0.235  -1.872
  412   HG23  ILE  51          HG23      ILE  51 -10.728  -0.415  -3.507
  413   HD11  ILE  51          HD11      ILE  51 -13.506  -1.604  -5.537
  414   HD12  ILE  51          HD12      ILE  51 -11.876  -1.270  -4.952
  415   HD13  ILE  51          HD13      ILE  51 -12.953   0.063  -5.371
  416    H    HIS  52           H        HIS  52 -13.192   2.548  -1.056
  417    HA   HIS  52           HA       HIS  52 -10.645   2.879   0.058
  418    HB2  HIS  52           HB2      HIS  52 -12.921   4.637  -0.584
  419    HB3  HIS  52           HB3      HIS  52 -11.800   5.244   0.633
  420    HD1  HIS  52           HD1      HIS  52 -10.412   6.883  -0.593
  421    HD2  HIS  52           HD2      HIS  52 -10.875   3.332  -2.710
  422    HE1  HIS  52           HE1      HIS  52  -8.861   7.055  -2.558
  423    HE2  HIS  52           HE2      HIS  52  -9.082   4.864  -3.768
  424    H    HIS  53           H        HIS  53 -13.849   3.006   1.642
  425    HA   HIS  53           HA       HIS  53 -12.765   3.776   4.158
  426    HB2  HIS  53           HB2      HIS  53 -15.380   2.435   3.493
  427    HB3  HIS  53           HB3      HIS  53 -14.956   3.024   5.094
  428    HD1  HIS  53           HD1      HIS  53 -14.100   5.752   4.850
  429    HD2  HIS  53           HD2      HIS  53 -16.951   4.190   2.257
  430    HE1  HIS  53           HE1      HIS  53 -15.297   7.741   3.904
  431    HE2  HIS  53           HE2      HIS  53 -17.100   6.783   2.434
  432    H    LEU  54           H        LEU  54 -12.936   0.768   2.538
  433    HA   LEU  54           HA       LEU  54 -12.881  -0.881   4.889
  434    HB2  LEU  54           HB2      LEU  54 -12.398  -1.472   1.972
  435    HB3  LEU  54           HB3      LEU  54 -12.298  -2.697   3.221
  436    HG   LEU  54           HG       LEU  54 -14.779  -1.081   2.621
  437   HD11  LEU  54          HD11      LEU  54 -15.618  -3.111   1.558
  438   HD12  LEU  54          HD12      LEU  54 -14.068  -3.904   1.836
  439   HD13  LEU  54          HD13      LEU  54 -14.168  -2.524   0.743
  440   HD21  LEU  54          HD21      LEU  54 -14.386  -3.561   4.304
  441   HD22  LEU  54          HD22      LEU  54 -15.910  -2.721   4.019
  442   HD23  LEU  54          HD23      LEU  54 -14.625  -1.931   4.933
  443    H    VAL  55           H        VAL  55 -10.503  -0.031   2.386
  444    HA   VAL  55           HA       VAL  55  -8.366  -1.349   3.749
  445    HB   VAL  55           HB       VAL  55  -6.929  -0.568   2.043
  446   HG11  VAL  55          HG11      VAL  55  -8.497  -2.239   1.293
  447   HG12  VAL  55          HG12      VAL  55  -8.161  -1.108  -0.017
  448   HG13  VAL  55          HG13      VAL  55  -9.675  -0.993   0.880
  449   HG21  VAL  55          HG21      VAL  55  -7.479   1.799   2.092
  450   HG22  VAL  55          HG22      VAL  55  -9.030   1.471   1.319
  451   HG23  VAL  55          HG23      VAL  55  -7.529   1.183   0.440
  452    H    GLN  56           H        GLN  56  -9.764   1.793   3.856
  453    HA   GLN  56           HA       GLN  56  -7.552   3.025   5.223
  454    HB2  GLN  56           HB2      GLN  56 -10.335   3.865   4.498
  455    HB3  GLN  56           HB3      GLN  56  -9.413   4.810   5.644
  456    HG2  GLN  56           HG2      GLN  56  -7.635   5.070   3.928
  457    HG3  GLN  56           HG3      GLN  56  -8.664   4.203   2.788
  458   HE21  GLN  56          HE21      GLN  56 -10.551   5.174   2.063
  459   HE22  GLN  56          HE22      GLN  56 -10.800   6.883   2.152
  460    H    MET  57           H        MET  57 -10.222   1.059   6.115
  461    HA   MET  57           HA       MET  57 -10.241   2.026   8.855
  462    HB2  MET  57           HB2      MET  57 -12.300   1.181   7.534
  463    HB3  MET  57           HB3      MET  57 -11.687  -0.425   7.899
  464    HG2  MET  57           HG2      MET  57 -11.748   0.173  10.314
  465    HG3  MET  57           HG3      MET  57 -12.532   1.685   9.870
  466    HE1  MET  57           HE1      MET  57 -15.847   0.269   8.181
  467    HE2  MET  57           HE2      MET  57 -14.313   0.370   7.314
  468    HE3  MET  57           HE3      MET  57 -14.817   1.686   8.377
  469    H    GLY  58           H        GLY  58  -8.311   0.050   7.092
  470    HA2  GLY  58           HA2      GLY  58  -6.482  -1.157   7.828
  471    HA3  GLY  58           HA3      GLY  58  -7.063  -0.970   9.475
  472    H    LEU  59           H        LEU  59  -9.536  -2.142   7.574
  473    HA   LEU  59           HA       LEU  59  -9.114  -4.828   8.615
  474    HB2  LEU  59           HB2      LEU  59 -11.457  -5.227   7.909
  475    HB3  LEU  59           HB3      LEU  59 -11.275  -3.930   9.071
  476    HG   LEU  59           HG       LEU  59 -11.283  -2.410   6.934
  477   HD11  LEU  59          HD11      LEU  59 -12.830  -4.804   5.971
  478   HD12  LEU  59          HD12      LEU  59 -11.263  -4.286   5.346
  479   HD13  LEU  59          HD13      LEU  59 -12.676  -3.246   5.160
  480   HD21  LEU  59          HD21      LEU  59 -13.711  -2.211   7.141
  481   HD22  LEU  59          HD22      LEU  59 -12.913  -2.304   8.711
  482   HD23  LEU  59          HD23      LEU  59 -13.743  -3.717   8.060
  483    H    ALA  60           H        ALA  60  -8.946  -3.051   5.706
  484    HA   ALA  60           HA       ALA  60  -8.422  -5.555   4.237
  485    HB1  ALA  60           HB1      ALA  60  -9.323  -2.871   3.201
  486    HB2  ALA  60           HB2      ALA  60 -10.226  -4.385   3.173
  487    HB3  ALA  60           HB3      ALA  60  -8.782  -4.193   2.173
  488    H    ASP  61           H        ASP  61  -6.682  -5.362   2.603
  489    HA   ASP  61           HA       ASP  61  -4.370  -4.193   3.841
  490    HB2  ASP  61           HB2      ASP  61  -4.286  -6.396   2.711
  491    HB3  ASP  61           HB3      ASP  61  -4.602  -5.593   1.175
  492    H    SER  62           H        SER  62  -5.649  -3.920   0.514
  493    HA   SER  62           HA       SER  62  -5.271  -1.062   0.579
  494    HB2  SER  62           HB2      SER  62  -3.739  -1.049  -1.342
  495    HB3  SER  62           HB3      SER  62  -3.007  -1.793   0.076
  496    HG   SER  62           HG       SER  62  -3.961  -3.830  -0.989
  497    H    VAL  63           H        VAL  63  -5.617  -0.188  -1.729
  498    HA   VAL  63           HA       VAL  63  -8.176  -0.984  -2.606
  499    HB   VAL  63           HB       VAL  63  -6.109   0.877  -3.788
  500   HG11  VAL  63          HG11      VAL  63  -8.910   0.362  -4.784
  501   HG12  VAL  63          HG12      VAL  63  -7.405   0.031  -5.646
  502   HG13  VAL  63          HG13      VAL  63  -7.877   1.696  -5.298
  503   HG21  VAL  63          HG21      VAL  63  -8.722   1.333  -2.360
  504   HG22  VAL  63          HG22      VAL  63  -7.721   2.601  -3.069
  505   HG23  VAL  63          HG23      VAL  63  -7.103   1.636  -1.729
  506    H    LYS  64           H        LYS  64  -4.949  -1.828  -3.566
  507    HA   LYS  64           HA       LYS  64  -5.308  -2.692  -6.185
  508    HB2  LYS  64           HB2      LYS  64  -3.536  -4.091  -4.211
  509    HB3  LYS  64           HB3      LYS  64  -3.288  -3.888  -5.925
  510    HG2  LYS  64           HG2      LYS  64  -2.934  -1.493  -5.603
  511    HG3  LYS  64           HG3      LYS  64  -3.176  -1.702  -3.869
  512    HD2  LYS  64           HD2      LYS  64  -1.064  -3.235  -5.360
  513    HD3  LYS  64           HD3      LYS  64  -0.762  -1.612  -4.748
  514    HE2  LYS  64           HE2      LYS  64   0.062  -3.245  -3.173
  515    HE3  LYS  64           HE3      LYS  64  -1.307  -2.393  -2.475
  516    HZ1  LYS  64           HZ1      LYS  64  -1.616  -5.019  -3.797
  517    HZ2  LYS  64           HZ2      LYS  64  -2.669  -4.257  -2.711
  518    HZ3  LYS  64           HZ3      LYS  64  -1.201  -4.886  -2.165
  519    H    ASP  65           H        ASP  65  -5.847  -4.344  -3.144
  520    HA   ASP  65           HA       ASP  65  -6.181  -6.954  -4.137
  521    HB2  ASP  65           HB2      ASP  65  -7.348  -5.696  -1.652
  522    HB3  ASP  65           HB3      ASP  65  -7.187  -7.424  -1.949
  523    H    PHE  66           H        PHE  66  -8.231  -4.213  -4.069
  524    HA   PHE  66           HA       PHE  66 -10.610  -5.783  -4.763
  525    HB2  PHE  66           HB2      PHE  66 -10.271  -2.814  -4.260
  526    HB3  PHE  66           HB3      PHE  66 -11.800  -3.625  -4.561
  527    HD1  PHE  66           HD1      PHE  66 -13.107  -4.028  -2.749
  528    HD2  PHE  66           HD2      PHE  66  -8.891  -3.924  -2.228
  529    HE1  PHE  66           HE1      PHE  66 -13.401  -4.371  -0.332
  530    HE2  PHE  66           HE2      PHE  66  -9.174  -4.267   0.189
  531    HZ   PHE  66           HZ       PHE  66 -11.435  -4.487   1.143
  532    H    GLN  67           H        GLN  67  -8.614  -3.110  -5.893
  533    HA   GLN  67           HA       GLN  67  -9.223  -3.747  -8.665
  534    HB2  GLN  67           HB2      GLN  67  -9.739  -1.062  -7.373
  535    HB3  GLN  67           HB3      GLN  67  -9.593  -1.281  -9.117
  536    HG2  GLN  67           HG2      GLN  67 -11.472  -2.928  -8.975
  537    HG3  GLN  67           HG3      GLN  67 -11.678  -2.453  -7.286
  538   HE21  GLN  67          HE21      GLN  67 -13.753  -1.690  -7.679
  539   HE22  GLN  67          HE22      GLN  67 -14.042  -0.209  -8.522
  540    H    ARG  68           H        ARG  68  -7.199  -4.239  -9.233
  541    HA   ARG  68           HA       ARG  68  -4.853  -2.950  -8.399
  542    HB2  ARG  68           HB2      ARG  68  -5.472  -4.610 -10.835
  543    HB3  ARG  68           HB3      ARG  68  -3.858  -4.027 -10.459
  544    HG2  ARG  68           HG2      ARG  68  -5.398  -5.612  -8.450
  545    HG3  ARG  68           HG3      ARG  68  -4.533  -6.417  -9.761
  546    HD2  ARG  68           HD2      ARG  68  -3.315  -4.506  -7.770
  547    HD3  ARG  68           HD3      ARG  68  -3.180  -6.264  -7.716
  548    HE   ARG  68           HE       ARG  68  -2.307  -5.331 -10.225
  549   HH11  ARG  68          HH11      ARG  68  -1.293  -5.384  -6.874
  550   HH12  ARG  68          HH12      ARG  68   0.394  -5.285  -7.257
  551   HH21  ARG  68          HH21      ARG  68  -0.088  -5.229 -10.728
  552   HH22  ARG  68          HH22      ARG  68   1.080  -5.218  -9.446
  553    H    LYS  69           H        LYS  69  -5.456  -0.709  -8.587
  554    HA   LYS  69           HA       LYS  69  -4.436   0.337 -11.107
  555    HB2  LYS  69           HB2      LYS  69  -6.869   0.576 -11.340
  556    HB3  LYS  69           HB3      LYS  69  -6.947   1.395  -9.784
  557    HG2  LYS  69           HG2      LYS  69  -5.541   3.200 -10.683
  558    HG3  LYS  69           HG3      LYS  69  -5.538   2.396 -12.252
  559    HD2  LYS  69           HD2      LYS  69  -7.969   2.634 -12.378
  560    HD3  LYS  69           HD3      LYS  69  -7.973   3.429 -10.799
  561    HE2  LYS  69           HE2      LYS  69  -6.574   5.214 -11.688
  562    HE3  LYS  69           HE3      LYS  69  -6.538   4.420 -13.259
  563    HZ1  LYS  69           HZ1      LYS  69  -8.153   6.201 -13.207
  564    HZ2  LYS  69           HZ2      LYS  69  -8.959   5.475 -11.912
  565    HZ3  LYS  69           HZ3      LYS  69  -8.925   4.712 -13.420
  566    H    GLY  70           H        GLY  70  -5.719   1.352  -7.945
  567    HA2  GLY  70           HA2      GLY  70  -3.819   3.406  -7.531
  568    HA3  GLY  70           HA3      GLY  70  -4.799   2.640  -6.285
  569    H    THR  71           H        THR  71  -1.735   2.851  -7.755
  570    HA   THR  71           HA       THR  71  -0.504   0.478  -7.018
  571    HB   THR  71           HB       THR  71   1.611   1.938  -6.931
  572    HG1  THR  71           HG1      THR  71   1.300   4.025  -6.941
  573   HG21  THR  71          HG21      THR  71   1.617   2.262  -9.360
  574   HG22  THR  71          HG22      THR  71  -0.131   2.038  -9.401
  575   HG23  THR  71          HG23      THR  71   0.918   0.699  -8.936
  576    H    HIS  72           H        HIS  72   0.759  -0.142  -5.234
  577    HA   HIS  72           HA       HIS  72  -0.038   0.890  -2.687
  578    HB2  HIS  72           HB2      HIS  72   1.133  -0.870  -1.765
  579    HB3  HIS  72           HB3      HIS  72   0.952  -1.498  -3.396
  580    HD1  HIS  72           HD1      HIS  72   3.137  -1.033  -5.000
  581    HD2  HIS  72           HD2      HIS  72   3.695  -0.699  -0.901
  582    HE1  HIS  72           HE1      HIS  72   5.618  -1.083  -4.637
  583    HE2  HIS  72           HE2      HIS  72   5.885  -1.275  -2.152
  584    H    ILE  73           H        ILE  73   2.226   1.694  -5.030
  585    HA   ILE  73           HA       ILE  73   4.286   2.758  -3.467
  586    HB   ILE  73           HB       ILE  73   3.560   2.753  -6.301
  587   HG12  ILE  73          HG12      ILE  73   5.263   1.288  -5.321
  588   HG13  ILE  73          HG13      ILE  73   5.951   2.327  -6.565
  589   HG21  ILE  73          HG21      ILE  73   5.345   4.588  -6.723
  590   HG22  ILE  73          HG22      ILE  73   4.865   5.151  -5.121
  591   HG23  ILE  73          HG23      ILE  73   3.671   5.042  -6.407
  592   HD11  ILE  73          HD11      ILE  73   6.206   2.673  -3.586
  593   HD12  ILE  73          HD12      ILE  73   6.798   3.822  -4.784
  594   HD13  ILE  73          HD13      ILE  73   7.470   2.193  -4.718
  595    H    VAL  74           H        VAL  74   4.122   4.278  -2.114
  596    HA   VAL  74           HA       VAL  74   2.460   6.475  -1.956
  597    HB   VAL  74           HB       VAL  74   3.858   6.152  -0.099
  598   HG11  VAL  74          HG11      VAL  74   6.212   6.046  -1.992
  599   HG12  VAL  74          HG12      VAL  74   5.489   4.677  -1.150
  600   HG13  VAL  74          HG13      VAL  74   6.314   5.939  -0.235
  601   HG21  VAL  74          HG21      VAL  74   5.235   8.356  -1.633
  602   HG22  VAL  74          HG22      VAL  74   5.266   8.127   0.118
  603   HG23  VAL  74          HG23      VAL  74   3.754   8.537  -0.692
  604    H    LEU  75           H        LEU  75   2.423   8.460  -2.958
  605    HA   LEU  75           HA       LEU  75   3.296   8.775  -5.543
  606    HB2  LEU  75           HB2      LEU  75   3.007  11.270  -5.075
  607    HB3  LEU  75           HB3      LEU  75   1.620  10.228  -4.821
  608    HG   LEU  75           HG       LEU  75   2.910  10.317  -2.340
  609   HD11  LEU  75          HD11      LEU  75   4.231  12.210  -3.063
  610   HD12  LEU  75          HD12      LEU  75   3.040  12.716  -1.865
  611   HD13  LEU  75          HD13      LEU  75   2.774  13.062  -3.575
  612   HD21  LEU  75          HD21      LEU  75   0.521  11.876  -3.317
  613   HD22  LEU  75          HD22      LEU  75   0.908  11.508  -1.635
  614   HD23  LEU  75          HD23      LEU  75   0.501  10.206  -2.753
  615    H    TRP  76           H        TRP  76   5.381   8.359  -6.035
  616    HA   TRP  76           HA       TRP  76   7.518   9.624  -4.513
  617    HB2  TRP  76           HB2      TRP  76   7.395   7.430  -6.538
  618    HB3  TRP  76           HB3      TRP  76   8.908   8.299  -6.322
  619    HD1  TRP  76           HD1      TRP  76   6.581   5.866  -4.547
  620    HE1  TRP  76           HE1      TRP  76   7.845   4.772  -2.602
  621    HE3  TRP  76           HE3      TRP  76  10.790   8.720  -4.639
  622    HZ2  TRP  76           HZ2      TRP  76  10.305   5.079  -1.276
  623    HZ3  TRP  76           HZ3      TRP  76  12.556   8.258  -2.996
  624    HH2  TRP  76           HH2      TRP  76  12.319   6.482  -1.354
  625    H    THR  77           H        THR  77   7.927  11.646  -5.052
  626    HA   THR  77           HA       THR  77   7.860  12.466  -7.844
  627    HB   THR  77           HB       THR  77   8.314  14.730  -6.942
  628    HG1  THR  77           HG1      THR  77   8.450  15.031  -4.714
  629   HG21  THR  77          HG21      THR  77   6.169  14.999  -5.735
  630   HG22  THR  77          HG22      THR  77   6.055  13.243  -5.589
  631   HG23  THR  77          HG23      THR  77   6.004  14.000  -7.180
  632    H    GLY  78           H        GLY  78   9.793  13.810  -8.597
  633    HA2  GLY  78           HA2      GLY  78  12.119  12.257  -8.583
  634    HA3  GLY  78           HA3      GLY  78  12.036  13.939  -9.089
  635    H    ASP  79           H        ASP  79  11.147  14.935  -6.558
  636    HA   ASP  79           HA       ASP  79  13.570  15.385  -5.205
  637    HB2  ASP  79           HB2      ASP  79  10.749  15.643  -4.136
  638    HB3  ASP  79           HB3      ASP  79  12.185  16.382  -3.439
  639    H    GLN  80           H        GLN  80  10.776  13.371  -4.332
  640    HA   GLN  80           HA       GLN  80  11.837  12.289  -1.978
  641    HB2  GLN  80           HB2      GLN  80   9.744  11.289  -3.891
  642    HB3  GLN  80           HB3      GLN  80  10.168  10.410  -2.430
  643    HG2  GLN  80           HG2      GLN  80   9.537  12.344  -1.085
  644    HG3  GLN  80           HG3      GLN  80   9.113  13.223  -2.555
  645   HE21  GLN  80          HE21      GLN  80   8.491   9.810  -2.242
  646   HE22  GLN  80          HE22      GLN  80   6.769   9.944  -2.139
  647    H    GLU  81           H        GLU  81  11.975  11.139  -5.320
  648    HA   GLU  81           HA       GLU  81  13.209   8.677  -4.810
  649    HB2  GLU  81           HB2      GLU  81  13.445  10.484  -7.221
  650    HB3  GLU  81           HB3      GLU  81  14.012   8.818  -7.164
  651    HG2  GLU  81           HG2      GLU  81  11.711   8.076  -6.706
  652    HG3  GLU  81           HG3      GLU  81  11.165   9.745  -6.839
  653    H    LEU  82           H        LEU  82  14.597  11.860  -5.482
  654    HA   LEU  82           HA       LEU  82  17.298  11.100  -5.295
  655    HB2  LEU  82           HB2      LEU  82  16.644  13.169  -6.336
  656    HB3  LEU  82           HB3      LEU  82  15.929  13.748  -4.846
  657    HG   LEU  82           HG       LEU  82  18.824  13.118  -4.735
  658   HD11  LEU  82          HD11      LEU  82  18.631  14.184  -6.931
  659   HD12  LEU  82          HD12      LEU  82  19.436  15.241  -5.771
  660   HD13  LEU  82          HD13      LEU  82  17.750  15.523  -6.201
  661   HD21  LEU  82          HD21      LEU  82  18.824  15.194  -3.413
  662   HD22  LEU  82          HD22      LEU  82  17.657  14.019  -2.804
  663   HD23  LEU  82          HD23      LEU  82  17.105  15.397  -3.758
  664    H    GLU  83           H        GLU  83  14.947  12.082  -2.853
  665    HA   GLU  83           HA       GLU  83  16.620  12.507  -0.675
  666    HB2  GLU  83           HB2      GLU  83  13.891  11.215  -0.712
  667    HB3  GLU  83           HB3      GLU  83  14.721  11.738   0.743
  668    HG2  GLU  83           HG2      GLU  83  14.676  14.048  -0.113
  669    HG3  GLU  83           HG3      GLU  83  13.735  13.480  -1.497
  670    H    LEU  84           H        LEU  84  14.977   9.483  -1.578
  671    HA   LEU  84           HA       LEU  84  16.335   8.108   0.562
  672    HB2  LEU  84           HB2      LEU  84  13.913   7.764  -0.154
  673    HB3  LEU  84           HB3      LEU  84  14.549   6.873  -1.522
  674    HG   LEU  84           HG       LEU  84  15.409   6.038   1.210
  675   HD11  LEU  84          HD11      LEU  84  12.912   6.393   1.265
  676   HD12  LEU  84          HD12      LEU  84  13.463   4.757   1.609
  677   HD13  LEU  84          HD13      LEU  84  12.793   5.142   0.028
  678   HD21  LEU  84          HD21      LEU  84  16.346   4.961  -0.772
  679   HD22  LEU  84          HD22      LEU  84  14.722   4.535  -1.310
  680   HD23  LEU  84          HD23      LEU  84  15.372   3.833   0.171
  681    H    GLN  85           H        GLN  85  16.667   8.453  -2.886
  682    HA   GLN  85           HA       GLN  85  18.225   6.255  -3.559
  683    HB2  GLN  85           HB2      GLN  85  17.366   8.098  -5.069
  684    HB3  GLN  85           HB3      GLN  85  18.688   9.096  -4.498
  685    HG2  GLN  85           HG2      GLN  85  19.122   6.454  -5.845
  686    HG3  GLN  85           HG3      GLN  85  18.974   7.962  -6.736
  687   HE21  GLN  85          HE21      GLN  85  20.583   9.570  -6.422
  688   HE22  GLN  85          HE22      GLN  85  22.164   9.133  -5.876
  689    H    ARG  86           H        ARG  86  19.423   9.457  -2.610
  690    HA   ARG  86           HA       ARG  86  22.103   8.638  -2.288
  691    HB2  ARG  86           HB2      ARG  86  20.610  11.034  -1.225
  692    HB3  ARG  86           HB3      ARG  86  22.350  10.827  -1.097
  693    HG2  ARG  86           HG2      ARG  86  22.574  10.865  -3.498
  694    HG3  ARG  86           HG3      ARG  86  20.821  10.924  -3.686
  695    HD2  ARG  86           HD2      ARG  86  22.141  13.132  -3.856
  696    HD3  ARG  86           HD3      ARG  86  20.670  13.098  -2.886
  697    HE   ARG  86           HE       ARG  86  23.323  12.773  -1.636
  698   HH11  ARG  86          HH11      ARG  86  20.299  14.507  -1.944
  699   HH12  ARG  86          HH12      ARG  86  20.505  15.398  -0.472
  700   HH21  ARG  86          HH21      ARG  86  23.602  13.946   0.306
  701   HH22  ARG  86          HH22      ARG  86  22.399  15.097   0.797
  702    H    LEU  87           H        LEU  87  19.416   8.967  -0.041
  703    HA   LEU  87           HA       LEU  87  20.882   8.736   2.353
  704    HB2  LEU  87           HB2      LEU  87  18.430   9.470   1.901
  705    HB3  LEU  87           HB3      LEU  87  18.065   7.762   2.041
  706    HG   LEU  87           HG       LEU  87  19.179   7.854   4.328
  707   HD11  LEU  87          HD11      LEU  87  19.224  10.072   5.389
  708   HD12  LEU  87          HD12      LEU  87  18.860  10.809   3.829
  709   HD13  LEU  87          HD13      LEU  87  20.379   9.942   4.062
  710   HD21  LEU  87          HD21      LEU  87  16.770   7.707   4.002
  711   HD22  LEU  87          HD22      LEU  87  16.675   9.462   3.860
  712   HD23  LEU  87          HD23      LEU  87  17.165   8.725   5.385
  713    H    PHE  88           H        PHE  88  19.282   6.357   0.297
  714    HA   PHE  88           HA       PHE  88  19.631   4.083   1.846
  715    HB2  PHE  88           HB2      PHE  88  18.276   3.593   0.098
  716    HB3  PHE  88           HB3      PHE  88  19.099   4.702  -0.985
  717    HD1  PHE  88           HD1      PHE  88  20.454   3.898  -2.662
  718    HD2  PHE  88           HD2      PHE  88  19.447   1.339   0.589
  719    HE1  PHE  88           HE1      PHE  88  21.470   1.999  -3.848
  720    HE2  PHE  88           HE2      PHE  88  20.467  -0.563  -0.597
  721    HZ   PHE  88           HZ       PHE  88  21.483  -0.229  -2.809
  722    H    GLU  89           H        GLU  89  21.842   5.579  -0.487
  723    HA   GLU  89           HA       GLU  89  23.839   3.567  -0.250
  724    HB2  GLU  89           HB2      GLU  89  24.240   6.451  -1.000
  725    HB3  GLU  89           HB3      GLU  89  25.284   5.101  -1.402
  726    HG2  GLU  89           HG2      GLU  89  23.375   4.156  -2.721
  727    HG3  GLU  89           HG3      GLU  89  22.544   5.691  -2.456
  728    H    GLU  90           H        GLU  90  23.185   6.592   1.401
  729    HA   GLU  90           HA       GLU  90  25.647   6.947   2.674
  730    HB2  GLU  90           HB2      GLU  90  22.852   7.848   3.243
  731    HB3  GLU  90           HB3      GLU  90  24.145   8.215   4.380
  732    HG2  GLU  90           HG2      GLU  90  24.093   8.984   1.471
  733    HG3  GLU  90           HG3      GLU  90  23.724  10.052   2.824
  734    H    PHE  91           H        PHE  91  22.698   5.339   3.868
  735    HA   PHE  91           HA       PHE  91  24.246   4.414   6.182
  736    HB2  PHE  91           HB2      PHE  91  21.259   4.432   5.712
  737    HB3  PHE  91           HB3      PHE  91  22.045   3.830   7.167
  738    HD1  PHE  91           HD1      PHE  91  23.589   5.510   8.402
  739    HD2  PHE  91           HD2      PHE  91  20.594   6.632   5.596
  740    HE1  PHE  91           HE1      PHE  91  23.554   7.776   9.353
  741    HE2  PHE  91           HE2      PHE  91  20.552   8.901   6.545
  742    HZ   PHE  91           HZ       PHE  91  22.034   9.476   8.423
  743    H    ARG  92           H        ARG  92  24.008   3.321   3.271
  744    HA   ARG  92           HA       ARG  92  22.974   0.690   3.497
  745    HB2  ARG  92           HB2      ARG  92  23.229   1.722   1.338
  746    HB3  ARG  92           HB3      ARG  92  24.961   1.909   1.577
  747    HG2  ARG  92           HG2      ARG  92  25.338  -0.402   1.344
  748    HG3  ARG  92           HG3      ARG  92  23.624  -0.771   1.494
  749    HD2  ARG  92           HD2      ARG  92  23.282   0.586  -0.612
  750    HD3  ARG  92           HD3      ARG  92  25.034   0.598  -0.784
  751    HE   ARG  92           HE       ARG  92  23.911  -2.039  -0.493
  752   HH11  ARG  92          HH11      ARG  92  24.690   0.516  -2.769
  753   HH12  ARG  92          HH12      ARG  92  24.801  -0.558  -4.125
  754   HH21  ARG  92          HH21      ARG  92  24.052  -3.450  -2.294
  755   HH22  ARG  92          HH22      ARG  92  24.453  -2.805  -3.857
  756    H    ASP  93           H        ASP  93  25.747   2.144   4.677
  757    HA   ASP  93           HA       ASP  93  27.402  -0.220   4.678
  758    HB2  ASP  93           HB2      ASP  93  28.328   2.033   4.322
  759    HB3  ASP  93           HB3      ASP  93  27.852   2.481   5.958
  760    H    SER  94           H        SER  94  24.783   0.493   6.392
  761    HA   SER  94           HA       SER  94  25.874  -0.661   8.865
  762    HB2  SER  94           HB2      SER  94  23.850   0.206  10.003
  763    HB3  SER  94           HB3      SER  94  24.815   1.488   9.278
  764    HG   SER  94           HG       SER  94  23.241   1.065   7.394
  765    H    ASP  95           H        ASP  95  24.043  -1.963  10.049
  766    HA   ASP  95           HA       ASP  95  23.636  -4.289   8.530
  767    HB2  ASP  95           HB2      ASP  95  23.833  -4.373  10.945
  768    HB3  ASP  95           HB3      ASP  95  22.371  -3.414  11.130
  769    H    ASP  96           H        ASP  96  21.353  -1.797   9.583
  770    HA   ASP  96           HA       ASP  96  19.503  -2.719   7.486
  771    HB2  ASP  96           HB2      ASP  96  18.604  -3.362   9.662
  772    HB3  ASP  96           HB3      ASP  96  18.804  -1.716  10.253
  773    H    VAL  97           H        VAL  97  19.857  -1.206   5.974
  774    HA   VAL  97           HA       VAL  97  20.429   1.503   6.616
  775    HB   VAL  97           HB       VAL  97  21.358   0.653   4.589
  776   HG11  VAL  97          HG11      VAL  97  20.076  -0.066   2.679
  777   HG12  VAL  97          HG12      VAL  97  18.568   0.225   3.547
  778   HG13  VAL  97          HG13      VAL  97  19.658  -1.053   4.084
  779   HG21  VAL  97          HG21      VAL  97  20.838   2.998   4.531
  780   HG22  VAL  97          HG22      VAL  97  19.197   2.657   3.988
  781   HG23  VAL  97          HG23      VAL  97  20.566   2.303   2.935
  782    H    LEU  98           H        LEU  98  17.490  -0.234   5.749
  783    HA   LEU  98           HA       LEU  98  15.994   2.082   5.087
  784    HB2  LEU  98           HB2      LEU  98  15.063  -0.661   5.902
  785    HB3  LEU  98           HB3      LEU  98  13.996   0.610   5.343
  786    HG   LEU  98           HG       LEU  98  15.590   0.582   3.243
  787   HD11  LEU  98          HD11      LEU  98  16.388  -1.645   2.717
  788   HD12  LEU  98          HD12      LEU  98  15.855  -2.227   4.294
  789   HD13  LEU  98          HD13      LEU  98  17.156  -1.041   4.186
  790   HD21  LEU  98          HD21      LEU  98  13.482  -1.508   3.759
  791   HD22  LEU  98          HD22      LEU  98  14.059  -0.990   2.176
  792   HD23  LEU  98          HD23      LEU  98  13.196   0.144   3.215
  793    H    GLY  99           H        GLY  99  16.548   0.351   8.085
  794    HA2  GLY  99           HA2      GLY  99  14.622   1.661   9.669
  795    HA3  GLY  99           HA3      GLY  99  16.131   0.971  10.262
  796    H    HIS 100           H        HIS 100  17.873   2.565   8.714
  797    HA   HIS 100           HA       HIS 100  17.886   4.926  10.355
  798    HB2  HIS 100           HB2      HIS 100  19.790   3.975   8.200
  799    HB3  HIS 100           HB3      HIS 100  20.047   5.402   9.199
  800    HD1  HIS 100           HD1      HIS 100  21.647   2.479   9.043
  801    HD2  HIS 100           HD2      HIS 100  19.309   4.038  12.108
  802    HE1  HIS 100           HE1      HIS 100  22.422   1.340  11.138
  803    HE2  HIS 100           HE2      HIS 100  20.920   2.207  12.955
  804    H    ILE 101           H        ILE 101  17.179   4.022   7.068
  805    HA   ILE 101           HA       ILE 101  16.922   6.534   5.894
  806    HB   ILE 101           HB       ILE 101  15.393   3.971   5.430
  807   HG12  ILE 101          HG12      ILE 101  17.523   5.427   3.838
  808   HG13  ILE 101          HG13      ILE 101  17.758   3.966   4.790
  809   HG21  ILE 101          HG21      ILE 101  14.487   4.965   3.385
  810   HG22  ILE 101          HG22      ILE 101  15.187   6.521   3.827
  811   HG23  ILE 101          HG23      ILE 101  13.919   5.811   4.824
  812   HD11  ILE 101          HD11      ILE 101  17.629   3.424   2.447
  813   HD12  ILE 101          HD12      ILE 101  16.069   4.234   2.314
  814   HD13  ILE 101          HD13      ILE 101  16.221   2.772   3.285
  815    H    MET 102           H        MET 102  14.415   4.583   7.511
  816    HA   MET 102           HA       MET 102  12.327   6.381   7.248
  817    HB2  MET 102           HB2      MET 102  12.851   4.351   9.408
  818    HB3  MET 102           HB3      MET 102  11.336   5.230   9.234
  819    HG2  MET 102           HG2      MET 102  11.045   4.285   7.005
  820    HG3  MET 102           HG3      MET 102  12.554   3.392   7.185
  821    HE1  MET 102           HE1      MET 102   9.407   0.905   7.372
  822    HE2  MET 102           HE2      MET 102  10.736   1.454   6.350
  823    HE3  MET 102           HE3      MET 102   9.349   2.509   6.632
  824    H    LYS 103           H        LYS 103  14.771   6.204   9.783
  825    HA   LYS 103           HA       LYS 103  13.548   8.227  11.393
  826    HB2  LYS 103           HB2      LYS 103  16.169   6.793  11.455
  827    HB3  LYS 103           HB3      LYS 103  15.985   8.266  12.398
  828    HG2  LYS 103           HG2      LYS 103  15.532   6.366  13.789
  829    HG3  LYS 103           HG3      LYS 103  14.036   7.263  13.530
  830    HD2  LYS 103           HD2      LYS 103  13.430   5.638  11.760
  831    HD3  LYS 103           HD3      LYS 103  14.885   4.718  12.148
  832    HE2  LYS 103           HE2      LYS 103  12.574   5.286  14.001
  833    HE3  LYS 103           HE3      LYS 103  12.942   3.743  13.234
  834    HZ1  LYS 103           HZ1      LYS 103  15.074   3.757  14.451
  835    HZ2  LYS 103           HZ2      LYS 103  13.728   3.707  15.469
  836    HZ3  LYS 103           HZ3      LYS 103  14.576   5.153  15.268
  837    H    ASN 104           H        ASN 104  15.689   8.310   8.661
  838    HA   ASN 104           HA       ASN 104  16.301  11.134   9.250
  839    HB2  ASN 104           HB2      ASN 104  17.697   9.106   7.522
  840    HB3  ASN 104           HB3      ASN 104  18.029  10.829   7.383
  841   HD21  ASN 104          HD21      ASN 104  18.336   7.999   9.354
  842   HD22  ASN 104          HD22      ASN 104  19.449   8.670  10.502
  843    H    ILE 105           H        ILE 105  14.144   9.386   7.445
  844    HA   ILE 105           HA       ILE 105  14.203  11.235   5.184
  845    HB   ILE 105           HB       ILE 105  14.048   8.827   4.700
  846   HG12  ILE 105          HG12      ILE 105  12.123   8.964   3.109
  847   HG13  ILE 105          HG13      ILE 105  11.675  10.489   3.867
  848   HG21  ILE 105          HG21      ILE 105  12.684   8.209   6.655
  849   HG22  ILE 105          HG22      ILE 105  12.035   7.577   5.141
  850   HG23  ILE 105          HG23      ILE 105  11.295   8.988   5.899
  851   HD11  ILE 105          HD11      ILE 105  14.265   9.932   2.445
  852   HD12  ILE 105          HD12      ILE 105  13.795  11.461   3.186
  853   HD13  ILE 105          HD13      ILE 105  12.900  10.842   1.800
  854    H    THR 106           H        THR 106  12.426  12.380   4.518
  855    HA   THR 106           HA       THR 106  11.036  13.669   6.591
  856    HB   THR 106           HB       THR 106  11.815  14.584   4.347
  857    HG1  THR 106           HG1      THR 106  10.175  16.148   4.371
  858   HG21  THR 106          HG21      THR 106  10.781  12.931   2.885
  859   HG22  THR 106          HG22      THR 106  10.194  14.551   2.511
  860   HG23  THR 106          HG23      THR 106   9.181  13.437   3.427
  861    H    ALA 107           H        ALA 107  10.097  11.139   4.323
  862    HA   ALA 107           HA       ALA 107   7.399  11.105   5.512
  863    HB1  ALA 107           HB1      ALA 107   6.636  10.012   3.479
  864    HB2  ALA 107           HB2      ALA 107   8.277  10.023   2.838
  865    HB3  ALA 107           HB3      ALA 107   7.420  11.545   3.091
  866    H    LYS 108           H        LYS 108   6.847   9.353   6.685
  867    HA   LYS 108           HA       LYS 108   8.728   7.188   6.943
  868    HB2  LYS 108           HB2      LYS 108   6.032   7.740   8.175
  869    HB3  LYS 108           HB3      LYS 108   6.838   6.196   8.394
  870    HG2  LYS 108           HG2      LYS 108   7.269   7.566  10.306
  871    HG3  LYS 108           HG3      LYS 108   8.767   7.394   9.394
  872    HD2  LYS 108           HD2      LYS 108   7.106   9.732   8.704
  873    HD3  LYS 108           HD3      LYS 108   7.816   9.746  10.319
  874    HE2  LYS 108           HE2      LYS 108   9.550   9.033   8.004
  875    HE3  LYS 108           HE3      LYS 108   9.102  10.727   8.229
  876    HZ1  LYS 108           HZ1      LYS 108  11.185  10.244   9.318
  877    HZ2  LYS 108           HZ2      LYS 108  10.476   9.004  10.224
  878    HZ3  LYS 108           HZ3      LYS 108  10.012  10.610  10.480
  879    H    ARG 109           H        ARG 109   8.895   5.922   5.231
  880    HA   ARG 109           HA       ARG 109   6.446   5.052   3.859
  881    HB2  ARG 109           HB2      ARG 109   9.288   5.082   2.808
  882    HB3  ARG 109           HB3      ARG 109   7.837   4.703   1.887
  883    HG2  ARG 109           HG2      ARG 109   7.055   6.962   2.076
  884    HG3  ARG 109           HG3      ARG 109   8.370   7.371   3.176
  885    HD2  ARG 109           HD2      ARG 109   9.962   6.786   1.303
  886    HD3  ARG 109           HD3      ARG 109   8.551   6.703   0.247
  887    HE   ARG 109           HE       ARG 109   8.135   9.089   1.065
  888   HH11  ARG 109          HH11      ARG 109  11.330   7.740   0.572
  889   HH12  ARG 109          HH12      ARG 109  12.074   9.282   0.304
  890   HH21  ARG 109          HH21      ARG 109   9.123  11.120   0.724
  891   HH22  ARG 109          HH22      ARG 109  10.833  11.222   0.408
  892    H    SER 110           H        SER 110   5.890   3.009   4.065
  893    HA   SER 110           HA       SER 110   7.115   1.231   5.784
  894    HB2  SER 110           HB2      SER 110   5.416   0.314   3.483
  895    HB3  SER 110           HB3      SER 110   5.437  -0.275   5.146
  896    HG   SER 110           HG       SER 110   3.863   1.064   5.477
  897    H    ARG 111           H        ARG 111   8.085  -0.844   5.364
  898    HA   ARG 111           HA       ARG 111  10.414  -0.634   3.866
  899    HB2  ARG 111           HB2      ARG 111   9.016  -3.073   4.958
  900    HB3  ARG 111           HB3      ARG 111  10.648  -3.088   4.301
  901    HG2  ARG 111           HG2      ARG 111   9.803  -1.341   6.595
  902    HG3  ARG 111           HG3      ARG 111  10.500  -2.946   6.795
  903    HD2  ARG 111           HD2      ARG 111  12.512  -2.243   5.641
  904    HD3  ARG 111           HD3      ARG 111  11.811  -0.653   5.349
  905    HE   ARG 111           HE       ARG 111  11.806  -0.383   7.816
  906   HH11  ARG 111          HH11      ARG 111  14.007  -2.647   6.303
  907   HH12  ARG 111          HH12      ARG 111  15.200  -2.523   7.561
  908   HH21  ARG 111          HH21      ARG 111  13.326  -0.293   9.517
  909   HH22  ARG 111          HH22      ARG 111  14.803  -1.214   9.401
  910    H    ALA 112           H        ALA 112   7.424  -2.381   3.092
  911    HA   ALA 112           HA       ALA 112   8.390  -3.682   0.812
  912    HB1  ALA 112           HB1      ALA 112   6.078  -4.134   0.276
  913    HB2  ALA 112           HB2      ALA 112   5.550  -2.884   1.399
  914    HB3  ALA 112           HB3      ALA 112   6.353  -4.330   2.006
  915    H    ARG 113           H        ARG 113   7.209  -0.406   1.204
  916    HA   ARG 113           HA       ARG 113   6.947  -0.108  -1.674
  917    HB2  ARG 113           HB2      ARG 113   6.194   2.175  -1.223
  918    HB3  ARG 113           HB3      ARG 113   5.277   0.992  -0.307
  919    HG2  ARG 113           HG2      ARG 113   6.772   1.508   1.640
  920    HG3  ARG 113           HG3      ARG 113   7.397   2.858   0.692
  921    HD2  ARG 113           HD2      ARG 113   5.658   3.647   2.166
  922    HD3  ARG 113           HD3      ARG 113   5.105   3.738   0.498
  923    HE   ARG 113           HE       ARG 113   4.361   1.319   1.891
  924   HH11  ARG 113          HH11      ARG 113   3.415   4.590   1.065
  925   HH12  ARG 113          HH12      ARG 113   1.727   4.304   1.329
  926   HH21  ARG 113          HH21      ARG 113   2.142   0.954   2.269
  927   HH22  ARG 113          HH22      ARG 113   1.005   2.240   2.024
  928    H    ILE 114           H        ILE 114   9.215   0.735   0.864
  929    HA   ILE 114           HA       ILE 114  10.889   2.355  -0.745
  930    HB   ILE 114           HB       ILE 114  11.619   0.642   1.636
  931   HG12  ILE 114          HG12      ILE 114  10.978   3.587   1.401
  932   HG13  ILE 114          HG13      ILE 114   9.973   2.366   2.172
  933   HG21  ILE 114          HG21      ILE 114  13.626   2.068   1.792
  934   HG22  ILE 114          HG22      ILE 114  13.181   2.831   0.266
  935   HG23  ILE 114          HG23      ILE 114  13.590   1.116   0.305
  936   HD11  ILE 114          HD11      ILE 114  11.655   2.017   3.882
  937   HD12  ILE 114          HD12      ILE 114  11.194   3.719   3.800
  938   HD13  ILE 114          HD13      ILE 114  12.719   3.183   3.095
  939    H    VAL 115           H        VAL 115  11.088  -1.092   0.155
  940    HA   VAL 115           HA       VAL 115  13.464  -1.609  -1.228
  941    HB   VAL 115           HB       VAL 115  12.911  -3.997  -1.044
  942   HG11  VAL 115          HG11      VAL 115  13.914  -2.820   0.849
  943   HG12  VAL 115          HG12      VAL 115  12.837  -4.107   1.390
  944   HG13  VAL 115          HG13      VAL 115  12.304  -2.428   1.458
  945   HG21  VAL 115          HG21      VAL 115  10.520  -3.912  -1.466
  946   HG22  VAL 115          HG22      VAL 115  10.270  -3.036   0.045
  947   HG23  VAL 115          HG23      VAL 115  10.848  -4.701   0.076
  948    H    ASP 116           H        ASP 116  10.106  -1.790  -2.320
  949    HA   ASP 116           HA       ASP 116  10.776  -3.022  -4.812
  950    HB2  ASP 116           HB2      ASP 116   8.516  -3.176  -3.812
  951    HB3  ASP 116           HB3      ASP 116   8.300  -1.449  -4.081
  952    H    LYS 117           H        LYS 117  10.580   0.263  -3.637
  953    HA   LYS 117           HA       LYS 117  10.539   1.538  -6.172
  954    HB2  LYS 117           HB2      LYS 117   9.922   2.604  -3.965
  955    HB3  LYS 117           HB3      LYS 117  11.642   2.685  -3.606
  956    HG2  LYS 117           HG2      LYS 117  10.950   4.809  -4.435
  957    HG3  LYS 117           HG3      LYS 117  11.947   4.039  -5.667
  958    HD2  LYS 117           HD2      LYS 117   9.796   3.259  -6.748
  959    HD3  LYS 117           HD3      LYS 117   8.943   4.322  -5.618
  960    HE2  LYS 117           HE2      LYS 117  10.109   6.248  -6.500
  961    HE3  LYS 117           HE3      LYS 117  11.080   5.219  -7.551
  962    HZ1  LYS 117           HZ1      LYS 117   9.052   4.573  -8.708
  963    HZ2  LYS 117           HZ2      LYS 117   9.290   6.242  -8.778
  964    HZ3  LYS 117           HZ3      LYS 117   8.138   5.597  -7.723
  965    H    LEU 118           H        LEU 118  13.112   0.483  -4.006
  966    HA   LEU 118           HA       LEU 118  15.305   1.579  -5.362
  967    HB2  LEU 118           HB2      LEU 118  14.876  -0.648  -3.478
  968    HB3  LEU 118           HB3      LEU 118  16.330  -0.739  -4.446
  969    HG   LEU 118           HG       LEU 118  16.945   1.538  -3.620
  970   HD11  LEU 118          HD11      LEU 118  15.833   2.354  -1.596
  971   HD12  LEU 118          HD12      LEU 118  14.628   1.075  -1.755
  972   HD13  LEU 118          HD13      LEU 118  14.747   2.334  -2.984
  973   HD21  LEU 118          HD21      LEU 118  17.873  -0.525  -2.696
  974   HD22  LEU 118          HD22      LEU 118  16.549  -0.582  -1.525
  975   HD23  LEU 118          HD23      LEU 118  17.718   0.739  -1.473
  976    H    LEU 119           H        LEU 119  13.631  -1.498  -5.808
  977    HA   LEU 119           HA       LEU 119  15.336  -2.493  -7.842
  978    HB2  LEU 119           HB2      LEU 119  12.576  -3.130  -6.883
  979    HB3  LEU 119           HB3      LEU 119  13.145  -3.833  -8.384
  980    HG   LEU 119           HG       LEU 119  13.429  -5.354  -6.451
  981   HD11  LEU 119          HD11      LEU 119  14.853  -5.537  -8.427
  982   HD12  LEU 119          HD12      LEU 119  15.709  -6.004  -6.959
  983   HD13  LEU 119          HD13      LEU 119  16.014  -4.431  -7.693
  984   HD21  LEU 119          HD21      LEU 119  13.898  -3.734  -4.696
  985   HD22  LEU 119          HD22      LEU 119  15.411  -3.287  -5.485
  986   HD23  LEU 119          HD23      LEU 119  15.210  -4.906  -4.816
  987    H    ALA 120           H        ALA 120  12.672  -0.327  -7.788
  988    HA   ALA 120           HA       ALA 120  12.080  -0.425 -10.582
  989    HB1  ALA 120           HB1      ALA 120  11.382   1.711  -8.580
  990    HB2  ALA 120           HB2      ALA 120  10.474   0.217  -8.815
  991    HB3  ALA 120           HB3      ALA 120  10.591   1.397 -10.127
  992    H    LEU 121           H        LEU 121  13.895   1.784  -8.477
  993    HA   LEU 121           HA       LEU 121  14.859   3.479 -10.537
  994    HB2  LEU 121           HB2      LEU 121  15.642   2.881  -7.723
  995    HB3  LEU 121           HB3      LEU 121  16.780   3.741  -8.737
  996    HG   LEU 121           HG       LEU 121  15.166   5.533  -9.067
  997   HD11  LEU 121          HD11      LEU 121  13.089   4.327  -8.963
  998   HD12  LEU 121          HD12      LEU 121  13.096   5.585  -7.726
  999   HD13  LEU 121          HD13      LEU 121  13.384   3.904  -7.279
 1000   HD21  LEU 121          HD21      LEU 121  16.700   5.713  -7.222
 1001   HD22  LEU 121          HD22      LEU 121  15.640   4.743  -6.201
 1002   HD23  LEU 121          HD23      LEU 121  15.131   6.352  -6.725
 1003    H    GLY 122           H        GLY 122  15.729   0.319  -9.483
 1004    HA2  GLY 122           HA2      GLY 122  17.319  -1.142 -10.308
 1005    HA3  GLY 122           HA3      GLY 122  17.828   0.108 -11.440
 1006    H    LEU 123           H        LEU 123  17.592   0.484  -7.952
 1007    HA   LEU 123           HA       LEU 123  20.330   1.387  -7.816
 1008    HB2  LEU 123           HB2      LEU 123  18.178   1.029  -5.737
 1009    HB3  LEU 123           HB3      LEU 123  19.798   1.575  -5.345
 1010    HG   LEU 123           HG       LEU 123  17.825   3.005  -7.125
 1011   HD11  LEU 123          HD11      LEU 123  17.868   4.693  -5.326
 1012   HD12  LEU 123          HD12      LEU 123  18.856   3.599  -4.358
 1013   HD13  LEU 123          HD13      LEU 123  17.210   3.146  -4.800
 1014   HD21  LEU 123          HD21      LEU 123  19.481   4.825  -7.120
 1015   HD22  LEU 123          HD22      LEU 123  20.090   3.373  -7.911
 1016   HD23  LEU 123          HD23      LEU 123  20.616   3.772  -6.276
 1017    H    VAL 124           H        VAL 124  18.506  -1.452  -7.092
 1018    HA   VAL 124           HA       VAL 124  20.994  -2.825  -6.342
 1019    HB   VAL 124           HB       VAL 124  19.736  -4.174  -4.685
 1020   HG11  VAL 124          HG11      VAL 124  19.771  -1.208  -4.151
 1021   HG12  VAL 124          HG12      VAL 124  21.134  -2.311  -3.966
 1022   HG13  VAL 124          HG13      VAL 124  19.719  -2.476  -2.927
 1023   HG21  VAL 124          HG21      VAL 124  17.588  -3.268  -3.842
 1024   HG22  VAL 124          HG22      VAL 124  17.493  -3.872  -5.495
 1025   HG23  VAL 124          HG23      VAL 124  17.578  -2.138  -5.196
 1026    H    ALA 125           H        ALA 125  20.750  -5.186  -6.385
 1027    HA   ALA 125           HA       ALA 125  19.530  -6.041  -8.856
 1028    HB1  ALA 125           HB1      ALA 125  21.773  -6.812  -8.087
 1029    HB2  ALA 125           HB2      ALA 125  20.660  -8.127  -8.454
 1030    HB3  ALA 125           HB3      ALA 125  20.971  -7.681  -6.775
 1031    H    GLU 126           H        GLU 126  18.968  -6.241  -5.472
 1032    HA   GLU 126           HA       GLU 126  16.382  -7.370  -5.653
 1033    HB2  GLU 126           HB2      GLU 126  17.037  -9.490  -4.392
 1034    HB3  GLU 126           HB3      GLU 126  17.442  -9.450  -6.104
 1035    HG2  GLU 126           HG2      GLU 126  19.739  -8.839  -5.543
 1036    HG3  GLU 126           HG3      GLU 126  19.333  -8.874  -3.837
 1037    H    ARG 127           H        ARG 127  15.806  -8.150  -3.241
 1038    HA   ARG 127           HA       ARG 127  16.208  -5.862  -1.623
 1039    HB2  ARG 127           HB2      ARG 127  14.938  -8.530  -1.143
 1040    HB3  ARG 127           HB3      ARG 127  15.198  -7.428   0.199
 1041    HG2  ARG 127           HG2      ARG 127  12.994  -7.072  -0.530
 1042    HG3  ARG 127           HG3      ARG 127  13.927  -5.703  -1.114
 1043    HD2  ARG 127           HD2      ARG 127  14.003  -6.627  -3.327
 1044    HD3  ARG 127           HD3      ARG 127  13.243  -8.120  -2.776
 1045    HE   ARG 127           HE       ARG 127  11.448  -6.194  -2.112
 1046   HH11  ARG 127          HH11      ARG 127  13.006  -7.137  -5.110
 1047   HH12  ARG 127          HH12      ARG 127  11.702  -6.569  -6.106
 1048   HH21  ARG 127          HH21      ARG 127   9.720  -5.487  -3.430
 1049   HH22  ARG 127          HH22      ARG 127   9.838  -5.639  -5.153
 1050    H    ARG 128           H        ARG 128  17.985  -8.748  -2.020
 1051    HA   ARG 128           HA       ARG 128  19.214  -9.066   0.462
 1052    HB2  ARG 128           HB2      ARG 128  19.340 -10.719  -1.312
 1053    HB3  ARG 128           HB3      ARG 128  20.262  -9.610  -2.313
 1054    HG2  ARG 128           HG2      ARG 128  22.021  -9.642  -0.508
 1055    HG3  ARG 128           HG3      ARG 128  21.134 -10.997   0.196
 1056    HD2  ARG 128           HD2      ARG 128  22.516 -10.834  -2.466
 1057    HD3  ARG 128           HD3      ARG 128  22.801 -11.971  -1.151
 1058    HE   ARG 128           HE       ARG 128  20.309 -11.975  -2.751
 1059   HH11  ARG 128          HH11      ARG 128  22.988 -13.677  -1.258
 1060   HH12  ARG 128          HH12      ARG 128  22.429 -15.242  -1.752
 1061   HH21  ARG 128          HH21      ARG 128  19.586 -14.027  -3.404
 1062   HH22  ARG 128          HH22      ARG 128  20.502 -15.441  -2.984
 1063    H    GLU 129           H        GLU 129  19.971  -6.915  -2.206
 1064    HA   GLU 129           HA       GLU 129  22.644  -6.383  -1.389
 1065    HB2  GLU 129           HB2      GLU 129  20.935  -4.759  -3.265
 1066    HB3  GLU 129           HB3      GLU 129  22.690  -4.788  -3.188
 1067    HG2  GLU 129           HG2      GLU 129  20.921  -7.085  -3.995
 1068    HG3  GLU 129           HG3      GLU 129  21.855  -6.063  -5.086
 1069    H    LEU 130           H        LEU 130  19.725  -5.270  -0.156
 1070    HA   LEU 130           HA       LEU 130  20.972  -2.784   0.792
 1071    HB2  LEU 130           HB2      LEU 130  18.459  -2.389   1.555
 1072    HB3  LEU 130           HB3      LEU 130  19.042  -1.958  -0.036
 1073    HG   LEU 130           HG       LEU 130  17.808  -4.654   0.348
 1074   HD11  LEU 130          HD11      LEU 130  15.608  -3.642  -0.186
 1075   HD12  LEU 130          HD12      LEU 130  16.310  -2.052   0.109
 1076   HD13  LEU 130          HD13      LEU 130  16.204  -3.228   1.420
 1077   HD21  LEU 130          HD21      LEU 130  18.814  -4.129  -1.794
 1078   HD22  LEU 130          HD22      LEU 130  17.872  -2.640  -1.899
 1079   HD23  LEU 130          HD23      LEU 130  17.059  -4.202  -1.965
 1080    H    TYR 131           H        TYR 131  20.936  -5.761   1.794
 1081    HA   TYR 131           HA       TYR 131  20.770  -4.930   4.610
 1082    HB2  TYR 131           HB2      TYR 131  19.844  -7.602   3.523
 1083    HB3  TYR 131           HB3      TYR 131  19.927  -7.168   5.227
 1084    HD1  TYR 131           HD1      TYR 131  18.577  -4.969   5.850
 1085    HD2  TYR 131           HD2      TYR 131  17.826  -7.398   2.446
 1086    HE1  TYR 131           HE1      TYR 131  16.287  -4.085   5.730
 1087    HE2  TYR 131           HE2      TYR 131  15.541  -6.523   2.306
 1088    HH   TYR 131           HH       TYR 131  13.870  -5.464   3.821
 1089    H    LYS 132           H        LYS 132  22.835  -4.900   5.243
 1090    HA   LYS 132           HA       LYS 132  24.847  -6.383   3.917
 1091    HB2  LYS 132           HB2      LYS 132  24.818  -4.602   6.310
 1092    HB3  LYS 132           HB3      LYS 132  26.222  -5.620   6.017
 1093    HG2  LYS 132           HG2      LYS 132  26.130  -4.613   3.624
 1094    HG3  LYS 132           HG3      LYS 132  25.156  -3.356   4.392
 1095    HD2  LYS 132           HD2      LYS 132  26.913  -2.724   5.825
 1096    HD3  LYS 132           HD3      LYS 132  27.823  -4.199   5.490
 1097    HE2  LYS 132           HE2      LYS 132  28.029  -3.411   3.115
 1098    HE3  LYS 132           HE3      LYS 132  27.337  -1.875   3.635
 1099    HZ1  LYS 132           HZ1      LYS 132  29.802  -1.925   3.561
 1100    HZ2  LYS 132           HZ2      LYS 132  29.787  -3.063   4.811
 1101    HZ3  LYS 132           HZ3      LYS 132  29.182  -1.506   5.078
 1102    H    LYS 133           H        LYS 133  25.085  -8.419   4.031
 1103    HA   LYS 133           HA       LYS 133  25.159  -9.743   6.647
 1104    HB2  LYS 133           HB2      LYS 133  24.037 -10.841   4.064
 1105    HB3  LYS 133           HB3      LYS 133  24.347 -11.811   5.492
 1106    HG2  LYS 133           HG2      LYS 133  22.716 -10.425   6.737
 1107    HG3  LYS 133           HG3      LYS 133  22.348  -9.577   5.232
 1108    HD2  LYS 133           HD2      LYS 133  21.615 -11.640   4.204
 1109    HD3  LYS 133           HD3      LYS 133  22.090 -12.556   5.633
 1110    HE2  LYS 133           HE2      LYS 133  20.426 -11.321   6.954
 1111    HE3  LYS 133           HE3      LYS 133  19.929 -10.459   5.496
 1112    HZ1  LYS 133           HZ1      LYS 133  19.763 -13.393   5.925
 1113    HZ2  LYS 133           HZ2      LYS 133  19.319 -12.590   4.508
 1114    HZ3  LYS 133           HZ3      LYS 133  18.461 -12.316   5.938
 1115    H    ARG 134           H        ARG 134  26.458 -11.854   6.424
 1116    HA   ARG 134           HA       ARG 134  28.918 -11.378   5.128
 1117    HB2  ARG 134           HB2      ARG 134  29.638 -13.499   5.890
 1118    HB3  ARG 134           HB3      ARG 134  28.596 -12.853   7.141
 1119    HG2  ARG 134           HG2      ARG 134  27.768 -14.906   5.104
 1120    HG3  ARG 134           HG3      ARG 134  28.315 -15.274   6.737
 1121    HD2  ARG 134           HD2      ARG 134  26.414 -13.952   7.618
 1122    HD3  ARG 134           HD3      ARG 134  25.863 -13.704   5.959
 1123    HE   ARG 134           HE       ARG 134  26.154 -16.414   7.059
 1124   HH11  ARG 134          HH11      ARG 134  24.171 -13.919   5.600
 1125   HH12  ARG 134          HH12      ARG 134  22.830 -14.979   5.322
 1126   HH21  ARG 134          HH21      ARG 134  24.417 -17.805   6.660
 1127   HH22  ARG 134          HH22      ARG 134  22.971 -17.196   5.919
 1128    H    GLN 135           H        GLN 135  28.290 -10.829   3.050
 1129    HA   GLN 135           HA       GLN 135  27.011 -12.727   1.308
 1130    HB2  GLN 135           HB2      GLN 135  28.337 -10.075   0.714
 1131    HB3  GLN 135           HB3      GLN 135  27.398 -11.013  -0.437
 1132    HG2  GLN 135           HG2      GLN 135  25.404 -10.719   0.884
 1133    HG3  GLN 135           HG3      GLN 135  26.322  -9.886   2.137
 1134   HE21  GLN 135          HE21      GLN 135  24.946  -9.658  -1.042
 1135   HE22  GLN 135          HE22      GLN 135  25.115  -7.951  -1.219
 1136    H    LYS 136           H        LYS 136  28.016 -13.193  -0.835
 1137    HA   LYS 136           HA       LYS 136  30.750 -14.140  -0.530
 1138    HB2  LYS 136           HB2      LYS 136  30.327 -15.297  -2.684
 1139    HB3  LYS 136           HB3      LYS 136  29.116 -15.683  -1.474
 1140    HG2  LYS 136           HG2      LYS 136  27.616 -13.991  -2.540
 1141    HG3  LYS 136           HG3      LYS 136  28.813 -13.830  -3.826
 1142    HD2  LYS 136           HD2      LYS 136  28.549 -16.129  -4.439
 1143    HD3  LYS 136           HD3      LYS 136  27.527 -16.436  -3.035
 1144    HE2  LYS 136           HE2      LYS 136  25.892 -14.800  -3.956
 1145    HE3  LYS 136           HE3      LYS 136  26.884 -14.699  -5.409
 1146    HZ1  LYS 136           HZ1      LYS 136  25.610 -17.172  -4.369
 1147    HZ2  LYS 136           HZ2      LYS 136  26.537 -17.052  -5.778
 1148    HZ3  LYS 136           HZ3      LYS 136  25.052 -16.254  -5.674
 1149    H    LYS 137           H        LYS 137  31.641 -13.939  -3.215
 1150    HA   LYS 137           HA       LYS 137  32.577 -11.324  -3.432
 1151    HB2  LYS 137           HB2      LYS 137  33.618 -13.174  -4.651
 1152    HB3  LYS 137           HB3      LYS 137  32.170 -13.372  -5.629
 1153    HG2  LYS 137           HG2      LYS 137  33.888 -12.209  -6.879
 1154    HG3  LYS 137           HG3      LYS 137  32.516 -11.140  -6.583
 1155    HD2  LYS 137           HD2      LYS 137  33.769 -10.212  -4.626
 1156    HD3  LYS 137           HD3      LYS 137  35.162 -11.164  -5.136
 1157    HE2  LYS 137           HE2      LYS 137  35.200  -9.988  -7.268
 1158    HE3  LYS 137           HE3      LYS 137  33.772  -9.065  -6.798
 1159    HZ1  LYS 137           HZ1      LYS 137  36.412  -8.982  -5.440
 1160    HZ2  LYS 137           HZ2      LYS 137  35.043  -8.107  -4.978
 1161    HZ3  LYS 137           HZ3      LYS 137  35.786  -7.786  -6.460
 1162    H    LEU 138           H        LEU 138  31.776  -9.480  -4.294
 1163    HA   LEU 138           HA       LEU 138  28.963  -9.356  -4.741
 1164    HB2  LEU 138           HB2      LEU 138  30.291  -7.546  -3.659
 1165    HB3  LEU 138           HB3      LEU 138  31.031  -7.212  -5.213
 1166    HG   LEU 138           HG       LEU 138  28.760  -6.665  -6.117
 1167   HD11  LEU 138          HD11      LEU 138  27.953  -6.899  -3.223
 1168   HD12  LEU 138          HD12      LEU 138  27.399  -7.917  -4.553
 1169   HD13  LEU 138          HD13      LEU 138  26.967  -6.208  -4.512
 1170   HD21  LEU 138          HD21      LEU 138  29.717  -5.067  -3.745
 1171   HD22  LEU 138          HD22      LEU 138  28.604  -4.487  -4.985
 1172   HD23  LEU 138          HD23      LEU 138  30.263  -4.901  -5.414
 1173    H    ALA 139           H        ALA 139  28.856 -10.847  -6.527
 1174    HA   ALA 139           HA       ALA 139  29.404  -9.516  -9.098
 1175    HB1  ALA 139           HB1      ALA 139  30.412 -11.756  -8.856
 1176    HB2  ALA 139           HB2      ALA 139  29.197 -11.710 -10.134
 1177    HB3  ALA 139           HB3      ALA 139  28.806 -12.430  -8.572
 1178    H    SER 140           H        SER 140  27.369  -8.708  -7.400
 1179    HA   SER 140           HA       SER 140  25.006  -9.331  -9.009
 1180    HB2  SER 140           HB2      SER 140  23.706  -8.900  -6.813
 1181    HB3  SER 140           HB3      SER 140  24.515 -10.456  -6.992
 1182    HG   SER 140           HG       SER 140  24.956  -8.441  -5.190
 1183    H    SER 141           H        SER 141  23.326  -7.532  -8.684
 1184    HA   SER 141           HA       SER 141  22.758  -5.367  -9.039
 1185    HB2  SER 141           HB2      SER 141  23.659  -4.950  -6.776
 1186    HB3  SER 141           HB3      SER 141  25.272  -4.746  -7.456
 1187    HG   SER 141           HG       SER 141  24.561  -2.911  -8.534
  Start of MODEL   15
    1    H1   ASP   1           HT1      ASP   1 -19.863  13.238  -6.349
    2    H2   ASP   1           HT2      ASP   1 -20.424  13.494  -7.921
    3    H3   ASP   1           HT3      ASP   1 -20.046  11.933  -7.404
    4    HA   ASP   1           HA       ASP   1 -21.835  11.969  -5.816
    5    HB2  ASP   1           HB2      ASP   1 -22.404  14.704  -6.981
    6    HB3  ASP   1           HB3      ASP   1 -23.457  13.843  -5.863
    7    HA   PRO   2           HA       PRO   2 -23.276  10.093  -9.651
    8    HB2  PRO   2           HB2      PRO   2 -24.855   8.441  -7.784
    9    HB3  PRO   2           HB3      PRO   2 -23.685   7.945  -9.009
   10    HG2  PRO   2           HG2      PRO   2 -23.107   7.802  -6.405
   11    HG3  PRO   2           HG3      PRO   2 -21.878   8.252  -7.602
   12    HD2  PRO   2           HD2      PRO   2 -23.434  10.004  -5.734
   13    HD3  PRO   2           HD3      PRO   2 -21.716  10.076  -6.181
   14    H    SER   3           H        SER   3 -25.783   9.963  -7.121
   15    HA   SER   3           HA       SER   3 -27.687  11.060  -9.057
   16    HB2  SER   3           HB2      SER   3 -28.295   8.922  -8.013
   17    HB3  SER   3           HB3      SER   3 -28.134   9.643  -6.414
   18    HG   SER   3           HG       SER   3 -29.922  10.687  -8.342
   19    H    ARG   4           H        ARG   4 -26.955  11.335  -5.601
   20    HA   ARG   4           HA       ARG   4 -27.240  14.244  -5.822
   21    HB2  ARG   4           HB2      ARG   4 -28.305  12.447  -3.633
   22    HB3  ARG   4           HB3      ARG   4 -28.094  14.180  -3.428
   23    HG2  ARG   4           HG2      ARG   4 -29.653  14.589  -5.264
   24    HG3  ARG   4           HG3      ARG   4 -29.866  12.850  -5.463
   25    HD2  ARG   4           HD2      ARG   4 -30.802  12.669  -3.247
   26    HD3  ARG   4           HD3      ARG   4 -30.481  14.375  -2.939
   27    HE   ARG   4           HE       ARG   4 -32.056  14.517  -5.090
   28   HH11  ARG   4          HH11      ARG   4 -32.389  12.652  -2.143
   29   HH12  ARG   4          HH12      ARG   4 -34.121  12.689  -2.170
   30   HH21  ARG   4          HH21      ARG   4 -34.331  14.576  -5.119
   31   HH22  ARG   4          HH22      ARG   4 -35.228  13.783  -3.863
   32    H    ARG   5           H        ARG   5 -26.335  14.943  -3.308
   33    HA   ARG   5           HA       ARG   5 -23.575  14.480  -3.515
   34    HB2  ARG   5           HB2      ARG   5 -24.397  16.436  -2.319
   35    HB3  ARG   5           HB3      ARG   5 -25.139  15.406  -1.096
   36    HG2  ARG   5           HG2      ARG   5 -22.849  14.518  -0.606
   37    HG3  ARG   5           HG3      ARG   5 -22.214  15.768  -1.671
   38    HD2  ARG   5           HD2      ARG   5 -23.885  16.263   0.780
   39    HD3  ARG   5           HD3      ARG   5 -22.128  16.376   0.710
   40    HE   ARG   5           HE       ARG   5 -23.105  18.030  -1.287
   41   HH11  ARG   5          HH11      ARG   5 -23.306  17.819   2.192
   42   HH12  ARG   5          HH12      ARG   5 -23.477  19.530   2.424
   43   HH21  ARG   5          HH21      ARG   5 -23.332  20.292  -1.003
   44   HH22  ARG   5          HH22      ARG   5 -23.495  20.943   0.597
   45    H    ALA   6           H        ALA   6 -22.224  13.097  -2.589
   46    HA   ALA   6           HA       ALA   6 -22.891  10.551  -1.806
   47    HB1  ALA   6           HB1      ALA   6 -20.633  11.247  -2.398
   48    HB2  ALA   6           HB2      ALA   6 -20.651  10.433  -0.830
   49    HB3  ALA   6           HB3      ALA   6 -20.533  12.196  -0.912
   50    HA   PRO   7           HA       PRO   7 -24.719  11.244   2.271
   51    HB2  PRO   7           HB2      PRO   7 -24.438   8.303   2.284
   52    HB3  PRO   7           HB3      PRO   7 -25.866   9.289   2.614
   53    HG2  PRO   7           HG2      PRO   7 -25.639   7.911   0.345
   54    HG3  PRO   7           HG3      PRO   7 -26.379   9.522   0.367
   55    HD2  PRO   7           HD2      PRO   7 -23.653   8.696  -0.535
   56    HD3  PRO   7           HD3      PRO   7 -24.749   9.915  -1.220
   57    H    THR   8           H        THR   8 -23.563  11.649   4.043
   58    HA   THR   8           HA       THR   8 -20.883  10.729   4.358
   59    HB   THR   8           HB       THR   8 -22.614  11.975   6.501
   60    HG1  THR   8           HG1      THR   8 -21.944  13.022   4.140
   61   HG21  THR   8          HG21      THR   8 -19.633  12.093   6.013
   62   HG22  THR   8          HG22      THR   8 -20.424  11.057   7.199
   63   HG23  THR   8          HG23      THR   8 -20.502  12.810   7.371
   64    H    TRP   9           H        TRP   9 -20.227   8.865   5.227
   65    HA   TRP   9           HA       TRP   9 -22.079   6.893   6.048
   66    HB2  TRP   9           HB2      TRP   9 -19.071   7.008   6.319
   67    HB3  TRP   9           HB3      TRP   9 -20.042   5.585   6.670
   68    HD1  TRP   9           HD1      TRP   9 -19.095   7.839   3.677
   69    HE1  TRP   9           HE1      TRP   9 -19.237   6.415   1.533
   70    HE3  TRP   9           HE3      TRP   9 -20.979   3.533   5.683
   71    HZ2  TRP   9           HZ2      TRP   9 -20.042   3.822   0.797
   72    HZ3  TRP   9           HZ3      TRP   9 -21.406   1.625   4.188
   73    HH2  TRP   9           HH2      TRP   9 -20.946   1.771   1.794
   74    H    SER  10           H        SER  10 -23.065   6.723   7.939
   75    HA   SER  10           HA       SER  10 -22.147   8.139  10.268
   76    HB2  SER  10           HB2      SER  10 -24.138   7.016  11.339
   77    HB3  SER  10           HB3      SER  10 -24.536   7.963   9.906
   78    HG   SER  10           HG       SER  10 -25.519   6.131   9.430
   79    HA   PRO  11           HA       PRO  11 -19.670   5.057  12.305
   80    HB2  PRO  11           HB2      PRO  11 -21.125   4.801  14.700
   81    HB3  PRO  11           HB3      PRO  11 -19.782   5.906  14.405
   82    HG2  PRO  11           HG2      PRO  11 -22.714   6.413  14.306
   83    HG3  PRO  11           HG3      PRO  11 -21.403   7.487  14.828
   84    HD2  PRO  11           HD2      PRO  11 -22.599   7.828  12.468
   85    HD3  PRO  11           HD3      PRO  11 -20.849   8.071  12.645
   86    H    GLU  12           H        GLU  12 -23.155   4.666  12.416
   87    HA   GLU  12           HA       GLU  12 -23.112   1.858  12.946
   88    HB2  GLU  12           HB2      GLU  12 -25.338   3.600  11.868
   89    HB3  GLU  12           HB3      GLU  12 -25.522   1.985  12.543
   90    HG2  GLU  12           HG2      GLU  12 -24.849   2.752  14.714
   91    HG3  GLU  12           HG3      GLU  12 -24.462   4.350  14.074
   92    H    GLU  13           H        GLU  13 -23.151   3.882  10.099
   93    HA   GLU  13           HA       GLU  13 -23.824   1.746   8.295
   94    HB2  GLU  13           HB2      GLU  13 -24.223   4.297   7.998
   95    HB3  GLU  13           HB3      GLU  13 -22.550   4.331   7.459
   96    HG2  GLU  13           HG2      GLU  13 -24.066   4.170   5.574
   97    HG3  GLU  13           HG3      GLU  13 -23.070   2.720   5.705
   98    H    GLU  14           H        GLU  14 -20.890   3.372   9.382
   99    HA   GLU  14           HA       GLU  14 -19.110   2.123   7.585
  100    HB2  GLU  14           HB2      GLU  14 -18.570   3.110  10.394
  101    HB3  GLU  14           HB3      GLU  14 -17.347   2.744   9.182
  102    HG2  GLU  14           HG2      GLU  14 -18.264   4.520   7.751
  103    HG3  GLU  14           HG3      GLU  14 -19.438   4.904   9.007
  104    H    ALA  15           H        ALA  15 -20.357   1.169  10.745
  105    HA   ALA  15           HA       ALA  15 -18.817  -1.199  10.994
  106    HB1  ALA  15           HB1      ALA  15 -20.434  -1.842  12.700
  107    HB2  ALA  15           HB2      ALA  15 -21.510  -0.547  12.179
  108    HB3  ALA  15           HB3      ALA  15 -19.946  -0.160  12.896
  109    H    HIS  16           H        HIS  16 -21.818  -0.433   9.420
  110    HA   HIS  16           HA       HIS  16 -22.547  -3.085   8.721
  111    HB2  HIS  16           HB2      HIS  16 -24.226  -1.324   8.865
  112    HB3  HIS  16           HB3      HIS  16 -23.416  -0.411   7.599
  113    HD1  HIS  16           HD1      HIS  16 -25.140  -0.413   5.823
  114    HD2  HIS  16           HD2      HIS  16 -24.414  -4.230   7.320
  115    HE1  HIS  16           HE1      HIS  16 -26.446  -1.990   4.350
  116    HE2  HIS  16           HE2      HIS  16 -26.183  -4.247   5.433
  117    H    LEU  17           H        LEU  17 -20.509  -0.622   7.372
  118    HA   LEU  17           HA       LEU  17 -20.297  -1.667   4.754
  119    HB2  LEU  17           HB2      LEU  17 -19.632   0.631   5.437
  120    HB3  LEU  17           HB3      LEU  17 -18.279  -0.049   6.316
  121    HG   LEU  17           HG       LEU  17 -17.276  -0.830   4.241
  122   HD11  LEU  17          HD11      LEU  17 -19.730   0.341   2.950
  123   HD12  LEU  17          HD12      LEU  17 -19.223  -1.349   2.942
  124   HD13  LEU  17          HD13      LEU  17 -18.275  -0.139   2.082
  125   HD21  LEU  17          HD21      LEU  17 -18.141   2.050   4.170
  126   HD22  LEU  17          HD22      LEU  17 -16.835   1.361   3.207
  127   HD23  LEU  17          HD23      LEU  17 -16.712   1.393   4.965
  128    H    ARG  18           H        ARG  18 -18.282  -2.040   7.673
  129    HA   ARG  18           HA       ARG  18 -16.681  -4.084   6.493
  130    HB2  ARG  18           HB2      ARG  18 -15.765  -4.434   8.713
  131    HB3  ARG  18           HB3      ARG  18 -15.851  -2.715   8.369
  132    HG2  ARG  18           HG2      ARG  18 -17.875  -2.550   9.729
  133    HG3  ARG  18           HG3      ARG  18 -17.765  -4.272  10.091
  134    HD2  ARG  18           HD2      ARG  18 -15.589  -3.912  11.147
  135    HD3  ARG  18           HD3      ARG  18 -15.690  -2.194  10.769
  136    HE   ARG  18           HE       ARG  18 -17.876  -3.228  12.356
  137   HH11  ARG  18          HH11      ARG  18 -14.692  -1.777  12.384
  138   HH12  ARG  18          HH12      ARG  18 -14.864  -1.113  13.975
  139   HH21  ARG  18          HH21      ARG  18 -18.112  -2.348  14.462
  140   HH22  ARG  18          HH22      ARG  18 -16.810  -1.435  15.158
  141    H    GLU  19           H        GLU  19 -19.658  -3.949   8.302
  142    HA   GLU  19           HA       GLU  19 -20.054  -6.504   9.138
  143    HB2  GLU  19           HB2      GLU  19 -21.703  -4.814   9.546
  144    HB3  GLU  19           HB3      GLU  19 -22.014  -4.640   7.827
  145    HG2  GLU  19           HG2      GLU  19 -23.805  -5.842   8.917
  146    HG3  GLU  19           HG3      GLU  19 -22.969  -6.875   7.760
  147    H    LEU  20           H        LEU  20 -20.737  -5.215   5.927
  148    HA   LEU  20           HA       LEU  20 -21.572  -7.718   4.852
  149    HB2  LEU  20           HB2      LEU  20 -21.641  -4.994   4.121
  150    HB3  LEU  20           HB3      LEU  20 -20.807  -5.842   2.834
  151    HG   LEU  20           HG       LEU  20 -23.471  -6.771   3.871
  152   HD11  LEU  20          HD11      LEU  20 -23.001  -4.910   1.555
  153   HD12  LEU  20          HD12      LEU  20 -23.632  -4.420   3.123
  154   HD13  LEU  20          HD13      LEU  20 -24.548  -5.540   2.116
  155   HD21  LEU  20          HD21      LEU  20 -23.574  -7.803   1.633
  156   HD22  LEU  20          HD22      LEU  20 -22.232  -8.401   2.612
  157   HD23  LEU  20          HD23      LEU  20 -21.933  -7.232   1.326
  158    H    TYR  21           H        TYR  21 -18.529  -6.015   5.053
  159    HA   TYR  21           HA       TYR  21 -17.187  -7.544   3.051
  160    HB2  TYR  21           HB2      TYR  21 -16.277  -5.383   3.765
  161    HB3  TYR  21           HB3      TYR  21 -16.057  -5.999   5.400
  162    HD1  TYR  21           HD1      TYR  21 -14.134  -7.260   5.983
  163    HD2  TYR  21           HD2      TYR  21 -14.875  -6.334   1.902
  164    HE1  TYR  21           HE1      TYR  21 -11.885  -8.064   5.399
  165    HE2  TYR  21           HE2      TYR  21 -12.627  -7.133   1.308
  166    HH   TYR  21           HH       TYR  21 -10.452  -7.496   2.364
  167    H    LEU  22           H        LEU  22 -17.343  -7.683   6.574
  168    HA   LEU  22           HA       LEU  22 -15.635  -9.897   6.899
  169    HB2  LEU  22           HB2      LEU  22 -17.911  -9.100   8.712
  170    HB3  LEU  22           HB3      LEU  22 -16.463  -9.983   9.150
  171    HG   LEU  22           HG       LEU  22 -16.534  -7.100   8.265
  172   HD11  LEU  22          HD11      LEU  22 -16.123  -8.269  11.005
  173   HD12  LEU  22          HD12      LEU  22 -17.560  -7.411  10.447
  174   HD13  LEU  22          HD13      LEU  22 -16.018  -6.563  10.572
  175   HD21  LEU  22          HD21      LEU  22 -14.442  -8.285   7.710
  176   HD22  LEU  22          HD22      LEU  22 -14.249  -8.685   9.416
  177   HD23  LEU  22          HD23      LEU  22 -14.225  -6.998   8.894
  178    H    ALA  23           H        ALA  23 -18.887  -9.639   5.869
  179    HA   ALA  23           HA       ALA  23 -19.650 -12.327   6.521
  180    HB1  ALA  23           HB1      ALA  23 -21.291 -10.493   6.385
  181    HB2  ALA  23           HB2      ALA  23 -21.693 -11.840   5.319
  182    HB3  ALA  23           HB3      ALA  23 -20.983 -10.370   4.654
  183    H    ASN  24           H        ASN  24 -18.537 -10.659   3.560
  184    HA   ASN  24           HA       ASN  24 -18.719 -13.240   2.167
  185    HB2  ASN  24           HB2      ASN  24 -18.850 -10.412   1.145
  186    HB3  ASN  24           HB3      ASN  24 -18.609 -11.790   0.074
  187   HD21  ASN  24          HD21      ASN  24 -20.828 -10.136   2.170
  188   HD22  ASN  24          HD22      ASN  24 -22.253 -10.982   1.664
  189    H    LYS  25           H        LYS  25 -16.419 -11.539   3.697
  190    HA   LYS  25           HA       LYS  25 -14.365 -11.216   1.810
  191    HB2  LYS  25           HB2      LYS  25 -12.829 -11.231   3.774
  192    HB3  LYS  25           HB3      LYS  25 -14.183 -10.120   3.930
  193    HG2  LYS  25           HG2      LYS  25 -15.325 -11.648   5.401
  194    HG3  LYS  25           HG3      LYS  25 -14.072 -12.864   5.162
  195    HD2  LYS  25           HD2      LYS  25 -13.485 -10.141   6.295
  196    HD3  LYS  25           HD3      LYS  25 -13.960 -11.505   7.308
  197    HE2  LYS  25           HE2      LYS  25 -11.565 -11.401   5.475
  198    HE3  LYS  25           HE3      LYS  25 -11.533 -11.255   7.230
  199    HZ1  LYS  25           HZ1      LYS  25 -12.627 -13.535   7.229
  200    HZ2  LYS  25           HZ2      LYS  25 -10.996 -13.464   6.806
  201    HZ3  LYS  25           HZ3      LYS  25 -12.168 -13.638   5.603
  202    H    ASP  26           H        ASP  26 -15.360 -14.005   3.685
  203    HA   ASP  26           HA       ASP  26 -13.018 -15.489   2.782
  204    HB2  ASP  26           HB2      ASP  26 -13.841 -17.262   4.331
  205    HB3  ASP  26           HB3      ASP  26 -13.501 -15.728   5.121
  206    H    VAL  27           H        VAL  27 -15.727 -14.723   1.332
  207    HA   VAL  27           HA       VAL  27 -16.370 -17.366   0.286
  208    HB   VAL  27           HB       VAL  27 -17.412 -14.664  -0.603
  209   HG11  VAL  27          HG11      VAL  27 -17.597 -16.400  -2.318
  210   HG12  VAL  27          HG12      VAL  27 -19.184 -15.947  -1.698
  211   HG13  VAL  27          HG13      VAL  27 -18.428 -17.452  -1.171
  212   HG21  VAL  27          HG21      VAL  27 -18.647 -16.689   1.261
  213   HG22  VAL  27          HG22      VAL  27 -19.437 -15.232   0.662
  214   HG23  VAL  27          HG23      VAL  27 -18.024 -15.106   1.709
  215    H    GLU  28           H        GLU  28 -14.920 -18.175  -1.073
  216    HA   GLU  28           HA       GLU  28 -13.107 -16.438  -2.490
  217    HB2  GLU  28           HB2      GLU  28 -13.306 -19.452  -2.431
  218    HB3  GLU  28           HB3      GLU  28 -11.985 -18.530  -3.137
  219    HG2  GLU  28           HG2      GLU  28 -12.765 -18.389  -0.237
  220    HG3  GLU  28           HG3      GLU  28 -11.527 -19.467  -0.873
  221    H    GLY  29           H        GLY  29 -13.027 -16.061  -4.635
  222    HA2  GLY  29           HA2      GLY  29 -13.451 -16.509  -6.908
  223    HA3  GLY  29           HA3      GLY  29 -14.720 -17.622  -6.431
  224    H    GLN  30           H        GLN  30 -15.654 -15.358  -4.534
  225    HA   GLN  30           HA       GLN  30 -17.331 -14.085  -6.568
  226    HB2  GLN  30           HB2      GLN  30 -18.559 -15.135  -4.760
  227    HB3  GLN  30           HB3      GLN  30 -17.624 -14.250  -3.561
  228    HG2  GLN  30           HG2      GLN  30 -18.545 -12.138  -4.555
  229    HG3  GLN  30           HG3      GLN  30 -19.631 -13.137  -5.490
  230   HE21  GLN  30          HE21      GLN  30 -18.868 -11.875  -2.444
  231   HE22  GLN  30          HE22      GLN  30 -20.310 -12.350  -1.629
  232    H    ASP  31           H        ASP  31 -17.489 -11.885  -6.811
  233    HA   ASP  31           HA       ASP  31 -15.481 -10.123  -5.920
  234    HB2  ASP  31           HB2      ASP  31 -18.276  -9.690  -6.964
  235    HB3  ASP  31           HB3      ASP  31 -17.266  -8.337  -6.462
  236    H    VAL  32           H        VAL  32 -15.163 -10.085  -3.721
  237    HA   VAL  32           HA       VAL  32 -17.177 -10.163  -1.785
  238    HB   VAL  32           HB       VAL  32 -14.744 -10.502  -1.298
  239   HG11  VAL  32          HG11      VAL  32 -13.784  -8.654  -2.514
  240   HG12  VAL  32          HG12      VAL  32 -13.388  -8.483  -0.803
  241   HG13  VAL  32          HG13      VAL  32 -14.666  -7.495  -1.519
  242   HG21  VAL  32          HG21      VAL  32 -14.808  -9.354   0.908
  243   HG22  VAL  32          HG22      VAL  32 -16.281 -10.246   0.527
  244   HG23  VAL  32          HG23      VAL  32 -16.249  -8.491   0.367
  245    H    VAL  33           H        VAL  33 -15.801  -7.494  -3.603
  246    HA   VAL  33           HA       VAL  33 -16.878  -5.497  -1.893
  247    HB   VAL  33           HB       VAL  33 -14.857  -5.218  -3.356
  248   HG11  VAL  33          HG11      VAL  33 -16.903  -4.748  -5.511
  249   HG12  VAL  33          HG12      VAL  33 -15.760  -6.088  -5.442
  250   HG13  VAL  33          HG13      VAL  33 -15.171  -4.438  -5.637
  251   HG21  VAL  33          HG21      VAL  33 -15.536  -2.811  -3.942
  252   HG22  VAL  33          HG22      VAL  33 -15.593  -3.317  -2.254
  253   HG23  VAL  33          HG23      VAL  33 -17.079  -3.229  -3.197
  254    H    GLU  34           H        GLU  34 -17.937  -6.970  -4.938
  255    HA   GLU  34           HA       GLU  34 -20.101  -5.169  -5.283
  256    HB2  GLU  34           HB2      GLU  34 -19.445  -7.831  -6.489
  257    HB3  GLU  34           HB3      GLU  34 -21.005  -7.073  -6.781
  258    HG2  GLU  34           HG2      GLU  34 -19.661  -5.017  -7.486
  259    HG3  GLU  34           HG3      GLU  34 -18.279  -6.110  -7.562
  260    H    ALA  35           H        ALA  35 -19.650  -8.069  -3.444
  261    HA   ALA  35           HA       ALA  35 -22.343  -8.504  -2.749
  262    HB1  ALA  35           HB1      ALA  35 -19.864  -8.933  -1.076
  263    HB2  ALA  35           HB2      ALA  35 -20.551 -10.093  -2.214
  264    HB3  ALA  35           HB3      ALA  35 -21.454  -9.633  -0.770
  265    H    ILE  36           H        ILE  36 -19.816  -6.434  -1.432
  266    HA   ILE  36           HA       ILE  36 -21.381  -5.448   0.728
  267    HB   ILE  36           HB       ILE  36 -18.911  -4.213  -0.485
  268   HG12  ILE  36          HG12      ILE  36 -19.073  -6.169   1.809
  269   HG13  ILE  36          HG13      ILE  36 -18.713  -6.646   0.154
  270   HG21  ILE  36          HG21      ILE  36 -18.593  -3.262   1.753
  271   HG22  ILE  36          HG22      ILE  36 -20.116  -3.984   2.274
  272   HG23  ILE  36          HG23      ILE  36 -20.114  -2.732   1.033
  273   HD11  ILE  36          HD11      ILE  36 -17.096  -4.825   1.900
  274   HD12  ILE  36          HD12      ILE  36 -16.756  -5.148   0.203
  275   HD13  ILE  36          HD13      ILE  36 -16.684  -6.456   1.379
  276    H    LEU  37           H        LEU  37 -20.135  -3.792  -2.183
  277    HA   LEU  37           HA       LEU  37 -21.514  -1.412  -1.541
  278    HB2  LEU  37           HB2      LEU  37 -20.856  -0.702  -3.874
  279    HB3  LEU  37           HB3      LEU  37 -19.571  -1.107  -2.760
  280    HG   LEU  37           HG       LEU  37 -19.478  -3.381  -3.892
  281   HD11  LEU  37          HD11      LEU  37 -21.273  -1.938  -5.826
  282   HD12  LEU  37          HD12      LEU  37 -21.538  -3.496  -5.048
  283   HD13  LEU  37          HD13      LEU  37 -20.287  -3.325  -6.278
  284   HD21  LEU  37          HD21      LEU  37 -18.237  -2.424  -5.862
  285   HD22  LEU  37          HD22      LEU  37 -17.743  -1.840  -4.275
  286   HD23  LEU  37          HD23      LEU  37 -18.753  -0.834  -5.302
  287    H    ALA  38           H        ALA  38 -22.604  -4.199  -3.201
  288    HA   ALA  38           HA       ALA  38 -24.719  -2.726  -4.544
  289    HB1  ALA  38           HB1      ALA  38 -23.600  -4.618  -5.672
  290    HB2  ALA  38           HB2      ALA  38 -25.351  -4.794  -5.563
  291    HB3  ALA  38           HB3      ALA  38 -24.306  -5.703  -4.471
  292    H    HIS  39           H        HIS  39 -24.295  -4.691  -1.673
  293    HA   HIS  39           HA       HIS  39 -27.131  -5.185  -1.414
  294    HB2  HIS  39           HB2      HIS  39 -24.733  -5.918   0.206
  295    HB3  HIS  39           HB3      HIS  39 -26.330  -6.012   0.940
  296    HD1  HIS  39           HD1      HIS  39 -27.641  -8.082   0.485
  297    HD2  HIS  39           HD2      HIS  39 -24.436  -7.627  -2.108
  298    HE1  HIS  39           HE1      HIS  39 -27.581 -10.186  -0.889
  299    HE2  HIS  39           HE2      HIS  39 -25.729  -9.825  -2.555
  300    H    LEU  40           H        LEU  40 -24.836  -2.856  -0.134
  301    HA   LEU  40           HA       LEU  40 -26.867  -1.902   1.707
  302    HB2  LEU  40           HB2      LEU  40 -25.001  -0.078   2.121
  303    HB3  LEU  40           HB3      LEU  40 -24.959  -1.654   2.876
  304    HG   LEU  40           HG       LEU  40 -23.397  -2.356   0.982
  305   HD11  LEU  40          HD11      LEU  40 -23.711  -0.626  -0.609
  306   HD12  LEU  40          HD12      LEU  40 -22.079  -0.447   0.041
  307   HD13  LEU  40          HD13      LEU  40 -23.368   0.622   0.588
  308   HD21  LEU  40          HD21      LEU  40 -21.456  -1.383   2.109
  309   HD22  LEU  40          HD22      LEU  40 -22.648  -1.989   3.258
  310   HD23  LEU  40          HD23      LEU  40 -22.517  -0.257   2.953
  311    H    ASN  41           H        ASN  41 -28.460  -1.205   0.328
  312    HA   ASN  41           HA       ASN  41 -27.872   0.848  -1.635
  313    HB2  ASN  41           HB2      ASN  41 -30.436  -0.490  -0.764
  314    HB3  ASN  41           HB3      ASN  41 -30.401   0.830  -1.929
  315   HD21  ASN  41          HD21      ASN  41 -29.466   0.492  -3.950
  316   HD22  ASN  41          HD22      ASN  41 -29.182  -1.098  -4.568
  317    H    THR  42           H        THR  42 -27.180   1.505   0.961
  318    HA   THR  42           HA       THR  42 -29.145   3.530   1.759
  319    HB   THR  42           HB       THR  42 -28.590   2.119   3.593
  320    HG1  THR  42           HG1      THR  42 -27.226   3.650   4.922
  321   HG21  THR  42          HG21      THR  42 -26.281   1.684   4.324
  322   HG22  THR  42          HG22      THR  42 -25.683   2.574   2.921
  323   HG23  THR  42          HG23      THR  42 -26.588   1.077   2.698
  324    H    VAL  43           H        VAL  43 -26.277   3.064   0.087
  325    HA   VAL  43           HA       VAL  43 -25.683   5.931   0.184
  326    HB   VAL  43           HB       VAL  43 -23.215   5.226  -0.162
  327   HG11  VAL  43          HG11      VAL  43 -22.816   5.203   2.243
  328   HG12  VAL  43          HG12      VAL  43 -24.529   4.886   2.529
  329   HG13  VAL  43          HG13      VAL  43 -24.021   6.409   1.800
  330   HG21  VAL  43          HG21      VAL  43 -23.579   2.849  -0.460
  331   HG22  VAL  43          HG22      VAL  43 -24.318   2.735   1.136
  332   HG23  VAL  43          HG23      VAL  43 -22.604   3.129   0.983
  333    HA   PRO  44           HA       PRO  44 -25.785   5.032  -4.289
  334    HB2  PRO  44           HB2      PRO  44 -26.487   7.854  -4.488
  335    HB3  PRO  44           HB3      PRO  44 -27.395   6.445  -5.041
  336    HG2  PRO  44           HG2      PRO  44 -28.198   8.000  -2.961
  337    HG3  PRO  44           HG3      PRO  44 -28.574   6.273  -3.082
  338    HD2  PRO  44           HD2      PRO  44 -26.472   7.649  -1.458
  339    HD3  PRO  44           HD3      PRO  44 -27.513   6.277  -1.024
  340    H    ARG  45           H        ARG  45 -23.518   4.842  -4.153
  341    HA   ARG  45           HA       ARG  45 -22.045   7.321  -4.675
  342    HB2  ARG  45           HB2      ARG  45 -21.209   5.192  -2.694
  343    HB3  ARG  45           HB3      ARG  45 -20.208   6.546  -3.200
  344    HG2  ARG  45           HG2      ARG  45 -21.856   8.097  -2.262
  345    HG3  ARG  45           HG3      ARG  45 -22.823   6.725  -1.715
  346    HD2  ARG  45           HD2      ARG  45 -21.513   7.528   0.133
  347    HD3  ARG  45           HD3      ARG  45 -20.880   5.965  -0.371
  348    HE   ARG  45           HE       ARG  45 -19.151   7.273  -1.604
  349   HH11  ARG  45          HH11      ARG  45 -20.722   8.628   1.228
  350   HH12  ARG  45          HH12      ARG  45 -19.406   9.698   1.589
  351   HH21  ARG  45          HH21      ARG  45 -17.439   8.717  -1.139
  352   HH22  ARG  45          HH22      ARG  45 -17.549   9.757   0.243
  353    H    THR  46           H        THR  46 -19.769   6.767  -5.443
  354    HA   THR  46           HA       THR  46 -19.961   4.820  -7.526
  355    HB   THR  46           HB       THR  46 -18.669   7.003  -7.656
  356    HG1  THR  46           HG1      THR  46 -17.684   6.081  -9.283
  357   HG21  THR  46          HG21      THR  46 -16.695   5.416  -6.013
  358   HG22  THR  46          HG22      THR  46 -17.444   6.958  -5.596
  359   HG23  THR  46          HG23      THR  46 -16.284   6.872  -6.921
  360    H    ARG  47           H        ARG  47 -18.394   3.048  -7.791
  361    HA   ARG  47           HA       ARG  47 -18.674   1.303  -5.596
  362    HB2  ARG  47           HB2      ARG  47 -16.882   0.938  -8.000
  363    HB3  ARG  47           HB3      ARG  47 -17.516  -0.328  -6.961
  364    HG2  ARG  47           HG2      ARG  47 -19.065   1.412  -8.868
  365    HG3  ARG  47           HG3      ARG  47 -18.764  -0.320  -8.995
  366    HD2  ARG  47           HD2      ARG  47 -20.004  -0.534  -6.788
  367    HD3  ARG  47           HD3      ARG  47 -20.521   1.129  -7.033
  368    HE   ARG  47           HE       ARG  47 -21.065  -0.509  -9.304
  369   HH11  ARG  47          HH11      ARG  47 -22.236   0.351  -6.107
  370   HH12  ARG  47          HH12      ARG  47 -23.870  -0.133  -6.436
  371   HH21  ARG  47          HH21      ARG  47 -23.229  -1.160  -9.726
  372   HH22  ARG  47          HH22      ARG  47 -24.429  -1.004  -8.480
  373    H    LYS  48           H        LYS  48 -16.051   3.272  -6.728
  374    HA   LYS  48           HA       LYS  48 -13.863   2.171  -5.436
  375    HB2  LYS  48           HB2      LYS  48 -13.669   3.929  -7.095
  376    HB3  LYS  48           HB3      LYS  48 -14.507   5.058  -6.042
  377    HG2  LYS  48           HG2      LYS  48 -12.629   4.849  -4.426
  378    HG3  LYS  48           HG3      LYS  48 -11.782   3.864  -5.619
  379    HD2  LYS  48           HD2      LYS  48 -11.040   6.195  -5.696
  380    HD3  LYS  48           HD3      LYS  48 -11.827   5.720  -7.201
  381    HE2  LYS  48           HE2      LYS  48 -13.834   6.877  -6.594
  382    HE3  LYS  48           HE3      LYS  48 -13.233   7.174  -4.965
  383    HZ1  LYS  48           HZ1      LYS  48 -13.035   9.143  -6.320
  384    HZ2  LYS  48           HZ2      LYS  48 -12.117   8.312  -7.471
  385    HZ3  LYS  48           HZ3      LYS  48 -11.495   8.572  -5.922
  386    H    GLN  49           H        GLN  49 -16.457   4.098  -4.105
  387    HA   GLN  49           HA       GLN  49 -15.024   5.096  -1.871
  388    HB2  GLN  49           HB2      GLN  49 -17.999   4.825  -2.301
  389    HB3  GLN  49           HB3      GLN  49 -17.240   5.756  -1.015
  390    HG2  GLN  49           HG2      GLN  49 -16.804   6.264  -3.945
  391    HG3  GLN  49           HG3      GLN  49 -17.997   7.103  -2.962
  392   HE21  GLN  49          HE21      GLN  49 -17.001   9.086  -3.391
  393   HE22  GLN  49          HE22      GLN  49 -15.508   9.538  -2.639
  394    H    ILE  50           H        ILE  50 -17.145   2.299  -2.314
  395    HA   ILE  50           HA       ILE  50 -17.146   1.519   0.410
  396    HB   ILE  50           HB       ILE  50 -17.775   0.078  -2.143
  397   HG12  ILE  50          HG12      ILE  50 -19.953  -0.246  -0.742
  398   HG13  ILE  50          HG13      ILE  50 -19.289   1.033   0.265
  399   HG21  ILE  50          HG21      ILE  50 -16.661  -1.611  -0.845
  400   HG22  ILE  50          HG22      ILE  50 -18.398  -1.919  -0.825
  401   HG23  ILE  50          HG23      ILE  50 -17.614  -1.194   0.579
  402   HD11  ILE  50          HD11      ILE  50 -19.205   2.504  -1.705
  403   HD12  ILE  50          HD12      ILE  50 -20.837   1.943  -1.333
  404   HD13  ILE  50          HD13      ILE  50 -19.942   1.215  -2.665
  405    H    ILE  51           H        ILE  51 -15.201   0.492  -2.372
  406    HA   ILE  51           HA       ILE  51 -13.510  -1.349  -1.188
  407    HB   ILE  51           HB       ILE  51 -12.812   0.739  -3.262
  408   HG12  ILE  51          HG12      ILE  51 -13.601  -2.155  -3.613
  409   HG13  ILE  51          HG13      ILE  51 -14.665  -0.782  -3.893
  410   HG21  ILE  51          HG21      ILE  51 -10.961  -0.753  -3.876
  411   HG22  ILE  51          HG22      ILE  51 -11.348  -1.779  -2.497
  412   HG23  ILE  51          HG23      ILE  51 -10.804  -0.121  -2.237
  413   HD11  ILE  51          HD11      ILE  51 -13.780  -1.638  -5.978
  414   HD12  ILE  51          HD12      ILE  51 -12.132  -1.401  -5.395
  415   HD13  ILE  51          HD13      ILE  51 -13.177  -0.009  -5.672
  416    H    HIS  52           H        HIS  52 -13.172   2.145  -1.418
  417    HA   HIS  52           HA       HIS  52 -10.609   2.319  -0.354
  418    HB2  HIS  52           HB2      HIS  52 -12.756   4.164  -1.071
  419    HB3  HIS  52           HB3      HIS  52 -11.708   4.758   0.215
  420    HD1  HIS  52           HD1      HIS  52 -10.107   6.292  -0.852
  421    HD2  HIS  52           HD2      HIS  52 -10.681   2.844  -3.118
  422    HE1  HIS  52           HE1      HIS  52  -8.446   6.429  -2.720
  423    HE2  HIS  52           HE2      HIS  52  -8.776   4.323  -4.060
  424    H    HIS  53           H        HIS  53 -13.733   2.893   1.320
  425    HA   HIS  53           HA       HIS  53 -12.551   3.671   3.746
  426    HB2  HIS  53           HB2      HIS  53 -15.238   2.402   3.258
  427    HB3  HIS  53           HB3      HIS  53 -14.736   3.100   4.790
  428    HD1  HIS  53           HD1      HIS  53 -13.438   5.707   3.734
  429    HD2  HIS  53           HD2      HIS  53 -17.108   4.187   2.481
  430    HE1  HIS  53           HE1      HIS  53 -14.708   7.682   2.845
  431    HE2  HIS  53           HE2      HIS  53 -17.008   6.785   2.359
  432    H    LEU  54           H        LEU  54 -13.233   0.504   2.461
  433    HA   LEU  54           HA       LEU  54 -13.041  -0.906   4.912
  434    HB2  LEU  54           HB2      LEU  54 -12.764  -1.770   2.044
  435    HB3  LEU  54           HB3      LEU  54 -12.667  -2.891   3.387
  436    HG   LEU  54           HG       LEU  54 -15.061  -1.134   2.882
  437   HD11  LEU  54          HD11      LEU  54 -14.665  -2.651   0.996
  438   HD12  LEU  54          HD12      LEU  54 -16.119  -3.069   1.899
  439   HD13  LEU  54          HD13      LEU  54 -14.647  -4.014   2.112
  440   HD21  LEU  54          HD21      LEU  54 -16.186  -2.641   4.404
  441   HD22  LEU  54          HD22      LEU  54 -14.751  -1.982   5.190
  442   HD23  LEU  54          HD23      LEU  54 -14.732  -3.626   4.557
  443    H    VAL  55           H        VAL  55 -10.710  -0.281   2.303
  444    HA   VAL  55           HA       VAL  55  -8.598  -1.634   3.699
  445    HB   VAL  55           HB       VAL  55  -7.140  -0.971   1.945
  446   HG11  VAL  55          HG11      VAL  55  -8.666  -2.691   1.300
  447   HG12  VAL  55          HG12      VAL  55  -8.433  -1.618  -0.079
  448   HG13  VAL  55          HG13      VAL  55  -9.905  -1.509   0.887
  449   HG21  VAL  55          HG21      VAL  55  -7.699   1.405   1.837
  450   HG22  VAL  55          HG22      VAL  55  -9.235   1.015   1.061
  451   HG23  VAL  55          HG23      VAL  55  -7.715   0.670   0.232
  452    H    GLN  56           H        GLN  56  -9.973   1.484   3.707
  453    HA   GLN  56           HA       GLN  56  -7.807   2.891   4.889
  454    HB2  GLN  56           HB2      GLN  56 -10.737   3.402   4.554
  455    HB3  GLN  56           HB3      GLN  56  -9.797   4.433   5.615
  456    HG2  GLN  56           HG2      GLN  56  -8.460   5.215   3.855
  457    HG3  GLN  56           HG3      GLN  56  -8.985   3.930   2.772
  458   HE21  GLN  56          HE21      GLN  56  -9.623   5.342   1.188
  459   HE22  GLN  56          HE22      GLN  56 -11.030   6.348   1.336
  460    H    MET  57           H        MET  57 -10.512   1.020   6.135
  461    HA   MET  57           HA       MET  57  -9.907   1.745   8.860
  462    HB2  MET  57           HB2      MET  57 -11.930  -0.061   7.590
  463    HB3  MET  57           HB3      MET  57 -11.642  -0.130   9.325
  464    HG2  MET  57           HG2      MET  57 -12.163   2.265   9.488
  465    HG3  MET  57           HG3      MET  57 -12.500   2.294   7.761
  466    HE1  MET  57           HE1      MET  57 -15.799   0.351   7.405
  467    HE2  MET  57           HE2      MET  57 -14.153  -0.171   7.041
  468    HE3  MET  57           HE3      MET  57 -14.663   1.473   6.657
  469    H    GLY  58           H        GLY  58  -8.257  -0.071   6.824
  470    HA2  GLY  58           HA2      GLY  58  -6.480  -1.481   7.193
  471    HA3  GLY  58           HA3      GLY  58  -6.754  -1.277   8.914
  472    H    LEU  59           H        LEU  59  -9.587  -2.295   7.525
  473    HA   LEU  59           HA       LEU  59  -9.243  -4.945   8.626
  474    HB2  LEU  59           HB2      LEU  59 -11.638  -5.237   8.123
  475    HB3  LEU  59           HB3      LEU  59 -11.313  -3.822   9.101
  476    HG   LEU  59           HG       LEU  59 -11.367  -2.583   6.783
  477   HD11  LEU  59          HD11      LEU  59 -11.545  -4.633   5.459
  478   HD12  LEU  59          HD12      LEU  59 -12.920  -3.559   5.220
  479   HD13  LEU  59          HD13      LEU  59 -13.088  -4.990   6.237
  480   HD21  LEU  59          HD21      LEU  59 -13.813  -3.561   8.241
  481   HD22  LEU  59          HD22      LEU  59 -13.782  -2.220   7.100
  482   HD23  LEU  59          HD23      LEU  59 -12.873  -2.116   8.607
  483    H    ALA  60           H        ALA  60  -9.027  -3.401   5.622
  484    HA   ALA  60           HA       ALA  60  -8.814  -6.021   4.270
  485    HB1  ALA  60           HB1      ALA  60 -10.539  -4.685   3.249
  486    HB2  ALA  60           HB2      ALA  60  -9.153  -4.771   2.159
  487    HB3  ALA  60           HB3      ALA  60  -9.440  -3.314   3.105
  488    H    ASP  61           H        ASP  61  -7.198  -5.935   2.394
  489    HA   ASP  61           HA       ASP  61  -4.657  -5.122   3.456
  490    HB2  ASP  61           HB2      ASP  61  -4.910  -7.175   2.099
  491    HB3  ASP  61           HB3      ASP  61  -5.356  -6.189   0.710
  492    H    SER  62           H        SER  62  -6.126  -4.450   0.306
  493    HA   SER  62           HA       SER  62  -5.754  -1.641   0.483
  494    HB2  SER  62           HB2      SER  62  -4.091  -1.470  -1.335
  495    HB3  SER  62           HB3      SER  62  -3.421  -2.229   0.102
  496    HG   SER  62           HG       SER  62  -3.556  -4.219  -0.889
  497    H    VAL  63           H        VAL  63  -6.041  -0.706  -1.877
  498    HA   VAL  63           HA       VAL  63  -8.540  -1.603  -2.827
  499    HB   VAL  63           HB       VAL  63  -6.485   0.218  -4.098
  500   HG11  VAL  63          HG11      VAL  63  -9.356  -0.221  -4.914
  501   HG12  VAL  63          HG12      VAL  63  -7.933  -0.721  -5.826
  502   HG13  VAL  63          HG13      VAL  63  -8.267   0.994  -5.580
  503   HG21  VAL  63          HG21      VAL  63  -9.022   0.794  -2.575
  504   HG22  VAL  63          HG22      VAL  63  -8.003   2.003  -3.358
  505   HG23  VAL  63          HG23      VAL  63  -7.373   1.058  -2.010
  506    H    LYS  64           H        LYS  64  -5.289  -2.459  -3.564
  507    HA   LYS  64           HA       LYS  64  -5.683  -3.443  -6.191
  508    HB2  LYS  64           HB2      LYS  64  -3.544  -4.302  -4.262
  509    HB3  LYS  64           HB3      LYS  64  -3.475  -4.332  -6.009
  510    HG2  LYS  64           HG2      LYS  64  -3.618  -1.845  -5.996
  511    HG3  LYS  64           HG3      LYS  64  -3.480  -1.904  -4.240
  512    HD2  LYS  64           HD2      LYS  64  -1.449  -2.916  -6.227
  513    HD3  LYS  64           HD3      LYS  64  -1.317  -1.447  -5.263
  514    HE2  LYS  64           HE2      LYS  64  -1.408  -4.275  -4.214
  515    HE3  LYS  64           HE3      LYS  64   0.019  -3.248  -4.309
  516    HZ1  LYS  64           HZ1      LYS  64  -2.373  -2.819  -2.599
  517    HZ2  LYS  64           HZ2      LYS  64  -1.116  -1.700  -2.766
  518    HZ3  LYS  64           HZ3      LYS  64  -0.810  -3.217  -2.085
  519    H    ASP  65           H        ASP  65  -6.237  -4.790  -3.044
  520    HA   ASP  65           HA       ASP  65  -6.244  -7.532  -3.880
  521    HB2  ASP  65           HB2      ASP  65  -5.840  -6.869  -1.532
  522    HB3  ASP  65           HB3      ASP  65  -7.493  -6.272  -1.426
  523    H    PHE  66           H        PHE  66  -8.570  -4.959  -3.626
  524    HA   PHE  66           HA       PHE  66 -10.860  -6.591  -4.265
  525    HB2  PHE  66           HB2      PHE  66 -10.431  -3.592  -4.289
  526    HB3  PHE  66           HB3      PHE  66 -11.968  -4.363  -4.642
  527    HD1  PHE  66           HD1      PHE  66  -9.382  -4.673  -1.966
  528    HD2  PHE  66           HD2      PHE  66 -13.472  -4.147  -2.983
  529    HE1  PHE  66           HE1      PHE  66  -9.956  -4.576   0.414
  530    HE2  PHE  66           HE2      PHE  66 -14.061  -4.061  -0.601
  531    HZ   PHE  66           HZ       PHE  66 -12.300  -4.269   1.108
  532    H    GLN  67           H        GLN  67  -8.776  -4.278  -5.861
  533    HA   GLN  67           HA       GLN  67  -9.447  -5.301  -8.494
  534    HB2  GLN  67           HB2      GLN  67 -10.116  -2.544  -7.469
  535    HB3  GLN  67           HB3      GLN  67  -9.784  -2.808  -9.185
  536    HG2  GLN  67           HG2      GLN  67 -11.619  -4.398  -9.318
  537    HG3  GLN  67           HG3      GLN  67 -11.915  -4.218  -7.589
  538   HE21  GLN  67          HE21      GLN  67 -14.041  -3.582  -8.016
  539   HE22  GLN  67          HE22      GLN  67 -14.404  -1.988  -8.581
  540    H    ARG  68           H        ARG  68  -7.302  -5.895  -8.816
  541    HA   ARG  68           HA       ARG  68  -5.167  -4.125  -8.129
  542    HB2  ARG  68           HB2      ARG  68  -4.999  -6.646  -8.199
  543    HB3  ARG  68           HB3      ARG  68  -4.983  -6.522  -9.953
  544    HG2  ARG  68           HG2      ARG  68  -2.921  -5.375  -9.955
  545    HG3  ARG  68           HG3      ARG  68  -2.997  -5.087  -8.214
  546    HD2  ARG  68           HD2      ARG  68  -1.443  -6.836  -8.528
  547    HD3  ARG  68           HD3      ARG  68  -2.911  -7.586  -7.916
  548    HE   ARG  68           HE       ARG  68  -2.076  -7.648 -10.746
  549   HH11  ARG  68          HH11      ARG  68  -3.702  -9.106  -8.004
  550   HH12  ARG  68          HH12      ARG  68  -3.956 -10.626  -8.796
  551   HH21  ARG  68          HH21      ARG  68  -2.396  -9.656 -11.790
  552   HH22  ARG  68          HH22      ARG  68  -3.201 -10.943 -10.947
  553    H    LYS  69           H        LYS  69  -6.080  -2.329  -9.238
  554    HA   LYS  69           HA       LYS  69  -4.540  -1.895 -11.662
  555    HB2  LYS  69           HB2      LYS  69  -6.787  -2.569 -12.481
  556    HB3  LYS  69           HB3      LYS  69  -7.514  -1.302 -11.509
  557    HG2  LYS  69           HG2      LYS  69  -6.317   0.384 -12.841
  558    HG3  LYS  69           HG3      LYS  69  -5.644  -0.905 -13.838
  559    HD2  LYS  69           HD2      LYS  69  -7.816  -1.522 -14.627
  560    HD3  LYS  69           HD3      LYS  69  -8.597  -0.436 -13.477
  561    HE2  LYS  69           HE2      LYS  69  -6.759   0.446 -15.695
  562    HE3  LYS  69           HE3      LYS  69  -8.520   0.456 -15.794
  563    HZ1  LYS  69           HZ1      LYS  69  -7.634   2.631 -15.200
  564    HZ2  LYS  69           HZ2      LYS  69  -6.901   1.981 -13.824
  565    HZ3  LYS  69           HZ3      LYS  69  -8.585   2.007 -13.949
  566    H    GLY  70           H        GLY  70  -4.736  -1.179  -8.731
  567    HA2  GLY  70           HA2      GLY  70  -5.248   1.708  -8.950
  568    HA3  GLY  70           HA3      GLY  70  -5.619   0.759  -7.519
  569    H    THR  71           H        THR  71  -2.686   0.621  -9.504
  570    HA   THR  71           HA       THR  71  -1.098   1.145  -7.150
  571    HB   THR  71           HB       THR  71   0.829   1.088  -8.886
  572    HG1  THR  71           HG1      THR  71   0.169  -0.206 -10.763
  573   HG21  THR  71          HG21      THR  71   0.838  -1.365  -8.854
  574   HG22  THR  71          HG22      THR  71  -0.856  -1.370  -8.369
  575   HG23  THR  71          HG23      THR  71   0.369  -0.706  -7.289
  576    H    HIS  72           H        HIS  72  -1.710   3.206  -6.595
  577    HA   HIS  72           HA       HIS  72  -1.447   5.528  -8.089
  578    HB2  HIS  72           HB2      HIS  72  -1.147   6.676  -6.005
  579    HB3  HIS  72           HB3      HIS  72  -2.162   5.286  -5.627
  580    HD1  HIS  72           HD1      HIS  72  -0.781   3.151  -4.645
  581    HD2  HIS  72           HD2      HIS  72   1.140   6.816  -4.586
  582    HE1  HIS  72           HE1      HIS  72   1.286   2.804  -3.288
  583    HE2  HIS  72           HE2      HIS  72   2.127   5.144  -2.862
  584    H    ILE  73           H        ILE  73   0.420   6.792  -8.649
  585    HA   ILE  73           HA       ILE  73   2.888   5.271  -8.358
  586    HB   ILE  73           HB       ILE  73   1.232   5.394 -10.700
  587   HG12  ILE  73          HG12      ILE  73   2.161   3.412  -9.429
  588   HG13  ILE  73          HG13      ILE  73   2.316   3.342 -11.191
  589   HG21  ILE  73          HG21      ILE  73   4.028   6.344 -10.978
  590   HG22  ILE  73          HG22      ILE  73   2.554   6.990 -11.699
  591   HG23  ILE  73          HG23      ILE  73   3.222   5.464 -12.280
  592   HD11  ILE  73          HD11      ILE  73   4.645   3.961 -11.039
  593   HD12  ILE  73          HD12      ILE  73   4.328   2.572  -9.998
  594   HD13  ILE  73          HD13      ILE  73   4.501   4.180  -9.298
  595    H    VAL  74           H        VAL  74   4.743   6.276  -8.642
  596    HA   VAL  74           HA       VAL  74   4.846   9.099  -8.204
  597    HB   VAL  74           HB       VAL  74   6.990   8.721  -7.542
  598   HG11  VAL  74          HG11      VAL  74   6.369   5.804  -7.959
  599   HG12  VAL  74          HG12      VAL  74   5.698   6.784  -6.650
  600   HG13  VAL  74          HG13      VAL  74   7.441   6.527  -6.754
  601   HG21  VAL  74          HG21      VAL  74   8.666   7.475  -8.796
  602   HG22  VAL  74          HG22      VAL  74   7.809   8.593  -9.857
  603   HG23  VAL  74          HG23      VAL  74   7.420   6.872  -9.891
  604    H    LEU  75           H        LEU  75   5.762  10.642  -9.635
  605    HA   LEU  75           HA       LEU  75   4.862  10.397 -12.246
  606    HB2  LEU  75           HB2      LEU  75   5.364  12.528 -11.049
  607    HB3  LEU  75           HB3      LEU  75   7.071  12.220 -11.342
  608    HG   LEU  75           HG       LEU  75   6.486  12.091 -13.801
  609   HD11  LEU  75          HD11      LEU  75   4.418  13.234 -14.479
  610   HD12  LEU  75          HD12      LEU  75   3.939  13.339 -12.784
  611   HD13  LEU  75          HD13      LEU  75   4.099  11.763 -13.556
  612   HD21  LEU  75          HD21      LEU  75   6.490  14.521 -14.072
  613   HD22  LEU  75          HD22      LEU  75   7.629  14.003 -12.829
  614   HD23  LEU  75          HD23      LEU  75   6.082  14.710 -12.367
  615    H    TRP  76           H        TRP  76   5.538   8.739 -13.432
  616    HA   TRP  76           HA       TRP  76   8.419   8.292 -13.758
  617    HB2  TRP  76           HB2      TRP  76   5.993   6.639 -14.448
  618    HB3  TRP  76           HB3      TRP  76   7.592   6.253 -15.075
  619    HD1  TRP  76           HD1      TRP  76   5.363   5.684 -12.224
  620    HE1  TRP  76           HE1      TRP  76   6.556   4.364 -10.370
  621    HE3  TRP  76           HE3      TRP  76  10.142   6.125 -13.904
  622    HZ2  TRP  76           HZ2      TRP  76   9.168   3.597  -9.722
  623    HZ3  TRP  76           HZ3      TRP  76  11.945   5.061 -12.604
  624    HH2  TRP  76           HH2      TRP  76  11.462   3.832 -10.550
  625    H    THR  77           H        THR  77   9.245   9.576 -15.289
  626    HA   THR  77           HA       THR  77   7.805   9.830 -17.831
  627    HB   THR  77           HB       THR  77   9.452  11.601 -18.360
  628    HG1  THR  77           HG1      THR  77  10.825  12.316 -16.617
  629   HG21  THR  77          HG21      THR  77   8.663  13.252 -16.690
  630   HG22  THR  77          HG22      THR  77   8.019  11.924 -15.722
  631   HG23  THR  77          HG23      THR  77   7.359  12.248 -17.324
  632    H    GLY  78           H        GLY  78   9.600   9.949 -19.731
  633    HA2  GLY  78           HA2      GLY  78  10.550   7.353 -20.091
  634    HA3  GLY  78           HA3      GLY  78  11.100   8.753 -21.000
  635    H    ASP  79           H        ASP  79  12.305  10.242 -19.048
  636    HA   ASP  79           HA       ASP  79  14.818   8.917 -18.801
  637    HB2  ASP  79           HB2      ASP  79  13.913  11.510 -17.527
  638    HB3  ASP  79           HB3      ASP  79  15.576  10.970 -17.711
  639    H    GLN  80           H        GLN  80  12.216   9.749 -16.566
  640    HA   GLN  80           HA       GLN  80  13.582   9.074 -14.182
  641    HB2  GLN  80           HB2      GLN  80  11.281  10.360 -14.692
  642    HB3  GLN  80           HB3      GLN  80  10.622   8.779 -14.319
  643    HG2  GLN  80           HG2      GLN  80  12.505  10.192 -12.475
  644    HG3  GLN  80           HG3      GLN  80  10.771  10.505 -12.461
  645   HE21  GLN  80          HE21      GLN  80   9.365   8.890 -11.796
  646   HE22  GLN  80          HE22      GLN  80   9.915   7.521 -10.896
  647    H    GLU  81           H        GLU  81  11.573   7.201 -16.424
  648    HA   GLU  81           HA       GLU  81  11.471   4.880 -14.766
  649    HB2  GLU  81           HB2      GLU  81   9.827   5.393 -16.581
  650    HB3  GLU  81           HB3      GLU  81  11.081   5.024 -17.757
  651    HG2  GLU  81           HG2      GLU  81  11.215   2.752 -16.960
  652    HG3  GLU  81           HG3      GLU  81  10.045   3.101 -15.690
  653    H    LEU  82           H        LEU  82  13.585   6.000 -17.344
  654    HA   LEU  82           HA       LEU  82  15.144   3.678 -17.629
  655    HB2  LEU  82           HB2      LEU  82  15.309   5.560 -19.177
  656    HB3  LEU  82           HB3      LEU  82  15.955   6.573 -17.898
  657    HG   LEU  82           HG       LEU  82  17.867   4.883 -17.749
  658   HD11  LEU  82          HD11      LEU  82  18.315   3.607 -19.781
  659   HD12  LEU  82          HD12      LEU  82  16.760   4.110 -20.442
  660   HD13  LEU  82          HD13      LEU  82  16.820   3.090 -19.005
  661   HD21  LEU  82          HD21      LEU  82  19.065   5.937 -19.604
  662   HD22  LEU  82          HD22      LEU  82  18.156   7.100 -18.642
  663   HD23  LEU  82          HD23      LEU  82  17.539   6.580 -20.210
  664    H    GLU  83           H        GLU  83  15.269   6.361 -15.382
  665    HA   GLU  83           HA       GLU  83  17.642   5.881 -14.064
  666    HB2  GLU  83           HB2      GLU  83  16.264   7.829 -13.625
  667    HB3  GLU  83           HB3      GLU  83  14.992   6.821 -12.952
  668    HG2  GLU  83           HG2      GLU  83  16.535   6.159 -11.142
  669    HG3  GLU  83           HG3      GLU  83  17.730   7.281 -11.796
  670    H    LEU  84           H        LEU  84  14.432   4.518 -13.337
  671    HA   LEU  84           HA       LEU  84  15.227   2.852 -11.229
  672    HB2  LEU  84           HB2      LEU  84  12.885   3.324 -11.714
  673    HB3  LEU  84           HB3      LEU  84  13.009   2.463 -13.235
  674    HG   LEU  84           HG       LEU  84  13.516   0.379 -11.924
  675   HD11  LEU  84          HD11      LEU  84  12.908   0.345  -9.555
  676   HD12  LEU  84          HD12      LEU  84  12.672   2.092  -9.592
  677   HD13  LEU  84          HD13      LEU  84  14.278   1.413  -9.858
  678   HD21  LEU  84          HD21      LEU  84  11.202  -0.017 -11.272
  679   HD22  LEU  84          HD22      LEU  84  11.295   0.812 -12.826
  680   HD23  LEU  84          HD23      LEU  84  10.872   1.712 -11.368
  681    H    GLN  85           H        GLN  85  14.916   2.201 -14.700
  682    HA   GLN  85           HA       GLN  85  15.536  -0.501 -14.692
  683    HB2  GLN  85           HB2      GLN  85  14.693   0.756 -16.651
  684    HB3  GLN  85           HB3      GLN  85  16.261   1.533 -16.812
  685    HG2  GLN  85           HG2      GLN  85  16.529  -1.338 -16.749
  686    HG3  GLN  85           HG3      GLN  85  15.406  -0.830 -18.005
  687   HE21  GLN  85          HE21      GLN  85  18.108   1.112 -16.920
  688   HE22  GLN  85          HE22      GLN  85  19.018   0.987 -18.380
  689    H    ARG  86           H        ARG  86  17.750   2.278 -14.992
  690    HA   ARG  86           HA       ARG  86  20.083   0.684 -15.247
  691    HB2  ARG  86           HB2      ARG  86  19.794   3.547 -14.323
  692    HB3  ARG  86           HB3      ARG  86  21.314   2.772 -14.753
  693    HG2  ARG  86           HG2      ARG  86  20.433   2.415 -17.042
  694    HG3  ARG  86           HG3      ARG  86  18.981   3.306 -16.579
  695    HD2  ARG  86           HD2      ARG  86  20.558   4.751 -17.757
  696    HD3  ARG  86           HD3      ARG  86  20.328   5.279 -16.092
  697    HE   ARG  86           HE       ARG  86  22.682   3.752 -17.015
  698   HH11  ARG  86          HH11      ARG  86  21.236   6.251 -15.021
  699   HH12  ARG  86          HH12      ARG  86  22.745   6.718 -14.305
  700   HH21  ARG  86          HH21      ARG  86  24.661   4.386 -16.077
  701   HH22  ARG  86          HH22      ARG  86  24.684   5.653 -14.890
  702    H    LEU  87           H        LEU  87  18.641   2.364 -12.464
  703    HA   LEU  87           HA       LEU  87  20.717   1.752 -10.661
  704    HB2  LEU  87           HB2      LEU  87  18.792   3.486 -10.512
  705    HB3  LEU  87           HB3      LEU  87  17.875   2.172  -9.802
  706    HG   LEU  87           HG       LEU  87  19.663   1.963  -8.058
  707   HD11  LEU  87          HD11      LEU  87  21.174   3.878  -7.757
  708   HD12  LEU  87          HD12      LEU  87  20.632   4.527  -9.305
  709   HD13  LEU  87          HD13      LEU  87  21.499   2.991  -9.245
  710   HD21  LEU  87          HD21      LEU  87  17.568   3.173  -7.642
  711   HD22  LEU  87          HD22      LEU  87  18.318   4.656  -8.235
  712   HD23  LEU  87          HD23      LEU  87  18.925   3.885  -6.769
  713    H    PHE  88           H        PHE  88  17.638   0.125 -11.343
  714    HA   PHE  88           HA       PHE  88  17.662  -1.918  -9.509
  715    HB2  PHE  88           HB2      PHE  88  15.802  -1.671 -10.948
  716    HB3  PHE  88           HB3      PHE  88  16.799  -1.814 -12.388
  717    HD1  PHE  88           HD1      PHE  88  16.994  -3.833 -13.471
  718    HD2  PHE  88           HD2      PHE  88  15.598  -3.771  -9.452
  719    HE1  PHE  88           HE1      PHE  88  16.448  -6.218 -13.633
  720    HE2  PHE  88           HE2      PHE  88  15.047  -6.169  -9.612
  721    HZ   PHE  88           HZ       PHE  88  15.479  -7.388 -11.705
  722    H    GLU  89           H        GLU  89  19.337  -1.883 -12.645
  723    HA   GLU  89           HA       GLU  89  20.410  -4.501 -12.427
  724    HB2  GLU  89           HB2      GLU  89  21.337  -2.151 -14.079
  725    HB3  GLU  89           HB3      GLU  89  21.786  -3.834 -14.341
  726    HG2  GLU  89           HG2      GLU  89  18.926  -3.051 -14.280
  727    HG3  GLU  89           HG3      GLU  89  19.883  -2.756 -15.738
  728    H    GLU  90           H        GLU  90  21.326  -1.461 -11.204
  729    HA   GLU  90           HA       GLU  90  24.124  -1.977 -10.921
  730    HB2  GLU  90           HB2      GLU  90  22.221   0.150 -10.037
  731    HB3  GLU  90           HB3      GLU  90  23.892   0.155  -9.461
  732    HG2  GLU  90           HG2      GLU  90  23.010   0.217 -12.341
  733    HG3  GLU  90           HG3      GLU  90  23.528   1.614 -11.405
  734    H    PHE  91           H        PHE  91  21.296  -2.191  -8.806
  735    HA   PHE  91           HA       PHE  91  23.074  -2.984  -6.597
  736    HB2  PHE  91           HB2      PHE  91  20.240  -1.937  -6.543
  737    HB3  PHE  91           HB3      PHE  91  21.102  -2.522  -5.124
  738    HD1  PHE  91           HD1      PHE  91  20.011   0.340  -6.399
  739    HD2  PHE  91           HD2      PHE  91  23.725  -1.425  -5.324
  740    HE1  PHE  91           HE1      PHE  91  20.963   2.578  -6.041
  741    HE2  PHE  91           HE2      PHE  91  24.691   0.808  -4.968
  742    HZ   PHE  91           HZ       PHE  91  23.305   2.813  -5.324
  743    H    ARG  92           H        ARG  92  21.450  -4.516  -8.921
  744    HA   ARG  92           HA       ARG  92  19.842  -6.307  -7.386
  745    HB2  ARG  92           HB2      ARG  92  19.534  -7.570  -9.448
  746    HB3  ARG  92           HB3      ARG  92  19.259  -5.855  -9.695
  747    HG2  ARG  92           HG2      ARG  92  21.430  -5.627 -10.735
  748    HG3  ARG  92           HG3      ARG  92  21.775  -7.331 -10.426
  749    HD2  ARG  92           HD2      ARG  92  19.469  -6.328 -12.086
  750    HD3  ARG  92           HD3      ARG  92  21.015  -6.862 -12.752
  751    HE   ARG  92           HE       ARG  92  20.220  -8.970 -11.254
  752   HH11  ARG  92          HH11      ARG  92  18.687  -7.102 -13.801
  753   HH12  ARG  92          HH12      ARG  92  17.693  -8.431 -14.328
  754   HH21  ARG  92          HH21      ARG  92  18.936 -10.703 -11.965
  755   HH22  ARG  92          HH22      ARG  92  17.838 -10.476 -13.291
  756    H    ASP  93           H        ASP  93  23.160  -6.122  -7.880
  757    HA   ASP  93           HA       ASP  93  23.752  -8.918  -7.709
  758    HB2  ASP  93           HB2      ASP  93  25.418  -6.441  -7.277
  759    HB3  ASP  93           HB3      ASP  93  26.064  -8.065  -7.056
  760    H    SER  94           H        SER  94  22.336  -6.921  -5.554
  761    HA   SER  94           HA       SER  94  23.512  -8.254  -3.217
  762    HB2  SER  94           HB2      SER  94  23.364  -5.717  -3.286
  763    HB3  SER  94           HB3      SER  94  21.612  -5.896  -3.220
  764    HG   SER  94           HG       SER  94  23.536  -6.614  -1.271
  765    H    ASP  95           H        ASP  95  21.676  -8.549  -1.430
  766    HA   ASP  95           HA       ASP  95  19.925 -10.520  -2.571
  767    HB2  ASP  95           HB2      ASP  95  19.339 -11.093  -0.306
  768    HB3  ASP  95           HB3      ASP  95  21.075 -10.821  -0.373
  769    H    ASP  96           H        ASP  96  19.565  -7.287  -1.263
  770    HA   ASP  96           HA       ASP  96  16.742  -7.365  -2.095
  771    HB2  ASP  96           HB2      ASP  96  17.011  -7.246   0.396
  772    HB3  ASP  96           HB3      ASP  96  17.857  -5.719   0.186
  773    H    VAL  97           H        VAL  97  16.940  -6.429  -4.049
  774    HA   VAL  97           HA       VAL  97  18.768  -4.266  -4.498
  775    HB   VAL  97           HB       VAL  97  18.337  -5.876  -6.280
  776   HG11  VAL  97          HG11      VAL  97  16.226  -5.855  -7.529
  777   HG12  VAL  97          HG12      VAL  97  15.538  -4.772  -6.316
  778   HG13  VAL  97          HG13      VAL  97  16.017  -6.409  -5.867
  779   HG21  VAL  97          HG21      VAL  97  19.068  -3.649  -6.911
  780   HG22  VAL  97          HG22      VAL  97  17.393  -3.103  -6.985
  781   HG23  VAL  97          HG23      VAL  97  17.979  -4.312  -8.129
  782    H    LEU  98           H        LEU  98  15.336  -4.579  -3.909
  783    HA   LEU  98           HA       LEU  98  14.574  -2.082  -4.982
  784    HB2  LEU  98           HB2      LEU  98  13.294  -4.305  -3.759
  785    HB3  LEU  98           HB3      LEU  98  12.746  -2.846  -2.953
  786    HG   LEU  98           HG       LEU  98  12.186  -1.902  -5.202
  787   HD11  LEU  98          HD11      LEU  98  13.562  -3.211  -6.641
  788   HD12  LEU  98          HD12      LEU  98  11.876  -3.555  -7.032
  789   HD13  LEU  98          HD13      LEU  98  12.813  -4.705  -6.081
  790   HD21  LEU  98          HD21      LEU  98  10.475  -2.837  -3.767
  791   HD22  LEU  98          HD22      LEU  98  10.801  -4.449  -4.404
  792   HD23  LEU  98          HD23      LEU  98  10.138  -3.199  -5.458
  793    H    GLY  99           H        GLY  99  15.377  -3.093  -1.671
  794    HA2  GLY  99           HA2      GLY  99  14.658  -0.656  -0.427
  795    HA3  GLY  99           HA3      GLY  99  15.793  -1.839   0.213
  796    H    HIS 100           H        HIS 100  17.533  -1.656  -2.128
  797    HA   HIS 100           HA       HIS 100  19.150   0.538  -1.227
  798    HB2  HIS 100           HB2      HIS 100  19.516  -1.411  -3.521
  799    HB3  HIS 100           HB3      HIS 100  20.714  -0.215  -3.041
  800    HD1  HIS 100           HD1      HIS 100  22.458  -2.018  -2.422
  801    HD2  HIS 100           HD2      HIS 100  18.906  -2.312  -0.286
  802    HE1  HIS 100           HE1      HIS 100  22.904  -3.673  -0.586
  803    HE2  HIS 100           HE2      HIS 100  20.683  -3.981   0.558
  804    H    ILE 101           H        ILE 101  17.059  -0.178  -3.929
  805    HA   ILE 101           HA       ILE 101  17.528   2.060  -5.543
  806    HB   ILE 101           HB       ILE 101  14.876   0.695  -5.001
  807   HG12  ILE 101          HG12      ILE 101  16.535  -0.907  -5.783
  808   HG13  ILE 101          HG13      ILE 101  15.341  -0.605  -7.041
  809   HG21  ILE 101          HG21      ILE 101  14.621   2.882  -6.062
  810   HG22  ILE 101          HG22      ILE 101  14.164   1.573  -7.152
  811   HG23  ILE 101          HG23      ILE 101  15.716   2.386  -7.353
  812   HD11  ILE 101          HD11      ILE 101  16.905   0.861  -8.183
  813   HD12  ILE 101          HD12      ILE 101  17.596  -0.743  -7.942
  814   HD13  ILE 101          HD13      ILE 101  18.095   0.594  -6.912
  815    H    MET 102           H        MET 102  15.233   1.581  -2.891
  816    HA   MET 102           HA       MET 102  14.059   4.158  -3.053
  817    HB2  MET 102           HB2      MET 102  14.105   2.421  -0.589
  818    HB3  MET 102           HB3      MET 102  12.866   3.565  -1.095
  819    HG2  MET 102           HG2      MET 102  12.045   2.142  -2.732
  820    HG3  MET 102           HG3      MET 102  13.500   1.151  -2.742
  821    HE1  MET 102           HE1      MET 102  10.034   1.798  -1.242
  822    HE2  MET 102           HE2      MET 102  11.044   2.498   0.025
  823    HE3  MET 102           HE3      MET 102  10.109   1.037   0.349
  824    H    LYS 103           H        LYS 103  16.723   2.824  -1.207
  825    HA   LYS 103           HA       LYS 103  16.812   5.031   0.633
  826    HB2  LYS 103           HB2      LYS 103  17.641   2.432   0.729
  827    HB3  LYS 103           HB3      LYS 103  19.160   3.273   0.464
  828    HG2  LYS 103           HG2      LYS 103  18.859   3.008   2.811
  829    HG3  LYS 103           HG3      LYS 103  18.629   4.715   2.423
  830    HD2  LYS 103           HD2      LYS 103  16.216   4.435   2.491
  831    HD3  LYS 103           HD3      LYS 103  16.405   2.704   2.779
  832    HE2  LYS 103           HE2      LYS 103  17.359   4.901   4.612
  833    HE3  LYS 103           HE3      LYS 103  15.892   3.947   4.835
  834    HZ1  LYS 103           HZ1      LYS 103  17.700   3.088   6.172
  835    HZ2  LYS 103           HZ2      LYS 103  18.664   2.883   4.802
  836    HZ3  LYS 103           HZ3      LYS 103  17.264   1.957   4.995
  837    H    ASN 104           H        ASN 104  18.130   4.389  -2.460
  838    HA   ASN 104           HA       ASN 104  20.132   6.531  -2.075
  839    HB2  ASN 104           HB2      ASN 104  20.969   4.184  -2.591
  840    HB3  ASN 104           HB3      ASN 104  20.242   4.373  -4.182
  841   HD21  ASN 104          HD21      ASN 104  22.139   4.309  -5.303
  842   HD22  ASN 104          HD22      ASN 104  23.328   5.559  -5.225
  843    H    ILE 105           H        ILE 105  17.170   6.411  -3.121
  844    HA   ILE 105           HA       ILE 105  17.639   7.346  -5.851
  845    HB   ILE 105           HB       ILE 105  15.993   5.520  -5.408
  846   HG12  ILE 105          HG12      ILE 105  14.238   6.453  -6.934
  847   HG13  ILE 105          HG13      ILE 105  15.038   8.016  -6.791
  848   HG21  ILE 105          HG21      ILE 105  13.772   6.097  -4.598
  849   HG22  ILE 105          HG22      ILE 105  14.317   7.739  -4.273
  850   HG23  ILE 105          HG23      ILE 105  14.999   6.390  -3.368
  851   HD11  ILE 105          HD11      ILE 105  16.288   5.501  -7.864
  852   HD12  ILE 105          HD12      ILE 105  17.061   7.080  -7.758
  853   HD13  ILE 105          HD13      ILE 105  15.679   6.845  -8.827
  854    H    THR 106           H        THR 106  16.442   9.126  -6.680
  855    HA   THR 106           HA       THR 106  16.604  11.425  -4.981
  856    HB   THR 106           HB       THR 106  17.246  11.227  -7.442
  857    HG1  THR 106           HG1      THR 106  16.200  13.457  -7.811
  858   HG21  THR 106          HG21      THR 106  15.494  11.748  -9.088
  859   HG22  THR 106          HG22      THR 106  14.275  11.641  -7.821
  860   HG23  THR 106          HG23      THR 106  15.191  10.209  -8.283
  861    H    ALA 107           H        ALA 107  14.093   9.291  -5.983
  862    HA   ALA 107           HA       ALA 107  11.996  11.268  -5.433
  863    HB1  ALA 107           HB1      ALA 107  11.789   8.563  -6.756
  864    HB2  ALA 107           HB2      ALA 107  11.894  10.108  -7.602
  865    HB3  ALA 107           HB3      ALA 107  10.490   9.745  -6.596
  866    H    LYS 108           H        LYS 108  10.008  10.380  -4.329
  867    HA   LYS 108           HA       LYS 108  10.752   8.625  -2.129
  868    HB2  LYS 108           HB2      LYS 108   8.125  10.033  -2.633
  869    HB3  LYS 108           HB3      LYS 108   8.588   9.196  -1.160
  870    HG2  LYS 108           HG2      LYS 108  10.202  11.500  -2.158
  871    HG3  LYS 108           HG3      LYS 108   8.706  11.773  -1.271
  872    HD2  LYS 108           HD2      LYS 108  10.488  11.875   0.303
  873    HD3  LYS 108           HD3      LYS 108   9.644  10.354   0.573
  874    HE2  LYS 108           HE2      LYS 108  11.380   9.094  -0.353
  875    HE3  LYS 108           HE3      LYS 108  12.079  10.487  -1.181
  876    HZ1  LYS 108           HZ1      LYS 108  12.731  11.372   0.967
  877    HZ2  LYS 108           HZ2      LYS 108  13.382   9.832   0.742
  878    HZ3  LYS 108           HZ3      LYS 108  12.048  10.043   1.758
  879    H    ARG 109           H        ARG 109  10.760   6.572  -2.682
  880    HA   ARG 109           HA       ARG 109   8.588   5.589  -4.412
  881    HB2  ARG 109           HB2      ARG 109  11.383   4.473  -4.090
  882    HB3  ARG 109           HB3      ARG 109  10.138   3.852  -5.164
  883    HG2  ARG 109           HG2      ARG 109  10.517   6.612  -5.728
  884    HG3  ARG 109           HG3      ARG 109  12.093   5.819  -5.683
  885    HD2  ARG 109           HD2      ARG 109  10.399   4.072  -7.073
  886    HD3  ARG 109           HD3      ARG 109  10.034   5.682  -7.686
  887    HE   ARG 109           HE       ARG 109  12.539   4.229  -7.951
  888   HH11  ARG 109          HH11      ARG 109  10.855   7.267  -8.312
  889   HH12  ARG 109          HH12      ARG 109  11.955   7.881  -9.508
  890   HH21  ARG 109          HH21      ARG 109  14.010   5.067  -9.520
  891   HH22  ARG 109          HH22      ARG 109  13.763   6.669 -10.157
  892    H    SER 110           H        SER 110   7.177   4.352  -3.334
  893    HA   SER 110           HA       SER 110   8.182   2.652  -1.179
  894    HB2  SER 110           HB2      SER 110   5.783   2.087  -0.798
  895    HB3  SER 110           HB3      SER 110   6.112   3.813  -0.652
  896    HG   SER 110           HG       SER 110   4.324   2.666  -2.166
  897    H    ARG 111           H        ARG 111   7.761   0.334  -1.269
  898    HA   ARG 111           HA       ARG 111   8.843  -0.663  -3.652
  899    HB2  ARG 111           HB2      ARG 111   7.591  -2.084  -1.314
  900    HB3  ARG 111           HB3      ARG 111   8.373  -2.923  -2.650
  901    HG2  ARG 111           HG2      ARG 111  10.449  -1.676  -2.161
  902    HG3  ARG 111           HG3      ARG 111   9.649  -0.954  -0.765
  903    HD2  ARG 111           HD2      ARG 111   9.431  -3.069   0.299
  904    HD3  ARG 111           HD3      ARG 111   9.935  -3.921  -1.160
  905    HE   ARG 111           HE       ARG 111  12.068  -2.369  -0.624
  906   HH11  ARG 111          HH11      ARG 111  10.170  -4.506   1.392
  907   HH12  ARG 111          HH12      ARG 111  11.514  -5.007   2.362
  908   HH21  ARG 111          HH21      ARG 111  13.861  -3.040   0.659
  909   HH22  ARG 111          HH22      ARG 111  13.612  -4.176   1.939
  910    H    ALA 112           H        ALA 112   5.533  -0.558  -2.514
  911    HA   ALA 112           HA       ALA 112   4.304  -2.293  -4.286
  912    HB1  ALA 112           HB1      ALA 112   3.227   0.356  -3.328
  913    HB2  ALA 112           HB2      ALA 112   3.157  -1.160  -2.432
  914    HB3  ALA 112           HB3      ALA 112   2.280  -0.995  -3.952
  915    H    ARG 113           H        ARG 113   5.436   1.001  -4.813
  916    HA   ARG 113           HA       ARG 113   4.147   1.173  -7.411
  917    HB2  ARG 113           HB2      ARG 113   6.211   3.136  -6.528
  918    HB3  ARG 113           HB3      ARG 113   4.734   3.401  -7.439
  919    HG2  ARG 113           HG2      ARG 113   3.435   3.049  -5.372
  920    HG3  ARG 113           HG3      ARG 113   4.956   2.906  -4.481
  921    HD2  ARG 113           HD2      ARG 113   5.514   5.165  -5.630
  922    HD3  ARG 113           HD3      ARG 113   3.765   5.282  -5.843
  923    HE   ARG 113           HE       ARG 113   4.544   4.695  -3.134
  924   HH11  ARG 113          HH11      ARG 113   4.075   7.269  -5.479
  925   HH12  ARG 113          HH12      ARG 113   3.838   8.500  -4.284
  926   HH21  ARG 113          HH21      ARG 113   4.217   6.346  -1.545
  927   HH22  ARG 113          HH22      ARG 113   3.911   7.975  -2.056
  928    H    ILE 114           H        ILE 114   7.250   0.445  -6.047
  929    HA   ILE 114           HA       ILE 114   8.783   0.853  -8.410
  930    HB   ILE 114           HB       ILE 114   9.402  -0.816  -5.969
  931   HG12  ILE 114          HG12      ILE 114  10.334   1.947  -6.746
  932   HG13  ILE 114          HG13      ILE 114   9.073   1.609  -5.565
  933   HG21  ILE 114          HG21      ILE 114  11.740  -0.711  -6.716
  934   HG22  ILE 114          HG22      ILE 114  11.227   0.095  -8.197
  935   HG23  ILE 114          HG23      ILE 114  10.717  -1.565  -7.874
  936   HD11  ILE 114          HD11      ILE 114  11.953   0.764  -5.356
  937   HD12  ILE 114          HD12      ILE 114  10.691   0.423  -4.169
  938   HD13  ILE 114          HD13      ILE 114  11.189   2.088  -4.480
  939    H    VAL 115           H        VAL 115   7.414  -2.009  -6.813
  940    HA   VAL 115           HA       VAL 115   8.452  -3.842  -8.693
  941    HB   VAL 115           HB       VAL 115   6.997  -5.496  -7.739
  942   HG11  VAL 115          HG11      VAL 115   7.957  -3.666  -5.558
  943   HG12  VAL 115          HG12      VAL 115   8.973  -4.785  -6.463
  944   HG13  VAL 115          HG13      VAL 115   7.680  -5.404  -5.433
  945   HG21  VAL 115          HG21      VAL 115   5.608  -3.280  -6.240
  946   HG22  VAL 115          HG22      VAL 115   5.276  -5.007  -6.103
  947   HG23  VAL 115          HG23      VAL 115   4.931  -4.160  -7.612
  948    H    ASP 116           H        ASP 116   5.414  -2.063  -8.489
  949    HA   ASP 116           HA       ASP 116   4.047  -3.222 -10.611
  950    HB2  ASP 116           HB2      ASP 116   2.927  -1.643  -9.242
  951    HB3  ASP 116           HB3      ASP 116   4.107  -0.385  -9.589
  952    H    LYS 117           H        LYS 117   6.451  -0.610 -10.637
  953    HA   LYS 117           HA       LYS 117   6.326  -0.321 -13.461
  954    HB2  LYS 117           HB2      LYS 117   7.885   0.880 -11.267
  955    HB3  LYS 117           HB3      LYS 117   8.662   0.868 -12.852
  956    HG2  LYS 117           HG2      LYS 117   5.907   1.942 -12.301
  957    HG3  LYS 117           HG3      LYS 117   7.371   2.924 -12.393
  958    HD2  LYS 117           HD2      LYS 117   7.708   2.246 -14.699
  959    HD3  LYS 117           HD3      LYS 117   6.300   1.186 -14.622
  960    HE2  LYS 117           HE2      LYS 117   4.872   3.138 -14.213
  961    HE3  LYS 117           HE3      LYS 117   6.285   4.184 -14.317
  962    HZ1  LYS 117           HZ1      LYS 117   5.134   4.194 -16.398
  963    HZ2  LYS 117           HZ2      LYS 117   5.161   2.508 -16.488
  964    HZ3  LYS 117           HZ3      LYS 117   6.609   3.381 -16.607
  965    H    LEU 118           H        LEU 118   8.406  -2.131 -11.268
  966    HA   LEU 118           HA       LEU 118  10.409  -2.817 -13.124
  967    HB2  LEU 118           HB2      LEU 118   9.946  -3.342 -10.467
  968    HB3  LEU 118           HB3      LEU 118   9.736  -4.921 -11.212
  969    HG   LEU 118           HG       LEU 118  11.994  -4.577 -12.296
  970   HD11  LEU 118          HD11      LEU 118  13.500  -2.977 -11.248
  971   HD12  LEU 118          HD12      LEU 118  12.177  -2.371 -10.252
  972   HD13  LEU 118          HD13      LEU 118  12.133  -2.158 -12.003
  973   HD21  LEU 118          HD21      LEU 118  11.688  -6.079 -10.441
  974   HD22  LEU 118          HD22      LEU 118  11.807  -4.741  -9.296
  975   HD23  LEU 118          HD23      LEU 118  13.211  -5.209 -10.260
  976    H    LEU 119           H        LEU 119   7.426  -4.486 -12.193
  977    HA   LEU 119           HA       LEU 119   7.801  -6.676 -13.985
  978    HB2  LEU 119           HB2      LEU 119   5.491  -5.640 -12.382
  979    HB3  LEU 119           HB3      LEU 119   5.249  -6.914 -13.561
  980    HG   LEU 119           HG       LEU 119   7.003  -8.259 -12.358
  981   HD11  LEU 119          HD11      LEU 119   7.435  -7.690  -9.999
  982   HD12  LEU 119          HD12      LEU 119   6.654  -6.126 -10.254
  983   HD13  LEU 119          HD13      LEU 119   8.140  -6.527 -11.122
  984   HD21  LEU 119          HD21      LEU 119   5.490  -8.974 -10.587
  985   HD22  LEU 119          HD22      LEU 119   4.638  -8.714 -12.107
  986   HD23  LEU 119          HD23      LEU 119   4.527  -7.516 -10.818
  987    H    ALA 120           H        ALA 120   6.723  -3.482 -14.340
  988    HA   ALA 120           HA       ALA 120   5.093  -4.008 -16.660
  989    HB1  ALA 120           HB1      ALA 120   4.639  -2.206 -14.997
  990    HB2  ALA 120           HB2      ALA 120   4.657  -1.673 -16.681
  991    HB3  ALA 120           HB3      ALA 120   6.042  -1.346 -15.637
  992    H    LEU 121           H        LEU 121   8.293  -2.679 -15.940
  993    HA   LEU 121           HA       LEU 121   9.164  -2.458 -18.637
  994    HB2  LEU 121           HB2      LEU 121  10.539  -2.773 -15.990
  995    HB3  LEU 121           HB3      LEU 121  11.458  -2.931 -17.470
  996    HG   LEU 121           HG       LEU 121  10.903  -0.646 -18.093
  997   HD11  LEU 121          HD11      LEU 121   9.413  -0.541 -15.481
  998   HD12  LEU 121          HD12      LEU 121   8.704  -0.450 -17.094
  999   HD13  LEU 121          HD13      LEU 121   9.760   0.840 -16.521
 1000   HD21  LEU 121          HD21      LEU 121  12.895  -1.020 -16.798
 1001   HD22  LEU 121          HD22      LEU 121  11.970  -0.973 -15.298
 1002   HD23  LEU 121          HD23      LEU 121  12.141   0.489 -16.277
 1003    H    GLY 122           H        GLY 122   8.641  -5.034 -16.448
 1004    HA2  GLY 122           HA2      GLY 122   8.645  -7.302 -16.758
 1005    HA3  GLY 122           HA3      GLY 122   9.130  -7.039 -18.432
 1006    H    LEU 123           H        LEU 123  10.835  -5.780 -15.650
 1007    HA   LEU 123           HA       LEU 123  13.286  -7.034 -16.457
 1008    HB2  LEU 123           HB2      LEU 123  12.500  -5.428 -14.020
 1009    HB3  LEU 123           HB3      LEU 123  14.132  -6.023 -14.301
 1010    HG   LEU 123           HG       LEU 123  12.650  -4.101 -16.103
 1011   HD11  LEU 123          HD11      LEU 123  14.247  -2.432 -15.285
 1012   HD12  LEU 123          HD12      LEU 123  14.880  -3.612 -14.137
 1013   HD13  LEU 123          HD13      LEU 123  13.215  -3.048 -13.994
 1014   HD21  LEU 123          HD21      LEU 123  15.489  -5.114 -16.165
 1015   HD22  LEU 123          HD22      LEU 123  14.856  -3.803 -17.162
 1016   HD23  LEU 123          HD23      LEU 123  14.225  -5.438 -17.353
 1017    H    VAL 124           H        VAL 124  10.691  -7.630 -14.348
 1018    HA   VAL 124           HA       VAL 124  11.718 -10.305 -13.732
 1019    HB   VAL 124           HB       VAL 124  10.816 -10.129 -11.425
 1020   HG11  VAL 124          HG11      VAL 124  12.677  -8.860 -10.486
 1021   HG12  VAL 124          HG12      VAL 124  12.983  -8.127 -12.059
 1022   HG13  VAL 124          HG13      VAL 124  13.215  -9.860 -11.834
 1023   HG21  VAL 124          HG21      VAL 124   9.257  -8.299 -11.808
 1024   HG22  VAL 124          HG22      VAL 124  10.605  -7.191 -12.076
 1025   HG23  VAL 124          HG23      VAL 124  10.360  -7.914 -10.488
 1026    H    ALA 125           H        ALA 125   9.932 -11.760 -13.054
 1027    HA   ALA 125           HA       ALA 125   7.415 -10.939 -14.325
 1028    HB1  ALA 125           HB1      ALA 125   6.878 -13.317 -14.441
 1029    HB2  ALA 125           HB2      ALA 125   8.378 -13.702 -13.590
 1030    HB3  ALA 125           HB3      ALA 125   8.434 -12.980 -15.200
 1031    H    GLU 126           H        GLU 126   8.841 -11.370 -11.320
 1032    HA   GLU 126           HA       GLU 126   6.306 -11.026  -9.974
 1033    HB2  GLU 126           HB2      GLU 126   6.632 -12.906  -8.455
 1034    HB3  GLU 126           HB3      GLU 126   6.510 -13.467 -10.116
 1035    HG2  GLU 126           HG2      GLU 126   8.970 -13.625 -10.206
 1036    HG3  GLU 126           HG3      GLU 126   9.035 -13.162  -8.510
 1037    H    ARG 127           H        ARG 127   6.773 -10.894  -7.507
 1038    HA   ARG 127           HA       ARG 127   8.805  -8.868  -7.228
 1039    HB2  ARG 127           HB2      ARG 127   6.712  -9.957  -5.352
 1040    HB3  ARG 127           HB3      ARG 127   7.912  -8.784  -4.839
 1041    HG2  ARG 127           HG2      ARG 127   5.938  -7.588  -5.363
 1042    HG3  ARG 127           HG3      ARG 127   7.104  -7.271  -6.643
 1043    HD2  ARG 127           HD2      ARG 127   4.900  -7.630  -7.584
 1044    HD3  ARG 127           HD3      ARG 127   5.985  -8.936  -8.057
 1045    HE   ARG 127           HE       ARG 127   4.445  -9.531  -5.704
 1046   HH11  ARG 127          HH11      ARG 127   4.426  -9.570  -9.212
 1047   HH12  ARG 127          HH12      ARG 127   3.231 -10.821  -9.322
 1048   HH21  ARG 127          HH21      ARG 127   2.850 -11.167  -5.855
 1049   HH22  ARG 127          HH22      ARG 127   2.322 -11.710  -7.417
 1050    H    ARG 128           H        ARG 128   8.520 -12.203  -6.617
 1051    HA   ARG 128           HA       ARG 128  10.125 -12.601  -4.397
 1052    HB2  ARG 128           HB2      ARG 128   8.891 -14.421  -5.125
 1053    HB3  ARG 128           HB3      ARG 128   9.419 -14.246  -6.788
 1054    HG2  ARG 128           HG2      ARG 128  11.580 -15.153  -6.250
 1055    HG3  ARG 128           HG3      ARG 128  11.168 -15.199  -4.531
 1056    HD2  ARG 128           HD2      ARG 128   9.765 -16.729  -6.719
 1057    HD3  ARG 128           HD3      ARG 128  10.944 -17.405  -5.596
 1058    HE   ARG 128           HE       ARG 128   9.233 -16.588  -3.841
 1059   HH11  ARG 128          HH11      ARG 128   8.418 -17.889  -6.992
 1060   HH12  ARG 128          HH12      ARG 128   6.907 -18.547  -6.460
 1061   HH21  ARG 128          HH21      ARG 128   7.236 -17.428  -3.156
 1062   HH22  ARG 128          HH22      ARG 128   6.225 -18.277  -4.282
 1063    H    GLU 129           H        GLU 129  11.123 -12.096  -7.750
 1064    HA   GLU 129           HA       GLU 129  13.787 -13.035  -7.332
 1065    HB2  GLU 129           HB2      GLU 129  12.578 -11.425  -9.572
 1066    HB3  GLU 129           HB3      GLU 129  14.198 -12.104  -9.591
 1067    HG2  GLU 129           HG2      GLU 129  11.652 -13.677  -9.327
 1068    HG3  GLU 129           HG3      GLU 129  12.588 -13.482 -10.808
 1069    H    LEU 130           H        LEU 130  12.261 -10.057  -6.678
 1070    HA   LEU 130           HA       LEU 130  14.756  -8.554  -6.855
 1071    HB2  LEU 130           HB2      LEU 130  12.911  -6.831  -5.760
 1072    HB3  LEU 130           HB3      LEU 130  13.356  -6.931  -7.450
 1073    HG   LEU 130           HG       LEU 130  11.097  -8.553  -6.301
 1074   HD11  LEU 130          HD11      LEU 130  11.002  -5.796  -7.500
 1075   HD12  LEU 130          HD12      LEU 130  10.599  -6.240  -5.840
 1076   HD13  LEU 130          HD13      LEU 130   9.601  -6.815  -7.177
 1077   HD21  LEU 130          HD21      LEU 130  10.339  -8.585  -8.625
 1078   HD22  LEU 130          HD22      LEU 130  11.954  -9.274  -8.468
 1079   HD23  LEU 130          HD23      LEU 130  11.752  -7.638  -9.100
 1080    H    TYR 131           H        TYR 131  13.090 -10.399  -4.645
 1081    HA   TYR 131           HA       TYR 131  14.702  -9.288  -2.433
 1082    HB2  TYR 131           HB2      TYR 131  12.157 -10.897  -2.112
 1083    HB3  TYR 131           HB3      TYR 131  13.038 -10.026  -0.863
 1084    HD1  TYR 131           HD1      TYR 131  13.281  -7.384  -1.431
 1085    HD2  TYR 131           HD2      TYR 131  10.210  -9.964  -2.843
 1086    HE1  TYR 131           HE1      TYR 131  11.797  -5.444  -1.743
 1087    HE2  TYR 131           HE2      TYR 131   8.727  -8.041  -3.168
 1088    HH   TYR 131           HH       TYR 131   8.468  -5.753  -2.283
 1089    H    LYS 132           H        LYS 132  15.935 -10.878  -4.115
 1090    HA   LYS 132           HA       LYS 132  15.679 -13.640  -3.134
 1091    HB2  LYS 132           HB2      LYS 132  14.781 -13.082  -5.482
 1092    HB3  LYS 132           HB3      LYS 132  16.463 -12.882  -5.942
 1093    HG2  LYS 132           HG2      LYS 132  15.917 -15.054  -6.580
 1094    HG3  LYS 132           HG3      LYS 132  16.812 -15.246  -5.069
 1095    HD2  LYS 132           HD2      LYS 132  14.807 -15.610  -3.838
 1096    HD3  LYS 132           HD3      LYS 132  13.806 -15.128  -5.209
 1097    HE2  LYS 132           HE2      LYS 132  15.560 -17.573  -5.028
 1098    HE3  LYS 132           HE3      LYS 132  13.797 -17.539  -4.975
 1099    HZ1  LYS 132           HZ1      LYS 132  14.343 -18.111  -7.160
 1100    HZ2  LYS 132           HZ2      LYS 132  15.569 -16.957  -7.269
 1101    HZ3  LYS 132           HZ3      LYS 132  13.950 -16.463  -7.259
 1102    H    LYS 133           H        LYS 133  17.598 -14.781  -2.854
 1103    HA   LYS 133           HA       LYS 133  20.061 -13.321  -2.773
 1104    HB2  LYS 133           HB2      LYS 133  19.652 -16.318  -2.675
 1105    HB3  LYS 133           HB3      LYS 133  21.098 -15.447  -2.183
 1106    HG2  LYS 133           HG2      LYS 133  19.714 -14.301  -0.441
 1107    HG3  LYS 133           HG3      LYS 133  18.397 -15.396  -0.861
 1108    HD2  LYS 133           HD2      LYS 133  19.478 -16.350   1.016
 1109    HD3  LYS 133           HD3      LYS 133  19.985 -17.302  -0.378
 1110    HE2  LYS 133           HE2      LYS 133  22.093 -16.100  -0.466
 1111    HE3  LYS 133           HE3      LYS 133  21.581 -15.060   0.862
 1112    HZ1  LYS 133           HZ1      LYS 133  23.010 -16.742   1.719
 1113    HZ2  LYS 133           HZ2      LYS 133  22.120 -17.974   0.983
 1114    HZ3  LYS 133           HZ3      LYS 133  21.444 -17.091   2.254
 1115    H    ARG 134           H        ARG 134  21.908 -13.698  -4.113
 1116    HA   ARG 134           HA       ARG 134  21.158 -13.970  -6.867
 1117    HB2  ARG 134           HB2      ARG 134  23.548 -13.066  -5.396
 1118    HB3  ARG 134           HB3      ARG 134  23.851 -13.773  -6.975
 1119    HG2  ARG 134           HG2      ARG 134  23.560 -11.262  -6.882
 1120    HG3  ARG 134           HG3      ARG 134  22.598 -12.126  -8.079
 1121    HD2  ARG 134           HD2      ARG 134  21.422 -11.604  -5.393
 1122    HD3  ARG 134           HD3      ARG 134  21.534 -10.271  -6.542
 1123    HE   ARG 134           HE       ARG 134  20.362 -12.606  -7.707
 1124   HH11  ARG 134          HH11      ARG 134  19.685  -9.821  -5.699
 1125   HH12  ARG 134          HH12      ARG 134  17.993  -9.809  -6.071
 1126   HH21  ARG 134          HH21      ARG 134  18.145 -12.589  -8.214
 1127   HH22  ARG 134          HH22      ARG 134  17.105 -11.382  -7.519
 1128    H    GLN 135           H        GLN 135  20.469 -16.093  -6.940
 1129    HA   GLN 135           HA       GLN 135  22.276 -18.276  -6.539
 1130    HB2  GLN 135           HB2      GLN 135  20.539 -19.654  -7.527
 1131    HB3  GLN 135           HB3      GLN 135  19.808 -18.531  -6.391
 1132    HG2  GLN 135           HG2      GLN 135  19.162 -17.082  -8.266
 1133    HG3  GLN 135           HG3      GLN 135  19.859 -18.249  -9.386
 1134   HE21  GLN 135          HE21      GLN 135  17.159 -17.301  -9.271
 1135   HE22  GLN 135          HE22      GLN 135  16.149 -18.684  -9.001
 1136    H    LYS 136           H        LYS 136  23.556 -19.300  -8.011
 1137    HA   LYS 136           HA       LYS 136  23.686 -18.092 -10.678
 1138    HB2  LYS 136           HB2      LYS 136  25.650 -19.825  -9.173
 1139    HB3  LYS 136           HB3      LYS 136  25.835 -19.433 -10.877
 1140    HG2  LYS 136           HG2      LYS 136  27.182 -17.888  -9.765
 1141    HG3  LYS 136           HG3      LYS 136  25.718 -16.993 -10.159
 1142    HD2  LYS 136           HD2      LYS 136  24.896 -17.417  -7.865
 1143    HD3  LYS 136           HD3      LYS 136  26.434 -18.197  -7.490
 1144    HE2  LYS 136           HE2      LYS 136  26.044 -15.328  -8.337
 1145    HE3  LYS 136           HE3      LYS 136  26.423 -15.891  -6.711
 1146    HZ1  LYS 136           HZ1      LYS 136  28.399 -15.105  -7.816
 1147    HZ2  LYS 136           HZ2      LYS 136  28.157 -16.172  -9.103
 1148    HZ3  LYS 136           HZ3      LYS 136  28.519 -16.774  -7.567
 1149    H    LYS 137           H        LYS 137  21.671 -19.117 -11.148
 1150    HA   LYS 137           HA       LYS 137  21.981 -21.801 -12.204
 1151    HB2  LYS 137           HB2      LYS 137  21.215 -22.045  -9.833
 1152    HB3  LYS 137           HB3      LYS 137  19.791 -21.102 -10.232
 1153    HG2  LYS 137           HG2      LYS 137  20.329 -23.522 -11.848
 1154    HG3  LYS 137           HG3      LYS 137  19.789 -23.743 -10.186
 1155    HD2  LYS 137           HD2      LYS 137  17.790 -22.494 -10.596
 1156    HD3  LYS 137           HD3      LYS 137  18.359 -22.011 -12.196
 1157    HE2  LYS 137           HE2      LYS 137  16.691 -23.816 -12.289
 1158    HE3  LYS 137           HE3      LYS 137  18.245 -24.299 -12.964
 1159    HZ1  LYS 137           HZ1      LYS 137  18.744 -25.451 -10.905
 1160    HZ2  LYS 137           HZ2      LYS 137  17.295 -26.021 -11.565
 1161    HZ3  LYS 137           HZ3      LYS 137  17.264 -24.969 -10.243
 1162    H    LEU 138           H        LEU 138  20.538 -22.217 -13.919
 1163    HA   LEU 138           HA       LEU 138  19.448 -19.903 -15.193
 1164    HB2  LEU 138           HB2      LEU 138  20.401 -21.718 -16.506
 1165    HB3  LEU 138           HB3      LEU 138  19.202 -22.832 -15.877
 1166    HG   LEU 138           HG       LEU 138  17.429 -21.456 -16.987
 1167   HD11  LEU 138          HD11      LEU 138  19.794 -20.086 -18.252
 1168   HD12  LEU 138          HD12      LEU 138  18.631 -19.354 -17.147
 1169   HD13  LEU 138          HD13      LEU 138  18.109 -19.895 -18.743
 1170   HD21  LEU 138          HD21      LEU 138  17.876 -22.287 -19.236
 1171   HD22  LEU 138          HD22      LEU 138  18.270 -23.498 -18.016
 1172   HD23  LEU 138          HD23      LEU 138  19.558 -22.583 -18.797
 1173    H    ALA 139           H        ALA 139  17.829 -19.051 -13.938
 1174    HA   ALA 139           HA       ALA 139  15.384 -20.682 -13.767
 1175    HB1  ALA 139           HB1      ALA 139  14.787 -19.511 -11.713
 1176    HB2  ALA 139           HB2      ALA 139  16.294 -18.599 -11.782
 1177    HB3  ALA 139           HB3      ALA 139  16.330 -20.345 -11.534
 1178    H    SER 140           H        SER 140  13.512 -19.737 -14.444
 1179    HA   SER 140           HA       SER 140  13.604 -16.878 -15.119
 1180    HB2  SER 140           HB2      SER 140  12.250 -19.064 -16.725
 1181    HB3  SER 140           HB3      SER 140  12.204 -17.340 -17.090
 1182    HG   SER 140           HG       SER 140  14.744 -18.018 -16.808
 1183    H    SER 141           H        SER 141  12.635 -16.420 -13.135
 1184    HA   SER 141           HA       SER 141  10.137 -17.716 -12.435
 1185    HB2  SER 141           HB2      SER 141  11.482 -15.440 -10.977
 1186    HB3  SER 141           HB3      SER 141  10.376 -16.646 -10.322
 1187    HG   SER 141           HG       SER 141  13.047 -16.735 -10.495
  Start of MODEL   16
    1    H1   ASP   1           HT1      ASP   1 -32.095  11.543 -10.007
    2    H2   ASP   1           HT2      ASP   1 -32.907  10.106  -9.658
    3    H3   ASP   1           HT3      ASP   1 -32.264  10.361 -11.201
    4    HA   ASP   1           HA       ASP   1 -30.895   8.844  -9.909
    5    HB2  ASP   1           HB2      ASP   1 -29.677  11.541 -10.524
    6    HB3  ASP   1           HB3      ASP   1 -28.738  10.094 -10.171
    7    HA   PRO   2           HA       PRO   2 -30.678  10.061  -5.570
    8    HB2  PRO   2           HB2      PRO   2 -29.648   7.402  -5.066
    9    HB3  PRO   2           HB3      PRO   2 -31.208   8.083  -4.602
   10    HG2  PRO   2           HG2      PRO   2 -30.919   6.102  -6.456
   11    HG3  PRO   2           HG3      PRO   2 -32.263   7.255  -6.450
   12    HD2  PRO   2           HD2      PRO   2 -29.781   7.244  -8.125
   13    HD3  PRO   2           HD3      PRO   2 -31.452   7.643  -8.580
   14    H    SER   3           H        SER   3 -28.329   9.339  -7.793
   15    HA   SER   3           HA       SER   3 -26.064   9.045  -6.073
   16    HB2  SER   3           HB2      SER   3 -24.808   9.283  -8.269
   17    HB3  SER   3           HB3      SER   3 -25.942   7.940  -8.159
   18    HG   SER   3           HG       SER   3 -26.253  10.401  -9.527
   19    H    ARG   4           H        ARG   4 -27.335  11.289  -5.273
   20    HA   ARG   4           HA       ARG   4 -25.951  13.626  -6.312
   21    HB2  ARG   4           HB2      ARG   4 -27.804  13.319  -3.931
   22    HB3  ARG   4           HB3      ARG   4 -27.201  14.845  -4.561
   23    HG2  ARG   4           HG2      ARG   4 -28.390  14.450  -6.660
   24    HG3  ARG   4           HG3      ARG   4 -28.998  12.919  -6.027
   25    HD2  ARG   4           HD2      ARG   4 -29.545  15.655  -4.876
   26    HD3  ARG   4           HD3      ARG   4 -30.666  14.701  -5.840
   27    HE   ARG   4           HE       ARG   4 -29.648  13.616  -3.308
   28   HH11  ARG   4          HH11      ARG   4 -32.332  14.844  -5.202
   29   HH12  ARG   4          HH12      ARG   4 -33.538  14.271  -4.095
   30   HH21  ARG   4          HH21      ARG   4 -31.233  12.866  -1.850
   31   HH22  ARG   4          HH22      ARG   4 -32.914  13.151  -2.183
   32    H    ARG   5           H        ARG   5 -25.439  14.983  -3.883
   33    HA   ARG   5           HA       ARG   5 -22.933  14.349  -3.114
   34    HB2  ARG   5           HB2      ARG   5 -23.867  16.329  -2.227
   35    HB3  ARG   5           HB3      ARG   5 -25.205  15.470  -1.485
   36    HG2  ARG   5           HG2      ARG   5 -23.569  16.296   0.153
   37    HG3  ARG   5           HG3      ARG   5 -23.742  14.543   0.192
   38    HD2  ARG   5           HD2      ARG   5 -21.402  15.184   0.376
   39    HD3  ARG   5           HD3      ARG   5 -21.695  14.309  -1.124
   40    HE   ARG   5           HE       ARG   5 -21.921  16.898  -1.874
   41   HH11  ARG   5          HH11      ARG   5 -19.469  15.134  -0.107
   42   HH12  ARG   5          HH12      ARG   5 -18.164  16.122  -0.677
   43   HH21  ARG   5          HH21      ARG   5 -20.205  18.196  -2.634
   44   HH22  ARG   5          HH22      ARG   5 -18.578  17.847  -2.139
   45    H    ALA   6           H        ALA   6 -22.097  12.485  -2.600
   46    HA   ALA   6           HA       ALA   6 -23.419  10.228  -1.715
   47    HB1  ALA   6           HB1      ALA   6 -21.214  10.174  -2.753
   48    HB2  ALA   6           HB2      ALA   6 -21.213   9.317  -1.210
   49    HB3  ALA   6           HB3      ALA   6 -20.514  10.933  -1.322
   50    HA   PRO   7           HA       PRO   7 -24.481  11.292   2.472
   51    HB2  PRO   7           HB2      PRO   7 -24.536   8.338   2.736
   52    HB3  PRO   7           HB3      PRO   7 -25.781   9.527   3.139
   53    HG2  PRO   7           HG2      PRO   7 -25.971   7.968   0.966
   54    HG3  PRO   7           HG3      PRO   7 -26.565   9.636   0.973
   55    HD2  PRO   7           HD2      PRO   7 -24.132   8.493  -0.290
   56    HD3  PRO   7           HD3      PRO   7 -25.139   9.862  -0.802
   57    H    THR   8           H        THR   8 -22.941  11.881   3.868
   58    HA   THR   8           HA       THR   8 -20.479  10.597   4.260
   59    HB   THR   8           HB       THR   8 -21.981  12.308   6.258
   60    HG1  THR   8           HG1      THR   8 -21.771  13.612   4.523
   61   HG21  THR   8          HG21      THR   8 -19.028  11.762   5.925
   62   HG22  THR   8          HG22      THR   8 -20.058  11.109   7.198
   63   HG23  THR   8          HG23      THR   8 -19.754  12.844   7.117
   64    H    TRP   9           H        TRP   9 -20.141   8.649   5.074
   65    HA   TRP   9           HA       TRP   9 -22.131   6.954   5.972
   66    HB2  TRP   9           HB2      TRP   9 -19.174   6.743   6.563
   67    HB3  TRP   9           HB3      TRP   9 -20.342   5.433   6.664
   68    HD1  TRP   9           HD1      TRP   9 -18.742   7.744   4.022
   69    HE1  TRP   9           HE1      TRP   9 -18.694   6.485   1.789
   70    HE3  TRP   9           HE3      TRP   9 -21.269   3.518   5.402
   71    HZ2  TRP   9           HZ2      TRP   9 -19.578   4.041   0.738
   72    HZ3  TRP   9           HZ3      TRP   9 -21.622   1.762   3.718
   73    HH2  TRP   9           HH2      TRP   9 -20.795   2.017   1.433
   74    H    SER  10           H        SER  10 -23.187   6.783   7.790
   75    HA   SER  10           HA       SER  10 -22.397   8.147  10.180
   76    HB2  SER  10           HB2      SER  10 -24.371   6.854  11.149
   77    HB3  SER  10           HB3      SER  10 -24.747   7.917   9.795
   78    HG   SER  10           HG       SER  10 -24.640   6.059   8.428
   79    HA   PRO  11           HA       PRO  11 -19.835   5.203  12.283
   80    HB2  PRO  11           HB2      PRO  11 -21.931   5.056  14.403
   81    HB3  PRO  11           HB3      PRO  11 -20.194   5.338  14.559
   82    HG2  PRO  11           HG2      PRO  11 -21.910   7.349  14.793
   83    HG3  PRO  11           HG3      PRO  11 -20.370   7.568  13.948
   84    HD2  PRO  11           HD2      PRO  11 -23.118   7.297  12.834
   85    HD3  PRO  11           HD3      PRO  11 -21.747   8.255  12.239
   86    H    GLU  12           H        GLU  12 -23.287   4.427  12.507
   87    HA   GLU  12           HA       GLU  12 -22.944   1.625  12.779
   88    HB2  GLU  12           HB2      GLU  12 -24.963   2.919  13.457
   89    HB3  GLU  12           HB3      GLU  12 -25.344   3.152  11.758
   90    HG2  GLU  12           HG2      GLU  12 -25.489   0.686  11.516
   91    HG3  GLU  12           HG3      GLU  12 -25.268   0.548  13.260
   92    H    GLU  13           H        GLU  13 -23.033   3.778  10.081
   93    HA   GLU  13           HA       GLU  13 -23.801   1.865   8.107
   94    HB2  GLU  13           HB2      GLU  13 -23.809   4.548   8.203
   95    HB3  GLU  13           HB3      GLU  13 -22.310   4.303   7.322
   96    HG2  GLU  13           HG2      GLU  13 -23.374   3.387   5.500
   97    HG3  GLU  13           HG3      GLU  13 -24.788   2.899   6.440
   98    H    GLU  14           H        GLU  14 -20.706   3.348   9.078
   99    HA   GLU  14           HA       GLU  14 -19.136   1.821   7.259
  100    HB2  GLU  14           HB2      GLU  14 -18.367   3.180   9.850
  101    HB3  GLU  14           HB3      GLU  14 -17.221   2.468   8.721
  102    HG2  GLU  14           HG2      GLU  14 -18.132   4.027   6.977
  103    HG3  GLU  14           HG3      GLU  14 -19.028   4.822   8.270
  104    H    ALA  15           H        ALA  15 -20.408   1.257  10.466
  105    HA   ALA  15           HA       ALA  15 -18.955  -1.075  11.096
  106    HB1  ALA  15           HB1      ALA  15 -20.774  -1.570  12.652
  107    HB2  ALA  15           HB2      ALA  15 -21.770  -0.328  11.891
  108    HB3  ALA  15           HB3      ALA  15 -20.299   0.126  12.750
  109    H    HIS  16           H        HIS  16 -21.870  -0.516   9.241
  110    HA   HIS  16           HA       HIS  16 -22.411  -3.251   8.681
  111    HB2  HIS  16           HB2      HIS  16 -24.091  -1.324   8.652
  112    HB3  HIS  16           HB3      HIS  16 -23.392  -0.867   7.103
  113    HD1  HIS  16           HD1      HIS  16 -26.284  -1.529   7.009
  114    HD2  HIS  16           HD2      HIS  16 -23.349  -4.441   6.640
  115    HE1  HIS  16           HE1      HIS  16 -27.391  -3.473   5.863
  116    HE2  HIS  16           HE2      HIS  16 -25.659  -5.300   5.864
  117    H    LEU  17           H        LEU  17 -20.576  -0.674   7.212
  118    HA   LEU  17           HA       LEU  17 -20.150  -1.827   4.679
  119    HB2  LEU  17           HB2      LEU  17 -19.667   0.551   5.375
  120    HB3  LEU  17           HB3      LEU  17 -18.244  -0.047   6.203
  121    HG   LEU  17           HG       LEU  17 -17.320  -0.821   4.060
  122   HD11  LEU  17          HD11      LEU  17 -19.330  -1.307   2.845
  123   HD12  LEU  17          HD12      LEU  17 -18.417  -0.082   1.966
  124   HD13  LEU  17          HD13      LEU  17 -19.828   0.382   2.914
  125   HD21  LEU  17          HD21      LEU  17 -16.762   1.408   4.859
  126   HD22  LEU  17          HD22      LEU  17 -18.182   2.066   4.046
  127   HD23  LEU  17          HD23      LEU  17 -16.862   1.377   3.099
  128    H    ARG  18           H        ARG  18 -18.212  -1.913   7.668
  129    HA   ARG  18           HA       ARG  18 -16.400  -3.871   6.676
  130    HB2  ARG  18           HB2      ARG  18 -15.599  -4.062   8.954
  131    HB3  ARG  18           HB3      ARG  18 -15.841  -2.366   8.575
  132    HG2  ARG  18           HG2      ARG  18 -18.067  -2.543   9.740
  133    HG3  ARG  18           HG3      ARG  18 -17.551  -4.134  10.296
  134    HD2  ARG  18           HD2      ARG  18 -16.109  -1.538  10.821
  135    HD3  ARG  18           HD3      ARG  18 -17.152  -2.377  11.964
  136    HE   ARG  18           HE       ARG  18 -14.930  -3.937  10.964
  137   HH11  ARG  18          HH11      ARG  18 -16.135  -1.830  13.483
  138   HH12  ARG  18          HH12      ARG  18 -14.902  -2.272  14.619
  139   HH21  ARG  18          HH21      ARG  18 -13.306  -4.533  12.470
  140   HH22  ARG  18          HH22      ARG  18 -13.301  -3.813  14.048
  141    H    GLU  19           H        GLU  19 -19.451  -3.927   8.392
  142    HA   GLU  19           HA       GLU  19 -19.604  -6.455   9.375
  143    HB2  GLU  19           HB2      GLU  19 -21.340  -4.747   9.658
  144    HB3  GLU  19           HB3      GLU  19 -21.796  -4.939   7.974
  145    HG2  GLU  19           HG2      GLU  19 -23.368  -6.074   9.389
  146    HG3  GLU  19           HG3      GLU  19 -22.468  -7.245   8.428
  147    H    LEU  20           H        LEU  20 -20.617  -5.398   6.175
  148    HA   LEU  20           HA       LEU  20 -21.239  -7.957   5.168
  149    HB2  LEU  20           HB2      LEU  20 -21.174  -5.215   4.235
  150    HB3  LEU  20           HB3      LEU  20 -20.640  -6.333   2.993
  151    HG   LEU  20           HG       LEU  20 -23.189  -6.827   4.487
  152   HD11  LEU  20          HD11      LEU  20 -23.250  -4.524   3.576
  153   HD12  LEU  20          HD12      LEU  20 -24.410  -5.605   2.812
  154   HD13  LEU  20          HD13      LEU  20 -22.915  -5.185   1.975
  155   HD21  LEU  20          HD21      LEU  20 -22.282  -8.641   3.163
  156   HD22  LEU  20          HD22      LEU  20 -22.147  -7.582   1.759
  157   HD23  LEU  20          HD23      LEU  20 -23.739  -8.006   2.397
  158    H    TYR  21           H        TYR  21 -18.277  -6.051   5.172
  159    HA   TYR  21           HA       TYR  21 -17.026  -7.584   3.121
  160    HB2  TYR  21           HB2      TYR  21 -16.275  -5.314   3.534
  161    HB3  TYR  21           HB3      TYR  21 -15.820  -5.736   5.184
  162    HD1  TYR  21           HD1      TYR  21 -15.149  -6.840   1.683
  163    HD2  TYR  21           HD2      TYR  21 -13.605  -6.231   5.597
  164    HE1  TYR  21           HE1      TYR  21 -12.915  -7.515   0.903
  165    HE2  TYR  21           HE2      TYR  21 -11.370  -6.898   4.829
  166    HH   TYR  21           HH       TYR  21 -10.607  -7.306   1.503
  167    H    LEU  22           H        LEU  22 -17.016  -7.652   6.629
  168    HA   LEU  22           HA       LEU  22 -15.014  -9.614   6.939
  169    HB2  LEU  22           HB2      LEU  22 -17.377  -9.130   8.750
  170    HB3  LEU  22           HB3      LEU  22 -15.842  -9.853   9.188
  171    HG   LEU  22           HG       LEU  22 -16.228  -6.988   8.340
  172   HD11  LEU  22          HD11      LEU  22 -17.216  -7.378  10.494
  173   HD12  LEU  22          HD12      LEU  22 -15.720  -6.462  10.677
  174   HD13  LEU  22          HD13      LEU  22 -15.752  -8.185  11.056
  175   HD21  LEU  22          HD21      LEU  22 -13.928  -6.665   9.012
  176   HD22  LEU  22          HD22      LEU  22 -14.031  -7.875   7.732
  177   HD23  LEU  22          HD23      LEU  22 -13.778  -8.378   9.403
  178    H    ALA  23           H        ALA  23 -18.359  -9.774   6.062
  179    HA   ALA  23           HA       ALA  23 -18.574 -12.611   6.544
  180    HB1  ALA  23           HB1      ALA  23 -20.525 -11.188   6.802
  181    HB2  ALA  23           HB2      ALA  23 -20.793 -12.407   5.557
  182    HB3  ALA  23           HB3      ALA  23 -20.440 -10.740   5.098
  183    H    ASN  24           H        ASN  24 -18.557 -10.566   3.571
  184    HA   ASN  24           HA       ASN  24 -18.673 -12.938   1.955
  185    HB2  ASN  24           HB2      ASN  24 -18.579 -10.005   1.301
  186    HB3  ASN  24           HB3      ASN  24 -18.478 -11.235   0.048
  187   HD21  ASN  24          HD21      ASN  24 -20.415 -11.506   2.965
  188   HD22  ASN  24          HD22      ASN  24 -21.949 -11.440   2.171
  189    H    LYS  25           H        LYS  25 -16.093 -11.497   3.472
  190    HA   LYS  25           HA       LYS  25 -14.141 -11.639   1.412
  191    HB2  LYS  25           HB2      LYS  25 -12.476 -11.742   3.282
  192    HB3  LYS  25           HB3      LYS  25 -13.572 -10.374   3.350
  193    HG2  LYS  25           HG2      LYS  25 -14.776 -11.282   5.138
  194    HG3  LYS  25           HG3      LYS  25 -14.090 -12.886   4.898
  195    HD2  LYS  25           HD2      LYS  25 -13.222 -11.494   6.869
  196    HD3  LYS  25           HD3      LYS  25 -12.030 -12.275   5.830
  197    HE2  LYS  25           HE2      LYS  25 -12.850  -9.484   5.196
  198    HE3  LYS  25           HE3      LYS  25 -11.804  -9.747   6.590
  199    HZ1  LYS  25           HZ1      LYS  25 -10.450  -9.335   4.681
  200    HZ2  LYS  25           HZ2      LYS  25 -11.241 -10.523   3.776
  201    HZ3  LYS  25           HZ3      LYS  25 -10.277 -10.969   5.089
  202    H    ASP  26           H        ASP  26 -15.732 -14.020   3.266
  203    HA   ASP  26           HA       ASP  26 -13.704 -16.029   2.625
  204    HB2  ASP  26           HB2      ASP  26 -16.009 -15.998   4.546
  205    HB3  ASP  26           HB3      ASP  26 -15.272 -17.519   4.052
  206    H    VAL  27           H        VAL  27 -16.212 -14.704   1.107
  207    HA   VAL  27           HA       VAL  27 -17.199 -17.208  -0.043
  208    HB   VAL  27           HB       VAL  27 -18.130 -14.378  -0.580
  209   HG11  VAL  27          HG11      VAL  27 -20.076 -15.458  -1.621
  210   HG12  VAL  27          HG12      VAL  27 -19.343 -17.037  -1.339
  211   HG13  VAL  27          HG13      VAL  27 -18.574 -15.891  -2.437
  212   HG21  VAL  27          HG21      VAL  27 -18.571 -15.044   1.730
  213   HG22  VAL  27          HG22      VAL  27 -19.372 -16.508   1.160
  214   HG23  VAL  27          HG23      VAL  27 -20.067 -14.926   0.804
  215    H    GLU  28           H        GLU  28 -15.891 -17.981  -1.537
  216    HA   GLU  28           HA       GLU  28 -14.533 -16.118  -3.337
  217    HB2  GLU  28           HB2      GLU  28 -14.001 -19.025  -2.716
  218    HB3  GLU  28           HB3      GLU  28 -13.132 -18.101  -3.934
  219    HG2  GLU  28           HG2      GLU  28 -12.393 -16.534  -2.182
  220    HG3  GLU  28           HG3      GLU  28 -13.207 -17.533  -0.980
  221    H    GLY  29           H        GLY  29 -14.536 -16.487  -5.582
  222    HA2  GLY  29           HA2      GLY  29 -15.551 -17.247  -7.574
  223    HA3  GLY  29           HA3      GLY  29 -16.740 -18.120  -6.607
  224    H    GLN  30           H        GLN  30 -16.392 -15.231  -5.197
  225    HA   GLN  30           HA       GLN  30 -18.387 -13.864  -6.863
  226    HB2  GLN  30           HB2      GLN  30 -19.555 -14.791  -4.928
  227    HB3  GLN  30           HB3      GLN  30 -18.364 -14.088  -3.841
  228    HG2  GLN  30           HG2      GLN  30 -19.069 -11.835  -4.735
  229    HG3  GLN  30           HG3      GLN  30 -20.420 -12.661  -5.505
  230   HE21  GLN  30          HE21      GLN  30 -19.001 -11.661  -2.490
  231   HE22  GLN  30          HE22      GLN  30 -20.425 -11.870  -1.546
  232    H    ASP  31           H        ASP  31 -18.196 -11.633  -6.931
  233    HA   ASP  31           HA       ASP  31 -15.687 -10.446  -6.310
  234    HB2  ASP  31           HB2      ASP  31 -17.419  -9.711  -8.086
  235    HB3  ASP  31           HB3      ASP  31 -18.260  -8.949  -6.732
  236    H    VAL  32           H        VAL  32 -15.049  -9.477  -4.400
  237    HA   VAL  32           HA       VAL  32 -16.899  -9.669  -2.204
  238    HB   VAL  32           HB       VAL  32 -14.348 -10.104  -2.082
  239   HG11  VAL  32          HG11      VAL  32 -14.408  -7.113  -1.699
  240   HG12  VAL  32          HG12      VAL  32 -13.551  -8.006  -2.961
  241   HG13  VAL  32          HG13      VAL  32 -13.049  -8.163  -1.276
  242   HG21  VAL  32          HG21      VAL  32 -15.864  -8.552   0.009
  243   HG22  VAL  32          HG22      VAL  32 -14.347  -9.403   0.309
  244   HG23  VAL  32          HG23      VAL  32 -15.783 -10.306  -0.175
  245    H    VAL  33           H        VAL  33 -15.347  -7.004  -4.003
  246    HA   VAL  33           HA       VAL  33 -16.324  -5.020  -2.213
  247    HB   VAL  33           HB       VAL  33 -14.324  -4.612  -3.610
  248   HG11  VAL  33          HG11      VAL  33 -16.284  -4.495  -5.882
  249   HG12  VAL  33          HG12      VAL  33 -14.945  -5.624  -5.688
  250   HG13  VAL  33          HG13      VAL  33 -14.625  -3.915  -5.956
  251   HG21  VAL  33          HG21      VAL  33 -14.894  -2.298  -4.238
  252   HG22  VAL  33          HG22      VAL  33 -15.485  -2.734  -2.634
  253   HG23  VAL  33          HG23      VAL  33 -16.598  -2.679  -4.000
  254    H    GLU  34           H        GLU  34 -17.375  -6.235  -5.368
  255    HA   GLU  34           HA       GLU  34 -19.530  -4.451  -5.662
  256    HB2  GLU  34           HB2      GLU  34 -18.448  -6.226  -7.319
  257    HB3  GLU  34           HB3      GLU  34 -19.747  -7.239  -6.708
  258    HG2  GLU  34           HG2      GLU  34 -20.268  -4.503  -7.818
  259    HG3  GLU  34           HG3      GLU  34 -20.156  -5.922  -8.857
  260    H    ALA  35           H        ALA  35 -19.197  -7.602  -4.125
  261    HA   ALA  35           HA       ALA  35 -21.811  -8.069  -3.346
  262    HB1  ALA  35           HB1      ALA  35 -19.327  -8.618  -1.732
  263    HB2  ALA  35           HB2      ALA  35 -19.971  -9.655  -3.009
  264    HB3  ALA  35           HB3      ALA  35 -20.899  -9.393  -1.532
  265    H    ILE  36           H        ILE  36 -19.285  -6.275  -1.615
  266    HA   ILE  36           HA       ILE  36 -20.782  -5.615   0.643
  267    HB   ILE  36           HB       ILE  36 -18.705  -3.787  -0.560
  268   HG12  ILE  36          HG12      ILE  36 -17.622  -5.896  -0.572
  269   HG13  ILE  36          HG13      ILE  36 -17.069  -5.080   0.885
  270   HG21  ILE  36          HG21      ILE  36 -19.850  -2.847   1.319
  271   HG22  ILE  36          HG22      ILE  36 -18.220  -3.296   1.816
  272   HG23  ILE  36          HG23      ILE  36 -19.592  -4.308   2.267
  273   HD11  ILE  36          HD11      ILE  36 -17.560  -7.459   1.225
  274   HD12  ILE  36          HD12      ILE  36 -19.243  -7.153   0.796
  275   HD13  ILE  36          HD13      ILE  36 -18.550  -6.405   2.235
  276    H    LEU  37           H        LEU  37 -20.045  -3.498  -2.129
  277    HA   LEU  37           HA       LEU  37 -21.841  -1.489  -1.255
  278    HB2  LEU  37           HB2      LEU  37 -21.525  -0.586  -3.620
  279    HB3  LEU  37           HB3      LEU  37 -20.137  -0.684  -2.566
  280    HG   LEU  37           HG       LEU  37 -19.639  -2.921  -3.771
  281   HD11  LEU  37          HD11      LEU  37 -21.551  -1.599  -5.698
  282   HD12  LEU  37          HD12      LEU  37 -21.685  -3.209  -4.989
  283   HD13  LEU  37          HD13      LEU  37 -20.404  -2.859  -6.151
  284   HD21  LEU  37          HD21      LEU  37 -18.377  -1.739  -5.453
  285   HD22  LEU  37          HD22      LEU  37 -18.313  -0.875  -3.918
  286   HD23  LEU  37          HD23      LEU  37 -19.362  -0.296  -5.212
  287    H    ALA  38           H        ALA  38 -22.359  -4.330  -3.088
  288    HA   ALA  38           HA       ALA  38 -24.776  -3.600  -4.380
  289    HB1  ALA  38           HB1      ALA  38 -25.152  -6.002  -4.630
  290    HB2  ALA  38           HB2      ALA  38 -23.853  -6.326  -3.481
  291    HB3  ALA  38           HB3      ALA  38 -23.487  -5.573  -5.036
  292    H    HIS  39           H        HIS  39 -24.096  -5.196  -1.286
  293    HA   HIS  39           HA       HIS  39 -26.917  -5.468  -0.717
  294    HB2  HIS  39           HB2      HIS  39 -24.467  -6.126   0.919
  295    HB3  HIS  39           HB3      HIS  39 -26.111  -6.389   1.485
  296    HD1  HIS  39           HD1      HIS  39 -27.118  -8.602   0.913
  297    HD2  HIS  39           HD2      HIS  39 -23.829  -7.693  -1.454
  298    HE1  HIS  39           HE1      HIS  39 -26.679 -10.667  -0.454
  299    HE2  HIS  39           HE2      HIS  39 -24.828 -10.012  -2.031
  300    H    LEU  40           H        LEU  40 -24.396  -3.182  -0.033
  301    HA   LEU  40           HA       LEU  40 -25.872  -1.828   2.022
  302    HB2  LEU  40           HB2      LEU  40 -23.444  -1.213   0.413
  303    HB3  LEU  40           HB3      LEU  40 -24.295   0.122   1.149
  304    HG   LEU  40           HG       LEU  40 -22.758  -0.268   2.756
  305   HD11  LEU  40          HD11      LEU  40 -23.678  -1.437   4.621
  306   HD12  LEU  40          HD12      LEU  40 -24.762  -2.348   3.574
  307   HD13  LEU  40          HD13      LEU  40 -24.978  -0.607   3.767
  308   HD21  LEU  40          HD21      LEU  40 -22.837  -3.168   2.017
  309   HD22  LEU  40          HD22      LEU  40 -21.875  -2.508   3.340
  310   HD23  LEU  40          HD23      LEU  40 -21.562  -2.001   1.679
  311    H    ASN  41           H        ASN  41 -27.951  -1.758   0.959
  312    HA   ASN  41           HA       ASN  41 -28.195   0.014  -1.335
  313    HB2  ASN  41           HB2      ASN  41 -30.589  -0.524  -1.203
  314    HB3  ASN  41           HB3      ASN  41 -29.627  -1.998  -1.151
  315   HD21  ASN  41          HD21      ASN  41 -31.884  -0.018   0.491
  316   HD22  ASN  41          HD22      ASN  41 -32.087  -1.022   1.882
  317    H    THR  42           H        THR  42 -27.062   1.077   1.023
  318    HA   THR  42           HA       THR  42 -29.125   2.930   1.971
  319    HB   THR  42           HB       THR  42 -28.108   1.680   3.773
  320    HG1  THR  42           HG1      THR  42 -26.756   4.036   4.253
  321   HG21  THR  42          HG21      THR  42 -25.712   1.833   4.293
  322   HG22  THR  42          HG22      THR  42 -25.452   2.751   2.809
  323   HG23  THR  42          HG23      THR  42 -25.992   1.074   2.726
  324    H    VAL  43           H        VAL  43 -26.301   2.668   0.060
  325    HA   VAL  43           HA       VAL  43 -26.102   5.588  -0.101
  326    HB   VAL  43           HB       VAL  43 -23.591   5.323  -0.323
  327   HG11  VAL  43          HG11      VAL  43 -23.216   5.302   2.109
  328   HG12  VAL  43          HG12      VAL  43 -24.873   4.740   2.341
  329   HG13  VAL  43          HG13      VAL  43 -24.570   6.329   1.640
  330   HG21  VAL  43          HG21      VAL  43 -24.176   2.655   0.957
  331   HG22  VAL  43          HG22      VAL  43 -22.579   3.381   0.778
  332   HG23  VAL  43          HG23      VAL  43 -23.501   2.918  -0.652
  333    HA   PRO  44           HA       PRO  44 -25.915   4.530  -4.506
  334    HB2  PRO  44           HB2      PRO  44 -26.343   7.375  -4.894
  335    HB3  PRO  44           HB3      PRO  44 -27.392   6.032  -5.348
  336    HG2  PRO  44           HG2      PRO  44 -28.025   7.809  -3.390
  337    HG3  PRO  44           HG3      PRO  44 -28.580   6.126  -3.389
  338    HD2  PRO  44           HD2      PRO  44 -26.325   7.377  -1.864
  339    HD3  PRO  44           HD3      PRO  44 -27.526   6.182  -1.327
  340    H    ARG  45           H        ARG  45 -23.666   4.129  -4.388
  341    HA   ARG  45           HA       ARG  45 -21.978   6.460  -4.914
  342    HB2  ARG  45           HB2      ARG  45 -21.441   4.401  -2.761
  343    HB3  ARG  45           HB3      ARG  45 -20.259   5.580  -3.321
  344    HG2  ARG  45           HG2      ARG  45 -21.674   7.396  -2.580
  345    HG3  ARG  45           HG3      ARG  45 -22.920   6.253  -2.078
  346    HD2  ARG  45           HD2      ARG  45 -21.812   6.809  -0.097
  347    HD3  ARG  45           HD3      ARG  45 -21.127   5.253  -0.548
  348    HE   ARG  45           HE       ARG  45 -19.213   6.555  -1.457
  349   HH11  ARG  45          HH11      ARG  45 -21.270   7.956   1.014
  350   HH12  ARG  45          HH12      ARG  45 -20.026   8.988   1.641
  351   HH21  ARG  45          HH21      ARG  45 -17.566   7.928  -0.600
  352   HH22  ARG  45          HH22      ARG  45 -17.944   8.982   0.727
  353    H    THR  46           H        THR  46 -19.658   5.642  -5.420
  354    HA   THR  46           HA       THR  46 -19.993   3.545  -7.425
  355    HB   THR  46           HB       THR  46 -19.096   5.748  -8.140
  356    HG1  THR  46           HG1      THR  46 -17.633   4.823  -9.497
  357   HG21  THR  46          HG21      THR  46 -17.823   6.316  -6.135
  358   HG22  THR  46          HG22      THR  46 -16.791   6.355  -7.565
  359   HG23  THR  46          HG23      THR  46 -16.710   4.987  -6.456
  360    H    ARG  47           H        ARG  47 -17.987   2.214  -7.828
  361    HA   ARG  47           HA       ARG  47 -17.610   0.465  -5.692
  362    HB2  ARG  47           HB2      ARG  47 -16.245   0.856  -8.332
  363    HB3  ARG  47           HB3      ARG  47 -15.593  -0.299  -7.180
  364    HG2  ARG  47           HG2      ARG  47 -17.058  -1.323  -8.874
  365    HG3  ARG  47           HG3      ARG  47 -17.618  -1.584  -7.230
  366    HD2  ARG  47           HD2      ARG  47 -19.468  -1.061  -8.734
  367    HD3  ARG  47           HD3      ARG  47 -19.276   0.185  -7.501
  368    HE   ARG  47           HE       ARG  47 -17.829   1.004  -9.738
  369   HH11  ARG  47          HH11      ARG  47 -21.164   0.262  -8.977
  370   HH12  ARG  47          HH12      ARG  47 -21.808   1.491 -10.015
  371   HH21  ARG  47          HH21      ARG  47 -18.682   2.627 -11.118
  372   HH22  ARG  47          HH22      ARG  47 -20.404   2.835 -11.225
  373    H    LYS  48           H        LYS  48 -15.534   3.014  -6.928
  374    HA   LYS  48           HA       LYS  48 -13.192   2.531  -5.548
  375    HB2  LYS  48           HB2      LYS  48 -13.452   4.172  -7.345
  376    HB3  LYS  48           HB3      LYS  48 -14.428   5.182  -6.292
  377    HG2  LYS  48           HG2      LYS  48 -12.394   5.270  -4.764
  378    HG3  LYS  48           HG3      LYS  48 -11.494   4.599  -6.126
  379    HD2  LYS  48           HD2      LYS  48 -11.252   6.973  -6.215
  380    HD3  LYS  48           HD3      LYS  48 -12.351   6.507  -7.513
  381    HE2  LYS  48           HE2      LYS  48 -14.260   7.061  -5.992
  382    HE3  LYS  48           HE3      LYS  48 -13.087   7.680  -4.834
  383    HZ1  LYS  48           HZ1      LYS  48 -13.991   9.466  -6.138
  384    HZ2  LYS  48           HZ2      LYS  48 -13.550   8.703  -7.578
  385    HZ3  LYS  48           HZ3      LYS  48 -12.357   9.272  -6.525
  386    H    GLN  49           H        GLN  49 -16.147   3.982  -4.389
  387    HA   GLN  49           HA       GLN  49 -14.914   5.344  -2.199
  388    HB2  GLN  49           HB2      GLN  49 -17.819   4.826  -2.840
  389    HB3  GLN  49           HB3      GLN  49 -17.251   5.879  -1.549
  390    HG2  GLN  49           HG2      GLN  49 -16.132   7.290  -3.151
  391    HG3  GLN  49           HG3      GLN  49 -16.605   6.227  -4.469
  392   HE21  GLN  49          HE21      GLN  49 -17.502   8.816  -2.429
  393   HE22  GLN  49          HE22      GLN  49 -19.070   9.097  -3.102
  394    H    ILE  50           H        ILE  50 -16.769   2.337  -2.525
  395    HA   ILE  50           HA       ILE  50 -16.780   1.773   0.267
  396    HB   ILE  50           HB       ILE  50 -17.272   0.060  -2.155
  397   HG12  ILE  50          HG12      ILE  50 -19.481  -0.226  -0.778
  398   HG13  ILE  50          HG13      ILE  50 -18.923   1.208   0.072
  399   HG21  ILE  50          HG21      ILE  50 -17.137  -0.888   0.700
  400   HG22  ILE  50          HG22      ILE  50 -16.131  -1.417  -0.646
  401   HG23  ILE  50          HG23      ILE  50 -17.850  -1.805  -0.627
  402   HD11  ILE  50          HD11      ILE  50 -19.382   1.021  -2.895
  403   HD12  ILE  50          HD12      ILE  50 -18.920   2.466  -1.992
  404   HD13  ILE  50          HD13      ILE  50 -20.498   1.723  -1.726
  405    H    ILE  51           H        ILE  51 -14.729   0.759  -2.431
  406    HA   ILE  51           HA       ILE  51 -13.002  -1.015  -1.247
  407    HB   ILE  51           HB       ILE  51 -12.292   1.185  -3.193
  408   HG12  ILE  51          HG12      ILE  51 -12.996  -1.707  -3.687
  409   HG13  ILE  51          HG13      ILE  51 -14.061  -0.336  -3.975
  410   HG21  ILE  51          HG21      ILE  51 -10.775  -1.354  -2.632
  411   HG22  ILE  51          HG22      ILE  51 -10.332   0.241  -2.030
  412   HG23  ILE  51          HG23      ILE  51 -10.318  -0.078  -3.765
  413   HD11  ILE  51          HD11      ILE  51 -12.520   0.517  -5.656
  414   HD12  ILE  51          HD12      ILE  51 -13.046  -1.123  -6.036
  415   HD13  ILE  51          HD13      ILE  51 -11.441  -0.847  -5.359
  416    H    HIS  52           H        HIS  52 -12.864   2.497  -1.199
  417    HA   HIS  52           HA       HIS  52 -10.319   2.673  -0.020
  418    HB2  HIS  52           HB2      HIS  52 -12.497   4.558  -0.681
  419    HB3  HIS  52           HB3      HIS  52 -11.335   5.085   0.535
  420    HD1  HIS  52           HD1      HIS  52  -9.890   6.685  -0.710
  421    HD2  HIS  52           HD2      HIS  52 -10.496   3.145  -2.826
  422    HE1  HIS  52           HE1      HIS  52  -8.326   6.784  -2.660
  423    HE2  HIS  52           HE2      HIS  52  -8.537   4.548  -3.778
  424    H    HIS  53           H        HIS  53 -13.560   3.108   1.469
  425    HA   HIS  53           HA       HIS  53 -12.571   3.923   3.968
  426    HB2  HIS  53           HB2      HIS  53 -15.162   2.506   3.349
  427    HB3  HIS  53           HB3      HIS  53 -14.776   3.251   4.896
  428    HD1  HIS  53           HD1      HIS  53 -13.770   5.929   4.251
  429    HD2  HIS  53           HD2      HIS  53 -16.855   4.148   2.106
  430    HE1  HIS  53           HE1      HIS  53 -14.911   7.812   3.046
  431    HE2  HIS  53           HE2      HIS  53 -16.577   6.675   1.547
  432    H    LEU  54           H        LEU  54 -13.124   0.719   2.697
  433    HA   LEU  54           HA       LEU  54 -12.974  -0.627   5.182
  434    HB2  LEU  54           HB2      LEU  54 -12.677  -1.563   2.337
  435    HB3  LEU  54           HB3      LEU  54 -12.585  -2.655   3.706
  436    HG   LEU  54           HG       LEU  54 -14.980  -0.903   3.155
  437   HD11  LEU  54          HD11      LEU  54 -16.046  -2.975   2.313
  438   HD12  LEU  54          HD12      LEU  54 -14.466  -3.761   2.360
  439   HD13  LEU  54          HD13      LEU  54 -14.738  -2.389   1.287
  440   HD21  LEU  54          HD21      LEU  54 -14.647  -1.723   5.479
  441   HD22  LEU  54          HD22      LEU  54 -14.688  -3.374   4.861
  442   HD23  LEU  54          HD23      LEU  54 -16.110  -2.342   4.715
  443    H    VAL  55           H        VAL  55 -10.560   0.019   2.655
  444    HA   VAL  55           HA       VAL  55  -8.488  -1.284   4.176
  445    HB   VAL  55           HB       VAL  55  -6.947  -0.598   2.468
  446   HG11  VAL  55          HG11      VAL  55  -8.065  -1.506   0.462
  447   HG12  VAL  55          HG12      VAL  55  -9.608  -1.401   1.315
  448   HG13  VAL  55          HG13      VAL  55  -8.339  -2.469   1.914
  449   HG21  VAL  55          HG21      VAL  55  -7.664   1.710   2.139
  450   HG22  VAL  55          HG22      VAL  55  -9.144   1.150   1.360
  451   HG23  VAL  55          HG23      VAL  55  -7.581   0.852   0.600
  452    H    GLN  56           H        GLN  56  -9.823   1.882   3.880
  453    HA   GLN  56           HA       GLN  56  -7.746   3.326   5.166
  454    HB2  GLN  56           HB2      GLN  56 -10.648   3.823   4.622
  455    HB3  GLN  56           HB3      GLN  56  -9.767   4.907   5.675
  456    HG2  GLN  56           HG2      GLN  56  -8.204   5.414   3.878
  457    HG3  GLN  56           HG3      GLN  56  -9.033   4.272   2.823
  458   HE21  GLN  56          HE21      GLN  56  -9.484   5.849   1.328
  459   HE22  GLN  56          HE22      GLN  56 -10.696   7.059   1.584
  460    H    MET  57           H        MET  57 -10.516   1.499   6.302
  461    HA   MET  57           HA       MET  57 -10.112   2.298   9.041
  462    HB2  MET  57           HB2      MET  57 -11.959   0.342   7.707
  463    HB3  MET  57           HB3      MET  57 -11.819   0.417   9.458
  464    HG2  MET  57           HG2      MET  57 -12.464   2.788   9.388
  465    HG3  MET  57           HG3      MET  57 -12.650   2.672   7.641
  466    HE1  MET  57           HE1      MET  57 -14.135   0.110   6.947
  467    HE2  MET  57           HE2      MET  57 -14.685   1.704   6.431
  468    HE3  MET  57           HE3      MET  57 -15.824   0.570   7.156
  469    H    GLY  58           H        GLY  58  -8.354   0.433   7.095
  470    HA2  GLY  58           HA2      GLY  58  -6.571  -0.934   7.546
  471    HA3  GLY  58           HA3      GLY  58  -6.844  -0.609   9.249
  472    H    LEU  59           H        LEU  59  -9.601  -1.809   7.777
  473    HA   LEU  59           HA       LEU  59  -9.175  -4.386   9.054
  474    HB2  LEU  59           HB2      LEU  59 -11.574  -4.738   8.698
  475    HB3  LEU  59           HB3      LEU  59 -11.245  -3.260   9.577
  476    HG   LEU  59           HG       LEU  59 -11.426  -2.182   7.174
  477   HD11  LEU  59          HD11      LEU  59 -13.007  -3.280   5.757
  478   HD12  LEU  59          HD12      LEU  59 -13.212  -4.590   6.919
  479   HD13  LEU  59          HD13      LEU  59 -11.676  -4.391   6.074
  480   HD21  LEU  59          HD21      LEU  59 -13.810  -1.799   7.612
  481   HD22  LEU  59          HD22      LEU  59 -12.820  -1.606   9.058
  482   HD23  LEU  59          HD23      LEU  59 -13.774  -3.071   8.830
  483    H    ALA  60           H        ALA  60  -9.102  -2.933   6.005
  484    HA   ALA  60           HA       ALA  60  -8.920  -5.592   4.733
  485    HB1  ALA  60           HB1      ALA  60 -10.805  -4.340   3.850
  486    HB2  ALA  60           HB2      ALA  60  -9.555  -4.524   2.619
  487    HB3  ALA  60           HB3      ALA  60  -9.745  -2.986   3.460
  488    H    ASP  61           H        ASP  61  -7.316  -5.830   3.088
  489    HA   ASP  61           HA       ASP  61  -4.794  -4.869   3.891
  490    HB2  ASP  61           HB2      ASP  61  -5.251  -7.035   2.704
  491    HB3  ASP  61           HB3      ASP  61  -5.520  -6.108   1.230
  492    H    SER  62           H        SER  62  -6.253  -4.452   0.682
  493    HA   SER  62           HA       SER  62  -5.587  -1.649   0.553
  494    HB2  SER  62           HB2      SER  62  -4.188  -3.597  -1.289
  495    HB3  SER  62           HB3      SER  62  -4.050  -1.844  -1.339
  496    HG   SER  62           HG       SER  62  -3.215  -3.544   0.794
  497    H    VAL  63           H        VAL  63  -6.000  -0.903  -1.835
  498    HA   VAL  63           HA       VAL  63  -8.638  -1.648  -2.488
  499    HB   VAL  63           HB       VAL  63  -8.431  -0.121  -4.285
  500   HG11  VAL  63          HG11      VAL  63  -7.879   1.893  -3.125
  501   HG12  VAL  63          HG12      VAL  63  -6.833   1.008  -2.020
  502   HG13  VAL  63          HG13      VAL  63  -8.574   0.767  -1.960
  503   HG21  VAL  63          HG21      VAL  63  -5.495  -0.037  -3.803
  504   HG22  VAL  63          HG22      VAL  63  -6.394   0.920  -4.981
  505   HG23  VAL  63          HG23      VAL  63  -6.298  -0.830  -5.155
  506    H    LYS  64           H        LYS  64  -5.556  -2.643  -3.561
  507    HA   LYS  64           HA       LYS  64  -5.783  -3.886  -5.961
  508    HB2  LYS  64           HB2      LYS  64  -4.677  -5.404  -3.632
  509    HB3  LYS  64           HB3      LYS  64  -4.088  -5.367  -5.280
  510    HG2  LYS  64           HG2      LYS  64  -3.326  -3.050  -4.903
  511    HG3  LYS  64           HG3      LYS  64  -3.848  -3.189  -3.223
  512    HD2  LYS  64           HD2      LYS  64  -1.618  -4.628  -4.628
  513    HD3  LYS  64           HD3      LYS  64  -1.554  -3.670  -3.154
  514    HE2  LYS  64           HE2      LYS  64  -2.872  -6.374  -3.452
  515    HE3  LYS  64           HE3      LYS  64  -1.314  -6.068  -2.699
  516    HZ1  LYS  64           HZ1      LYS  64  -2.824  -6.258  -0.950
  517    HZ2  LYS  64           HZ2      LYS  64  -4.004  -5.322  -1.708
  518    HZ3  LYS  64           HZ3      LYS  64  -2.596  -4.592  -1.104
  519    H    ASP  65           H        ASP  65  -6.751  -5.137  -2.863
  520    HA   ASP  65           HA       ASP  65  -7.504  -7.700  -3.787
  521    HB2  ASP  65           HB2      ASP  65  -8.215  -6.363  -1.170
  522    HB3  ASP  65           HB3      ASP  65  -8.063  -8.092  -1.485
  523    H    PHE  66           H        PHE  66  -9.028  -4.746  -4.031
  524    HA   PHE  66           HA       PHE  66 -11.705  -5.960  -4.053
  525    HB2  PHE  66           HB2      PHE  66 -10.874  -3.052  -4.001
  526    HB3  PHE  66           HB3      PHE  66 -12.535  -3.619  -4.091
  527    HD1  PHE  66           HD1      PHE  66  -9.500  -4.014  -1.979
  528    HD2  PHE  66           HD2      PHE  66 -13.744  -3.738  -2.140
  529    HE1  PHE  66           HE1      PHE  66  -9.593  -4.050   0.470
  530    HE2  PHE  66           HE2      PHE  66 -13.840  -3.787   0.305
  531    HZ   PHE  66           HZ       PHE  66 -11.759  -3.933   1.619
  532    H    GLN  67           H        GLN  67  -9.590  -3.768  -5.944
  533    HA   GLN  67           HA       GLN  67 -10.866  -4.624  -8.394
  534    HB2  GLN  67           HB2      GLN  67 -11.299  -1.884  -7.268
  535    HB3  GLN  67           HB3      GLN  67 -11.375  -2.180  -9.008
  536    HG2  GLN  67           HG2      GLN  67 -13.010  -4.091  -8.284
  537    HG3  GLN  67           HG3      GLN  67 -13.167  -3.098  -6.840
  538   HE21  GLN  67          HE21      GLN  67 -15.105  -3.756  -8.939
  539   HE22  GLN  67          HE22      GLN  67 -15.659  -2.235  -9.549
  540    H    ARG  68           H        ARG  68  -8.220  -3.029  -6.878
  541    HA   ARG  68           HA       ARG  68  -7.297  -1.773  -9.279
  542    HB2  ARG  68           HB2      ARG  68  -6.725  -0.874  -7.055
  543    HB3  ARG  68           HB3      ARG  68  -5.751  -2.296  -6.738
  544    HG2  ARG  68           HG2      ARG  68  -4.007  -1.323  -7.688
  545    HG3  ARG  68           HG3      ARG  68  -4.896  -1.198  -9.208
  546    HD2  ARG  68           HD2      ARG  68  -4.947   0.789  -6.937
  547    HD3  ARG  68           HD3      ARG  68  -4.118   0.992  -8.480
  548    HE   ARG  68           HE       ARG  68  -6.622   0.599  -9.298
  549   HH11  ARG  68          HH11      ARG  68  -5.356   2.688  -6.790
  550   HH12  ARG  68          HH12      ARG  68  -6.640   3.844  -6.935
  551   HH21  ARG  68          HH21      ARG  68  -8.316   2.096  -9.480
  552   HH22  ARG  68          HH22      ARG  68  -8.333   3.502  -8.462
  553    H    LYS  69           H        LYS  69  -7.152  -3.264 -10.837
  554    HA   LYS  69           HA       LYS  69  -5.779  -5.746 -10.590
  555    HB2  LYS  69           HB2      LYS  69  -7.618  -5.016 -12.258
  556    HB3  LYS  69           HB3      LYS  69  -6.306  -4.296 -13.176
  557    HG2  LYS  69           HG2      LYS  69  -6.103  -7.160 -12.381
  558    HG3  LYS  69           HG3      LYS  69  -7.175  -6.710 -13.706
  559    HD2  LYS  69           HD2      LYS  69  -5.292  -5.628 -14.846
  560    HD3  LYS  69           HD3      LYS  69  -4.226  -6.107 -13.523
  561    HE2  LYS  69           HE2      LYS  69  -4.603  -8.441 -14.008
  562    HE3  LYS  69           HE3      LYS  69  -5.794  -8.029 -15.241
  563    HZ1  LYS  69           HZ1      LYS  69  -4.042  -6.953 -16.514
  564    HZ2  LYS  69           HZ2      LYS  69  -3.669  -8.576 -16.232
  565    HZ3  LYS  69           HZ3      LYS  69  -2.901  -7.369 -15.336
  566    H    GLY  70           H        GLY  70  -4.804  -2.519 -10.995
  567    HA2  GLY  70           HA2      GLY  70  -2.187  -2.981 -12.034
  568    HA3  GLY  70           HA3      GLY  70  -2.706  -1.583 -11.092
  569    H    THR  71           H        THR  71  -2.451  -5.063 -10.454
  570    HA   THR  71           HA       THR  71  -1.607  -4.493  -7.753
  571    HB   THR  71           HB       THR  71  -1.717  -7.262  -8.777
  572    HG1  THR  71           HG1      THR  71  -3.936  -5.490  -8.591
  573   HG21  THR  71          HG21      THR  71  -2.656  -5.874  -6.280
  574   HG22  THR  71          HG22      THR  71  -1.211  -6.865  -6.454
  575   HG23  THR  71          HG23      THR  71  -2.810  -7.604  -6.580
  576    H    HIS  72           H        HIS  72   0.427  -4.403  -7.158
  577    HA   HIS  72           HA       HIS  72   2.529  -5.427  -8.852
  578    HB2  HIS  72           HB2      HIS  72   4.051  -4.405  -7.307
  579    HB3  HIS  72           HB3      HIS  72   2.715  -3.287  -7.526
  580    HD1  HIS  72           HD1      HIS  72   4.557  -3.180  -5.044
  581    HD2  HIS  72           HD2      HIS  72   0.927  -5.181  -5.182
  582    HE1  HIS  72           HE1      HIS  72   3.823  -3.431  -2.663
  583    HE2  HIS  72           HE2      HIS  72   1.456  -4.255  -2.819
  584    H    ILE  73           H        ILE  73   0.438  -7.098  -7.253
  585    HA   ILE  73           HA       ILE  73   1.942  -8.553  -5.342
  586    HB   ILE  73           HB       ILE  73  -0.722  -9.019  -6.591
  587   HG12  ILE  73          HG12      ILE  73  -0.136  -7.650  -4.437
  588   HG13  ILE  73          HG13      ILE  73  -1.545  -8.710  -4.440
  589   HG21  ILE  73          HG21      ILE  73   0.856 -11.081  -5.081
  590   HG22  ILE  73          HG22      ILE  73   0.193 -11.219  -6.710
  591   HG23  ILE  73          HG23      ILE  73  -0.890 -11.161  -5.320
  592   HD11  ILE  73          HD11      ILE  73   1.170  -9.390  -3.323
  593   HD12  ILE  73          HD12      ILE  73  -0.250 -10.437  -3.306
  594   HD13  ILE  73          HD13      ILE  73  -0.254  -8.931  -2.386
  595    H    VAL  74           H        VAL  74   3.532  -9.729  -5.746
  596    HA   VAL  74           HA       VAL  74   3.943 -11.222  -8.157
  597    HB   VAL  74           HB       VAL  74   5.996 -11.865  -7.156
  598   HG11  VAL  74          HG11      VAL  74   6.904  -9.751  -6.223
  599   HG12  VAL  74          HG12      VAL  74   5.253  -9.126  -6.100
  600   HG13  VAL  74          HG13      VAL  74   5.942  -9.504  -7.682
  601   HG21  VAL  74          HG21      VAL  74   4.879 -11.074  -4.463
  602   HG22  VAL  74          HG22      VAL  74   6.488 -11.723  -4.776
  603   HG23  VAL  74          HG23      VAL  74   5.065 -12.729  -5.042
  604    H    LEU  75           H        LEU  75   3.625 -13.470  -8.343
  605    HA   LEU  75           HA       LEU  75   1.233 -14.406  -7.397
  606    HB2  LEU  75           HB2      LEU  75   2.178 -16.693  -8.079
  607    HB3  LEU  75           HB3      LEU  75   2.078 -15.434  -9.298
  608    HG   LEU  75           HG       LEU  75   4.616 -15.197  -8.067
  609   HD11  LEU  75          HD11      LEU  75   4.006 -18.011  -8.936
  610   HD12  LEU  75          HD12      LEU  75   4.341 -17.478  -7.288
  611   HD13  LEU  75          HD13      LEU  75   5.594 -17.367  -8.522
  612   HD21  LEU  75          HD21      LEU  75   4.068 -14.558 -10.353
  613   HD22  LEU  75          HD22      LEU  75   3.812 -16.253 -10.776
  614   HD23  LEU  75          HD23      LEU  75   5.420 -15.692 -10.319
  615    H    TRP  76           H        TRP  76   0.893 -14.327  -5.187
  616    HA   TRP  76           HA       TRP  76   2.849 -15.595  -3.438
  617    HB2  TRP  76           HB2      TRP  76   0.540 -13.732  -2.976
  618    HB3  TRP  76           HB3      TRP  76   1.211 -14.661  -1.636
  619    HD1  TRP  76           HD1      TRP  76   1.558 -11.425  -3.245
  620    HE1  TRP  76           HE1      TRP  76   3.773 -10.273  -2.617
  621    HE3  TRP  76           HE3      TRP  76   3.999 -15.428  -1.242
  622    HZ2  TRP  76           HZ2      TRP  76   6.229 -10.978  -1.429
  623    HZ3  TRP  76           HZ3      TRP  76   6.278 -15.106  -0.382
  624    HH2  TRP  76           HH2      TRP  76   7.371 -12.932  -0.481
  625    H    THR  77           H        THR  77   2.643 -17.689  -3.253
  626    HA   THR  77           HA       THR  77  -0.026 -18.855  -2.886
  627    HB   THR  77           HB       THR  77   1.110 -21.032  -3.312
  628    HG1  THR  77           HG1      THR  77   3.330 -20.342  -4.471
  629   HG21  THR  77          HG21      THR  77   1.585 -18.985  -5.486
  630   HG22  THR  77          HG22      THR  77   0.048 -19.789  -5.165
  631   HG23  THR  77          HG23      THR  77   1.438 -20.728  -5.708
  632    H    GLY  78           H        GLY  78  -0.075 -20.680  -1.246
  633    HA2  GLY  78           HA2      GLY  78   0.668 -19.815   1.290
  634    HA3  GLY  78           HA3      GLY  78   0.257 -21.475   0.885
  635    H    ASP  79           H        ASP  79   2.454 -21.739  -1.019
  636    HA   ASP  79           HA       ASP  79   4.522 -22.451   0.835
  637    HB2  ASP  79           HB2      ASP  79   4.269 -22.667  -2.154
  638    HB3  ASP  79           HB3      ASP  79   5.783 -23.036  -1.332
  639    H    GLN  80           H        GLN  80   4.211 -20.030  -1.776
  640    HA   GLN  80           HA       GLN  80   6.867 -19.085  -1.448
  641    HB2  GLN  80           HB2      GLN  80   5.626 -18.687  -3.535
  642    HB3  GLN  80           HB3      GLN  80   4.510 -17.630  -2.670
  643    HG2  GLN  80           HG2      GLN  80   6.303 -16.093  -2.160
  644    HG3  GLN  80           HG3      GLN  80   7.475 -17.168  -2.915
  645   HE21  GLN  80          HE21      GLN  80   4.949 -14.864  -3.426
  646   HE22  GLN  80          HE22      GLN  80   5.197 -14.652  -5.121
  647    H    GLU  81           H        GLU  81   3.772 -18.120  -0.028
  648    HA   GLU  81           HA       GLU  81   4.745 -15.782   1.241
  649    HB2  GLU  81           HB2      GLU  81   2.415 -17.571   1.975
  650    HB3  GLU  81           HB3      GLU  81   2.725 -15.990   2.686
  651    HG2  GLU  81           HG2      GLU  81   2.520 -14.968   0.463
  652    HG3  GLU  81           HG3      GLU  81   2.165 -16.553  -0.218
  653    H    LEU  82           H        LEU  82   4.589 -19.164   2.227
  654    HA   LEU  82           HA       LEU  82   5.696 -18.767   4.817
  655    HB2  LEU  82           HB2      LEU  82   4.488 -20.814   4.201
  656    HB3  LEU  82           HB3      LEU  82   5.744 -21.208   3.042
  657    HG   LEU  82           HG       LEU  82   7.345 -21.186   5.057
  658   HD11  LEU  82          HD11      LEU  82   6.295 -21.744   7.198
  659   HD12  LEU  82          HD12      LEU  82   4.707 -21.456   6.489
  660   HD13  LEU  82          HD13      LEU  82   5.856 -20.128   6.649
  661   HD21  LEU  82          HD21      LEU  82   6.732 -23.187   3.839
  662   HD22  LEU  82          HD22      LEU  82   5.246 -23.328   4.781
  663   HD23  LEU  82          HD23      LEU  82   6.813 -23.515   5.570
  664    H    GLU  83           H        GLU  83   7.021 -19.336   1.618
  665    HA   GLU  83           HA       GLU  83   9.682 -19.840   2.343
  666    HB2  GLU  83           HB2      GLU  83   8.519 -20.073   0.042
  667    HB3  GLU  83           HB3      GLU  83   8.938 -18.378  -0.179
  668    HG2  GLU  83           HG2      GLU  83  10.605 -19.803  -1.196
  669    HG3  GLU  83           HG3      GLU  83  11.298 -18.918   0.164
  670    H    LEU  84           H        LEU  84   7.937 -16.828   1.720
  671    HA   LEU  84           HA       LEU  84  10.154 -15.099   1.946
  672    HB2  LEU  84           HB2      LEU  84   8.001 -14.354   1.028
  673    HB3  LEU  84           HB3      LEU  84   7.260 -14.535   2.608
  674    HG   LEU  84           HG       LEU  84   8.841 -12.792   3.478
  675   HD11  LEU  84          HD11      LEU  84  10.002 -11.365   1.889
  676   HD12  LEU  84          HD12      LEU  84   9.463 -12.388   0.557
  677   HD13  LEU  84          HD13      LEU  84  10.571 -13.030   1.768
  678   HD21  LEU  84          HD21      LEU  84   7.047 -11.938   1.211
  679   HD22  LEU  84          HD22      LEU  84   7.638 -10.909   2.512
  680   HD23  LEU  84          HD23      LEU  84   6.542 -12.243   2.872
  681    H    GLN  85           H        GLN  85   7.987 -16.523   4.325
  682    HA   GLN  85           HA       GLN  85   8.807 -15.032   6.560
  683    HB2  GLN  85           HB2      GLN  85   6.797 -16.435   6.534
  684    HB3  GLN  85           HB3      GLN  85   7.793 -17.875   6.382
  685    HG2  GLN  85           HG2      GLN  85   8.839 -17.192   8.597
  686    HG3  GLN  85           HG3      GLN  85   7.498 -16.059   8.740
  687   HE21  GLN  85          HE21      GLN  85   8.436 -19.370   8.676
  688   HE22  GLN  85          HE22      GLN  85   6.947 -20.007   9.254
  689    H    ARG  86           H        ARG  86   9.804 -18.286   5.485
  690    HA   ARG  86           HA       ARG  86  11.835 -18.699   7.356
  691    HB2  ARG  86           HB2      ARG  86  11.671 -19.709   4.504
  692    HB3  ARG  86           HB3      ARG  86  12.739 -20.355   5.744
  693    HG2  ARG  86           HG2      ARG  86  10.679 -20.882   7.089
  694    HG3  ARG  86           HG3      ARG  86   9.736 -20.456   5.661
  695    HD2  ARG  86           HD2      ARG  86  11.901 -22.549   5.662
  696    HD3  ARG  86           HD3      ARG  86  10.207 -22.911   5.971
  697    HE   ARG  86           HE       ARG  86  11.045 -21.643   3.435
  698   HH11  ARG  86          HH11      ARG  86   9.508 -24.281   5.181
  699   HH12  ARG  86          HH12      ARG  86   8.893 -25.037   3.749
  700   HH21  ARG  86          HH21      ARG  86  10.224 -22.654   1.542
  701   HH22  ARG  86          HH22      ARG  86   9.260 -24.094   1.691
  702    H    LEU  87           H        LEU  87  11.931 -17.172   4.199
  703    HA   LEU  87           HA       LEU  87  14.709 -16.758   4.009
  704    HB2  LEU  87           HB2      LEU  87  12.977 -16.657   2.193
  705    HB3  LEU  87           HB3      LEU  87  12.473 -15.110   2.832
  706    HG   LEU  87           HG       LEU  87  14.870 -14.334   2.375
  707   HD11  LEU  87          HD11      LEU  87  14.812 -16.808   0.652
  708   HD12  LEU  87          HD12      LEU  87  15.872 -16.538   2.038
  709   HD13  LEU  87          HD13      LEU  87  16.031 -15.534   0.595
  710   HD21  LEU  87          HD21      LEU  87  12.890 -13.663   1.108
  711   HD22  LEU  87          HD22      LEU  87  13.072 -15.087   0.084
  712   HD23  LEU  87          HD23      LEU  87  14.308 -13.830   0.073
  713    H    PHE  88           H        PHE  88  12.084 -14.651   5.118
  714    HA   PHE  88           HA       PHE  88  13.619 -12.356   5.607
  715    HB2  PHE  88           HB2      PHE  88  11.405 -11.834   5.462
  716    HB3  PHE  88           HB3      PHE  88  10.890 -13.316   6.246
  717    HD1  PHE  88           HD1      PHE  88  12.307  -9.946   6.907
  718    HD2  PHE  88           HD2      PHE  88  10.241 -13.327   8.467
  719    HE1  PHE  88           HE1      PHE  88  11.780  -8.680   8.955
  720    HE2  PHE  88           HE2      PHE  88   9.726 -12.073  10.514
  721    HZ   PHE  88           HZ       PHE  88  10.501  -9.755  10.760
  722    H    GLU  89           H        GLU  89  12.664 -14.988   7.786
  723    HA   GLU  89           HA       GLU  89  13.607 -13.832  10.165
  724    HB2  GLU  89           HB2      GLU  89  13.404 -16.739   9.382
  725    HB3  GLU  89           HB3      GLU  89  13.622 -16.153  11.022
  726    HG2  GLU  89           HG2      GLU  89  11.470 -14.996  10.888
  727    HG3  GLU  89           HG3      GLU  89  11.277 -15.582   9.236
  728    H    GLU  90           H        GLU  90  15.186 -15.702   7.688
  729    HA   GLU  90           HA       GLU  90  17.554 -16.174   9.227
  730    HB2  GLU  90           HB2      GLU  90  16.623 -16.773   6.460
  731    HB3  GLU  90           HB3      GLU  90  18.322 -16.980   6.870
  732    HG2  GLU  90           HG2      GLU  90  16.041 -18.259   8.340
  733    HG3  GLU  90           HG3      GLU  90  16.970 -19.040   7.063
  734    H    PHE  91           H        PHE  91  16.573 -13.847   6.771
  735    HA   PHE  91           HA       PHE  91  19.312 -12.910   6.524
  736    HB2  PHE  91           HB2      PHE  91  16.781 -12.322   5.043
  737    HB3  PHE  91           HB3      PHE  91  18.140 -11.207   4.928
  738    HD1  PHE  91           HD1      PHE  91  20.452 -12.378   4.450
  739    HD2  PHE  91           HD2      PHE  91  16.648 -14.018   3.502
  740    HE1  PHE  91           HE1      PHE  91  21.501 -13.793   2.737
  741    HE2  PHE  91           HE2      PHE  91  17.691 -15.442   1.787
  742    HZ   PHE  91           HZ       PHE  91  20.118 -15.328   1.403
  743    H    ARG  92           H        ARG  92  16.718 -12.237   8.557
  744    HA   ARG  92           HA       ARG  92  17.277  -9.440   8.879
  745    HB2  ARG  92           HB2      ARG  92  15.726  -9.414  10.661
  746    HB3  ARG  92           HB3      ARG  92  15.066 -10.502   9.455
  747    HG2  ARG  92           HG2      ARG  92  15.688 -12.416  10.737
  748    HG3  ARG  92           HG3      ARG  92  16.582 -11.417  11.885
  749    HD2  ARG  92           HD2      ARG  92  13.610 -11.272  11.388
  750    HD3  ARG  92           HD3      ARG  92  14.376 -12.091  12.749
  751    HE   ARG  92           HE       ARG  92  15.205  -9.384  12.618
  752   HH11  ARG  92          HH11      ARG  92  12.481 -11.383  13.528
  753   HH12  ARG  92          HH12      ARG  92  11.876 -10.248  14.694
  754   HH21  ARG  92          HH21      ARG  92  14.404  -7.875  14.142
  755   HH22  ARG  92          HH22      ARG  92  12.978  -8.266  15.050
  756    H    ASP  93           H        ASP  93  18.807 -12.261   9.811
  757    HA   ASP  93           HA       ASP  93  20.182 -11.168  12.092
  758    HB2  ASP  93           HB2      ASP  93  19.830 -13.610  11.789
  759    HB3  ASP  93           HB3      ASP  93  20.891 -13.569  10.385
  760    H    SER  94           H        SER  94  20.231 -10.427   8.916
  761    HA   SER  94           HA       SER  94  23.098  -9.791   8.853
  762    HB2  SER  94           HB2      SER  94  21.077  -9.756   6.595
  763    HB3  SER  94           HB3      SER  94  22.817  -9.511   6.442
  764    HG   SER  94           HG       SER  94  22.014 -11.839   7.721
  765    H    ASP  95           H        ASP  95  22.935  -7.702   6.956
  766    HA   ASP  95           HA       ASP  95  22.310  -5.565   8.791
  767    HB2  ASP  95           HB2      ASP  95  23.469  -4.126   7.160
  768    HB3  ASP  95           HB3      ASP  95  24.439  -5.521   7.613
  769    H    ASP  96           H        ASP  96  21.387  -6.357   5.436
  770    HA   ASP  96           HA       ASP  96  18.907  -4.827   5.900
  771    HB2  ASP  96           HB2      ASP  96  20.466  -3.751   4.228
  772    HB3  ASP  96           HB3      ASP  96  20.276  -5.182   3.222
  773    H    VAL  97           H        VAL  97  17.539  -6.447   6.377
  774    HA   VAL  97           HA       VAL  97  17.777  -9.076   5.513
  775    HB   VAL  97           HB       VAL  97  16.460  -8.545   7.457
  776   HG11  VAL  97          HG11      VAL  97  14.199  -7.558   7.246
  777   HG12  VAL  97          HG12      VAL  97  14.590  -7.150   5.577
  778   HG13  VAL  97          HG13      VAL  97  15.516  -6.438   6.898
  779   HG21  VAL  97          HG21      VAL  97  15.935 -10.607   6.244
  780   HG22  VAL  97          HG22      VAL  97  14.699  -9.743   5.331
  781   HG23  VAL  97          HG23      VAL  97  14.523  -9.950   7.074
  782    H    LEU  98           H        LEU  98  15.919  -6.410   4.066
  783    HA   LEU  98           HA       LEU  98  14.537  -8.207   2.314
  784    HB2  LEU  98           HB2      LEU  98  14.412  -5.341   2.906
  785    HB3  LEU  98           HB3      LEU  98  14.047  -5.763   1.240
  786    HG   LEU  98           HG       LEU  98  12.407  -7.447   2.153
  787   HD11  LEU  98          HD11      LEU  98  11.526  -6.952   4.422
  788   HD12  LEU  98          HD12      LEU  98  12.948  -5.944   4.696
  789   HD13  LEU  98          HD13      LEU  98  13.133  -7.674   4.401
  790   HD21  LEU  98          HD21      LEU  98  11.587  -5.445   1.168
  791   HD22  LEU  98          HD22      LEU  98  11.972  -4.508   2.612
  792   HD23  LEU  98          HD23      LEU  98  10.687  -5.717   2.658
  793    H    GLY  99           H        GLY  99  17.169  -5.864   1.934
  794    HA2  GLY  99           HA2      GLY  99  17.487  -6.059  -0.834
  795    HA3  GLY  99           HA3      GLY  99  18.790  -5.744   0.311
  796    H    HIS 100           H        HIS 100  18.610  -8.179   1.732
  797    HA   HIS 100           HA       HIS 100  20.154  -9.818  -0.066
  798    HB2  HIS 100           HB2      HIS 100  19.346 -10.174   2.827
  799    HB3  HIS 100           HB3      HIS 100  20.288 -11.366   1.944
  800    HD1  HIS 100           HD1      HIS 100  22.763 -11.056   1.992
  801    HD2  HIS 100           HD2      HIS 100  20.735  -7.588   3.030
  802    HE1  HIS 100           HE1      HIS 100  24.531  -9.453   2.773
  803    HE2  HIS 100           HE2      HIS 100  23.243  -7.465   3.646
  804    H    ILE 101           H        ILE 101  16.979  -9.860   1.416
  805    HA   ILE 101           HA       ILE 101  16.021 -12.338   0.586
  806    HB   ILE 101           HB       ILE 101  14.711  -9.674   1.014
  807   HG12  ILE 101          HG12      ILE 101  14.393 -12.355   2.372
  808   HG13  ILE 101          HG13      ILE 101  15.357 -11.009   2.967
  809   HG21  ILE 101          HG21      ILE 101  12.494 -10.747   0.702
  810   HG22  ILE 101          HG22      ILE 101  13.317 -12.129  -0.019
  811   HG23  ILE 101          HG23      ILE 101  13.416 -10.547  -0.788
  812   HD11  ILE 101          HD11      ILE 101  13.344  -9.663   3.205
  813   HD12  ILE 101          HD12      ILE 101  13.217 -11.165   4.118
  814   HD13  ILE 101          HD13      ILE 101  12.374 -10.997   2.581
  815    H    MET 102           H        MET 102  15.792  -9.222  -1.115
  816    HA   MET 102           HA       MET 102  14.318 -10.184  -3.292
  817    HB2  MET 102           HB2      MET 102  16.161  -7.791  -3.308
  818    HB3  MET 102           HB3      MET 102  14.760  -8.064  -4.340
  819    HG2  MET 102           HG2      MET 102  13.258  -7.756  -2.559
  820    HG3  MET 102           HG3      MET 102  14.539  -7.867  -1.356
  821    HE1  MET 102           HE1      MET 102  14.228  -5.738  -4.736
  822    HE2  MET 102           HE2      MET 102  13.584  -4.257  -4.020
  823    HE3  MET 102           HE3      MET 102  12.668  -5.766  -3.912
  824    H    LYS 103           H        LYS 103  17.752 -10.159  -2.709
  825    HA   LYS 103           HA       LYS 103  18.319 -10.661  -5.525
  826    HB2  LYS 103           HB2      LYS 103  20.241 -10.407  -3.208
  827    HB3  LYS 103           HB3      LYS 103  20.661 -10.430  -4.913
  828    HG2  LYS 103           HG2      LYS 103  19.048  -8.302  -3.519
  829    HG3  LYS 103           HG3      LYS 103  20.734  -8.173  -4.016
  830    HD2  LYS 103           HD2      LYS 103  20.093  -8.387  -6.345
  831    HD3  LYS 103           HD3      LYS 103  18.407  -8.619  -5.883
  832    HE2  LYS 103           HE2      LYS 103  18.346  -6.379  -4.924
  833    HE3  LYS 103           HE3      LYS 103  20.041  -6.142  -5.344
  834    HZ1  LYS 103           HZ1      LYS 103  18.530  -5.109  -6.946
  835    HZ2  LYS 103           HZ2      LYS 103  17.853  -6.617  -7.293
  836    HZ3  LYS 103           HZ3      LYS 103  19.472  -6.313  -7.671
  837    H    ASN 104           H        ASN 104  18.061 -12.396  -2.528
  838    HA   ASN 104           HA       ASN 104  19.603 -14.648  -3.573
  839    HB2  ASN 104           HB2      ASN 104  19.999 -13.897  -1.249
  840    HB3  ASN 104           HB3      ASN 104  18.336 -14.299  -0.849
  841   HD21  ASN 104          HD21      ASN 104  17.778 -16.411  -0.504
  842   HD22  ASN 104          HD22      ASN 104  18.916 -17.708  -0.474
  843    H    ILE 105           H        ILE 105  16.299 -13.711  -3.185
  844    HA   ILE 105           HA       ILE 105  15.437 -16.487  -3.092
  845    HB   ILE 105           HB       ILE 105  14.289 -14.830  -1.671
  846   HG12  ILE 105          HG12      ILE 105  11.966 -15.533  -2.215
  847   HG13  ILE 105          HG13      ILE 105  12.563 -16.190  -3.735
  848   HG21  ILE 105          HG21      ILE 105  14.320 -12.905  -3.144
  849   HG22  ILE 105          HG22      ILE 105  12.665 -13.278  -2.659
  850   HG23  ILE 105          HG23      ILE 105  13.236 -13.729  -4.265
  851   HD11  ILE 105          HD11      ILE 105  13.393 -17.092  -0.985
  852   HD12  ILE 105          HD12      ILE 105  13.956 -17.768  -2.513
  853   HD13  ILE 105          HD13      ILE 105  12.261 -17.923  -2.049
  854    H    THR 106           H        THR 106  13.927 -17.336  -4.516
  855    HA   THR 106           HA       THR 106  14.675 -17.281  -7.153
  856    HB   THR 106           HB       THR 106  13.561 -19.142  -6.032
  857    HG1  THR 106           HG1      THR 106  13.461 -19.259  -8.247
  858   HG21  THR 106          HG21      THR 106  11.084 -17.424  -6.192
  859   HG22  THR 106          HG22      THR 106  11.887 -17.994  -4.728
  860   HG23  THR 106          HG23      THR 106  11.086 -19.143  -5.799
  861    H    ALA 107           H        ALA 107  12.291 -15.276  -5.554
  862    HA   ALA 107           HA       ALA 107  11.419 -14.277  -8.191
  863    HB1  ALA 107           HB1      ALA 107   9.944 -14.186  -5.564
  864    HB2  ALA 107           HB2      ALA 107   9.601 -15.273  -6.912
  865    HB3  ALA 107           HB3      ALA 107   9.363 -13.534  -7.096
  866    H    LYS 108           H        LYS 108  11.971 -12.232  -8.707
  867    HA   LYS 108           HA       LYS 108  13.209 -10.523  -6.760
  868    HB2  LYS 108           HB2      LYS 108  12.643 -10.375  -9.666
  869    HB3  LYS 108           HB3      LYS 108  12.717  -8.840  -8.821
  870    HG2  LYS 108           HG2      LYS 108  14.866  -9.241  -9.705
  871    HG3  LYS 108           HG3      LYS 108  14.974  -9.522  -7.970
  872    HD2  LYS 108           HD2      LYS 108  14.477 -11.798  -9.853
  873    HD3  LYS 108           HD3      LYS 108  16.109 -11.186  -9.603
  874    HE2  LYS 108           HE2      LYS 108  15.892 -11.604  -7.199
  875    HE3  LYS 108           HE3      LYS 108  14.258 -12.214  -7.454
  876    HZ1  LYS 108           HZ1      LYS 108  15.210 -13.963  -8.863
  877    HZ2  LYS 108           HZ2      LYS 108  15.790 -14.033  -7.273
  878    HZ3  LYS 108           HZ3      LYS 108  16.766 -13.403  -8.505
  879    H    ARG 109           H        ARG 109  11.938  -9.818  -5.187
  880    HA   ARG 109           HA       ARG 109   9.271  -8.788  -5.891
  881    HB2  ARG 109           HB2      ARG 109  10.191  -9.721  -3.170
  882    HB3  ARG 109           HB3      ARG 109   8.544  -9.358  -3.675
  883    HG2  ARG 109           HG2      ARG 109   8.573 -11.266  -5.190
  884    HG3  ARG 109           HG3      ARG 109  10.235 -11.626  -4.713
  885    HD2  ARG 109           HD2      ARG 109   9.405 -11.855  -2.359
  886    HD3  ARG 109           HD3      ARG 109   7.763 -11.729  -2.993
  887    HE   ARG 109           HE       ARG 109   8.323 -13.757  -4.338
  888   HH11  ARG 109          HH11      ARG 109  10.014 -13.085  -1.343
  889   HH12  ARG 109          HH12      ARG 109  10.425 -14.743  -1.055
  890   HH21  ARG 109          HH21      ARG 109   8.883 -15.941  -3.974
  891   HH22  ARG 109          HH22      ARG 109   9.784 -16.368  -2.557
  892    H    SER 110           H        SER 110   8.712  -6.770  -5.246
  893    HA   SER 110           HA       SER 110  10.899  -4.983  -4.769
  894    HB2  SER 110           HB2      SER 110   7.944  -4.343  -4.833
  895    HB3  SER 110           HB3      SER 110   9.281  -3.213  -5.049
  896    HG   SER 110           HG       SER 110   9.760  -5.003  -6.821
  897    H    ARG 111           H        ARG 111  10.886  -3.321  -3.091
  898    HA   ARG 111           HA       ARG 111  10.910  -4.438  -0.532
  899    HB2  ARG 111           HB2      ARG 111  10.875  -1.549  -1.411
  900    HB3  ARG 111           HB3      ARG 111  11.151  -2.061   0.249
  901    HG2  ARG 111           HG2      ARG 111  12.855  -3.084  -1.991
  902    HG3  ARG 111           HG3      ARG 111  13.183  -1.529  -1.229
  903    HD2  ARG 111           HD2      ARG 111  13.457  -2.583   0.915
  904    HD3  ARG 111           HD3      ARG 111  12.943  -4.135   0.260
  905    HE   ARG 111           HE       ARG 111  14.994  -4.053  -1.127
  906   HH11  ARG 111          HH11      ARG 111  14.847  -2.195   1.851
  907   HH12  ARG 111          HH12      ARG 111  16.562  -2.242   2.106
  908   HH21  ARG 111          HH21      ARG 111  17.261  -4.012  -0.819
  909   HH22  ARG 111          HH22      ARG 111  17.925  -3.243   0.586
  910    H    ALA 112           H        ALA 112   8.599  -2.140  -1.955
  911    HA   ALA 112           HA       ALA 112   6.902  -1.997   0.292
  912    HB1  ALA 112           HB1      ALA 112   5.283  -0.977  -1.227
  913    HB2  ALA 112           HB2      ALA 112   6.248  -1.491  -2.609
  914    HB3  ALA 112           HB3      ALA 112   6.894  -0.310  -1.472
  915    H    ARG 113           H        ARG 113   7.270  -4.380  -2.157
  916    HA   ARG 113           HA       ARG 113   4.639  -5.525  -1.832
  917    HB2  ARG 113           HB2      ARG 113   6.654  -5.707  -3.755
  918    HB3  ARG 113           HB3      ARG 113   6.648  -7.286  -2.987
  919    HG2  ARG 113           HG2      ARG 113   4.073  -6.092  -3.877
  920    HG3  ARG 113           HG3      ARG 113   5.160  -6.804  -5.068
  921    HD2  ARG 113           HD2      ARG 113   3.490  -8.400  -4.292
  922    HD3  ARG 113           HD3      ARG 113   5.116  -8.914  -3.874
  923    HE   ARG 113           HE       ARG 113   4.562  -8.757  -1.663
  924   HH11  ARG 113          HH11      ARG 113   2.168  -6.975  -3.493
  925   HH12  ARG 113          HH12      ARG 113   1.078  -6.833  -2.149
  926   HH21  ARG 113          HH21      ARG 113   3.121  -8.553   0.079
  927   HH22  ARG 113          HH22      ARG 113   1.622  -7.688  -0.124
  928    H    ILE 114           H        ILE 114   7.954  -6.361  -0.935
  929    HA   ILE 114           HA       ILE 114   7.373  -8.774   0.343
  930    HB   ILE 114           HB       ILE 114   9.618  -6.810   0.714
  931   HG12  ILE 114          HG12      ILE 114   9.520  -9.540  -0.583
  932   HG13  ILE 114          HG13      ILE 114   9.339  -8.021  -1.455
  933   HG21  ILE 114          HG21      ILE 114   9.277  -9.525   1.975
  934   HG22  ILE 114          HG22      ILE 114   9.424  -7.971   2.806
  935   HG23  ILE 114          HG23      ILE 114  10.798  -8.637   1.915
  936   HD11  ILE 114          HD11      ILE 114  11.583  -7.354  -0.825
  937   HD12  ILE 114          HD12      ILE 114  11.606  -8.926  -1.625
  938   HD13  ILE 114          HD13      ILE 114  11.772  -8.827   0.127
  939    H    VAL 115           H        VAL 115   7.704  -5.503   1.693
  940    HA   VAL 115           HA       VAL 115   7.252  -6.313   4.354
  941    HB   VAL 115           HB       VAL 115   7.053  -4.014   4.930
  942   HG11  VAL 115          HG11      VAL 115   9.062  -3.070   3.926
  943   HG12  VAL 115          HG12      VAL 115   9.001  -4.297   2.660
  944   HG13  VAL 115          HG13      VAL 115   9.280  -4.772   4.335
  945   HG21  VAL 115          HG21      VAL 115   6.818  -2.205   3.334
  946   HG22  VAL 115          HG22      VAL 115   5.454  -3.317   3.191
  947   HG23  VAL 115          HG23      VAL 115   6.757  -3.363   2.003
  948    H    ASP 116           H        ASP 116   5.089  -5.238   1.795
  949    HA   ASP 116           HA       ASP 116   2.711  -4.997   3.246
  950    HB2  ASP 116           HB2      ASP 116   2.963  -4.241   0.944
  951    HB3  ASP 116           HB3      ASP 116   3.181  -5.898   0.398
  952    H    LYS 117           H        LYS 117   4.333  -7.804   1.894
  953    HA   LYS 117           HA       LYS 117   2.156  -9.592   2.483
  954    HB2  LYS 117           HB2      LYS 117   3.638 -10.027   0.592
  955    HB3  LYS 117           HB3      LYS 117   5.013 -10.153   1.674
  956    HG2  LYS 117           HG2      LYS 117   4.132 -12.326   0.856
  957    HG3  LYS 117           HG3      LYS 117   4.190 -12.178   2.611
  958    HD2  LYS 117           HD2      LYS 117   2.126 -13.248   1.791
  959    HD3  LYS 117           HD3      LYS 117   1.816 -11.772   2.701
  960    HE2  LYS 117           HE2      LYS 117   1.498 -10.557   0.598
  961    HE3  LYS 117           HE3      LYS 117   1.834 -12.035  -0.306
  962    HZ1  LYS 117           HZ1      LYS 117  -0.094 -13.062   0.828
  963    HZ2  LYS 117           HZ2      LYS 117  -0.518 -11.744  -0.156
  964    HZ3  LYS 117           HZ3      LYS 117  -0.455 -11.554   1.519
  965    H    LEU 118           H        LEU 118   5.251  -8.753   3.962
  966    HA   LEU 118           HA       LEU 118   5.282 -10.609   6.058
  967    HB2  LEU 118           HB2      LEU 118   6.699  -8.284   5.321
  968    HB3  LEU 118           HB3      LEU 118   6.140  -8.023   6.963
  969    HG   LEU 118           HG       LEU 118   7.189 -10.240   7.557
  970   HD11  LEU 118          HD11      LEU 118   7.338 -11.175   5.316
  971   HD12  LEU 118          HD12      LEU 118   8.938 -11.064   6.054
  972   HD13  LEU 118          HD13      LEU 118   8.442  -9.885   4.840
  973   HD21  LEU 118          HD21      LEU 118   8.196  -8.115   8.127
  974   HD22  LEU 118          HD22      LEU 118   8.956  -8.030   6.533
  975   HD23  LEU 118          HD23      LEU 118   9.436  -9.287   7.677
  976    H    LEU 119           H        LEU 119   3.787  -7.453   5.767
  977    HA   LEU 119           HA       LEU 119   2.693  -7.282   8.366
  978    HB2  LEU 119           HB2      LEU 119   2.258  -5.917   5.745
  979    HB3  LEU 119           HB3      LEU 119   1.078  -5.676   7.021
  980    HG   LEU 119           HG       LEU 119   2.846  -3.892   6.855
  981   HD11  LEU 119          HD11      LEU 119   3.170  -3.729   9.271
  982   HD12  LEU 119          HD12      LEU 119   2.642  -5.403   9.450
  983   HD13  LEU 119          HD13      LEU 119   1.517  -4.182   8.856
  984   HD21  LEU 119          HD21      LEU 119   5.033  -4.383   7.924
  985   HD22  LEU 119          HD22      LEU 119   4.809  -5.216   6.385
  986   HD23  LEU 119          HD23      LEU 119   4.625  -6.100   7.901
  987    H    ALA 120           H        ALA 120   1.709  -8.877   5.485
  988    HA   ALA 120           HA       ALA 120  -1.062  -9.144   6.224
  989    HB1  ALA 120           HB1      ALA 120  -1.324 -10.309   4.166
  990    HB2  ALA 120           HB2      ALA 120   0.412 -10.605   4.047
  991    HB3  ALA 120           HB3      ALA 120  -0.213  -8.964   3.873
  992    H    LEU 121           H        LEU 121   1.824 -11.197   6.188
  993    HA   LEU 121           HA       LEU 121   0.615 -13.472   7.379
  994    HB2  LEU 121           HB2      LEU 121   3.405 -12.446   7.088
  995    HB3  LEU 121           HB3      LEU 121   3.104 -13.737   8.231
  996    HG   LEU 121           HG       LEU 121   2.255 -15.147   6.426
  997   HD11  LEU 121          HD11      LEU 121   2.549 -14.460   4.088
  998   HD12  LEU 121          HD12      LEU 121   2.981 -12.840   4.636
  999   HD13  LEU 121          HD13      LEU 121   1.361 -13.470   4.932
 1000   HD21  LEU 121          HD21      LEU 121   4.417 -15.457   5.269
 1001   HD22  LEU 121          HD22      LEU 121   4.587 -15.277   7.017
 1002   HD23  LEU 121          HD23      LEU 121   4.964 -13.924   5.952
 1003    H    GLY 122           H        GLY 122   1.591 -10.409   8.520
 1004    HA2  GLY 122           HA2      GLY 122   1.490  -9.429  10.583
 1005    HA3  GLY 122           HA3      GLY 122   0.684 -10.880  11.179
 1006    H    LEU 123           H        LEU 123   3.796 -10.805   9.588
 1007    HA   LEU 123           HA       LEU 123   5.117 -12.133  11.751
 1008    HB2  LEU 123           HB2      LEU 123   6.112 -10.809   9.226
 1009    HB3  LEU 123           HB3      LEU 123   7.177 -11.618  10.362
 1010    HG   LEU 123           HG       LEU 123   4.939 -12.923   8.808
 1011   HD11  LEU 123          HD11      LEU 123   7.932 -13.094   8.496
 1012   HD12  LEU 123          HD12      LEU 123   6.808 -12.317   7.383
 1013   HD13  LEU 123          HD13      LEU 123   6.751 -14.063   7.615
 1014   HD21  LEU 123          HD21      LEU 123   5.257 -13.992  10.965
 1015   HD22  LEU 123          HD22      LEU 123   6.992 -14.106  10.674
 1016   HD23  LEU 123          HD23      LEU 123   5.867 -15.024   9.673
 1017    H    VAL 124           H        VAL 124   4.599  -8.936  10.671
 1018    HA   VAL 124           HA       VAL 124   5.817  -7.850  13.102
 1019    HB   VAL 124           HB       VAL 124   6.730  -5.937  11.798
 1020   HG11  VAL 124          HG11      VAL 124   8.234  -7.714  12.484
 1021   HG12  VAL 124          HG12      VAL 124   8.690  -7.126  10.885
 1022   HG13  VAL 124          HG13      VAL 124   7.820  -8.651  11.050
 1023   HG21  VAL 124          HG21      VAL 124   6.985  -6.136   9.385
 1024   HG22  VAL 124          HG22      VAL 124   5.282  -6.186   9.835
 1025   HG23  VAL 124          HG23      VAL 124   6.125  -7.675   9.407
 1026    H    ALA 125           H        ALA 125   5.161  -5.423  13.239
 1027    HA   ALA 125           HA       ALA 125   2.363  -5.182  12.312
 1028    HB1  ALA 125           HB1      ALA 125   2.541  -5.411  14.742
 1029    HB2  ALA 125           HB2      ALA 125   1.935  -3.818  14.288
 1030    HB3  ALA 125           HB3      ALA 125   3.612  -4.011  14.797
 1031    H    GLU 126           H        GLU 126   5.464  -3.998  12.051
 1032    HA   GLU 126           HA       GLU 126   4.562  -1.685  10.541
 1033    HB2  GLU 126           HB2      GLU 126   6.145  -0.188  11.736
 1034    HB3  GLU 126           HB3      GLU 126   4.840  -0.758  12.772
 1035    HG2  GLU 126           HG2      GLU 126   6.448  -2.569  13.531
 1036    HG3  GLU 126           HG3      GLU 126   7.709  -1.627  12.739
 1037    H    ARG 127           H        ARG 127   6.497  -0.664   9.418
 1038    HA   ARG 127           HA       ARG 127   8.121  -2.771   8.310
 1039    HB2  ARG 127           HB2      ARG 127   7.735   0.129   7.708
 1040    HB3  ARG 127           HB3      ARG 127   9.182  -0.667   7.113
 1041    HG2  ARG 127           HG2      ARG 127   7.489  -0.674   5.413
 1042    HG3  ARG 127           HG3      ARG 127   7.785  -2.319   5.966
 1043    HD2  ARG 127           HD2      ARG 127   5.392  -1.883   5.673
 1044    HD3  ARG 127           HD3      ARG 127   5.786  -2.224   7.356
 1045    HE   ARG 127           HE       ARG 127   5.821   0.573   6.839
 1046   HH11  ARG 127          HH11      ARG 127   3.624  -2.110   7.340
 1047   HH12  ARG 127          HH12      ARG 127   2.371  -1.124   8.020
 1048   HH21  ARG 127          HH21      ARG 127   4.165   1.872   7.715
 1049   HH22  ARG 127          HH22      ARG 127   2.674   1.143   8.228
 1050    H    ARG 128           H        ARG 128   8.406  -0.487  10.808
 1051    HA   ARG 128           HA       ARG 128  11.165   0.028  10.755
 1052    HB2  ARG 128           HB2      ARG 128   9.486   1.354  12.000
 1053    HB3  ARG 128           HB3      ARG 128   9.304   0.022  13.133
 1054    HG2  ARG 128           HG2      ARG 128  11.684   0.255  13.734
 1055    HG3  ARG 128           HG3      ARG 128  11.786   1.658  12.665
 1056    HD2  ARG 128           HD2      ARG 128   9.927   2.682  14.003
 1057    HD3  ARG 128           HD3      ARG 128  10.103   1.346  15.141
 1058    HE   ARG 128           HE       ARG 128  12.559   2.749  14.621
 1059   HH11  ARG 128          HH11      ARG 128   9.659   2.672  16.578
 1060   HH12  ARG 128          HH12      ARG 128  10.354   3.595  17.872
 1061   HH21  ARG 128          HH21      ARG 128  13.472   3.987  16.295
 1062   HH22  ARG 128          HH22      ARG 128  12.528   4.366  17.703
 1063    H    GLU 129           H        GLU 129   9.417  -2.764  11.803
 1064    HA   GLU 129           HA       GLU 129  11.391  -3.631  13.702
 1065    HB2  GLU 129           HB2      GLU 129   9.092  -5.131  12.451
 1066    HB3  GLU 129           HB3      GLU 129  10.079  -5.691  13.790
 1067    HG2  GLU 129           HG2      GLU 129   9.290  -3.909  15.189
 1068    HG3  GLU 129           HG3      GLU 129   8.395  -3.212  13.840
 1069    H    LEU 130           H        LEU 130  10.900  -4.031  10.305
 1070    HA   LEU 130           HA       LEU 130  12.478  -6.448  10.142
 1071    HB2  LEU 130           HB2      LEU 130  12.235  -5.422   7.560
 1072    HB3  LEU 130           HB3      LEU 130  11.285  -6.702   8.280
 1073    HG   LEU 130           HG       LEU 130  10.496  -3.806   8.498
 1074   HD11  LEU 130          HD11      LEU 130  10.675  -4.378   6.141
 1075   HD12  LEU 130          HD12      LEU 130   8.989  -4.203   6.626
 1076   HD13  LEU 130          HD13      LEU 130   9.680  -5.811   6.406
 1077   HD21  LEU 130          HD21      LEU 130   8.264  -4.779   8.861
 1078   HD22  LEU 130          HD22      LEU 130   9.424  -5.295  10.086
 1079   HD23  LEU 130          HD23      LEU 130   8.971  -6.393   8.782
 1080    H    TYR 131           H        TYR 131  13.387  -3.639  10.990
 1081    HA   TYR 131           HA       TYR 131  15.888  -3.720   9.465
 1082    HB2  TYR 131           HB2      TYR 131  14.442  -1.298  10.566
 1083    HB3  TYR 131           HB3      TYR 131  16.081  -1.261   9.922
 1084    HD1  TYR 131           HD1      TYR 131  16.483  -1.387   7.540
 1085    HD2  TYR 131           HD2      TYR 131  12.525  -1.661   9.075
 1086    HE1  TYR 131           HE1      TYR 131  15.585  -1.065   5.272
 1087    HE2  TYR 131           HE2      TYR 131  11.611  -1.342   6.811
 1088    HH   TYR 131           HH       TYR 131  13.500  -1.589   4.025
 1089    H    LYS 132           H        LYS 132  17.654  -3.833  10.602
 1090    HA   LYS 132           HA       LYS 132  17.870  -5.269  12.816
 1091    HB2  LYS 132           HB2      LYS 132  19.618  -4.444  11.117
 1092    HB3  LYS 132           HB3      LYS 132  19.950  -3.173  12.276
 1093    HG2  LYS 132           HG2      LYS 132  21.508  -5.033  12.506
 1094    HG3  LYS 132           HG3      LYS 132  20.528  -4.867  13.960
 1095    HD2  LYS 132           HD2      LYS 132  19.131  -6.706  13.300
 1096    HD3  LYS 132           HD3      LYS 132  19.929  -6.802  11.729
 1097    HE2  LYS 132           HE2      LYS 132  22.007  -7.450  12.789
 1098    HE3  LYS 132           HE3      LYS 132  21.288  -7.252  14.384
 1099    HZ1  LYS 132           HZ1      LYS 132  19.847  -9.084  13.994
 1100    HZ2  LYS 132           HZ2      LYS 132  21.409  -9.583  13.580
 1101    HZ3  LYS 132           HZ3      LYS 132  20.298  -9.185  12.366
 1102    H    LYS 133           H        LYS 133  19.804  -2.968  14.091
 1103    HA   LYS 133           HA       LYS 133  18.637  -2.970  16.605
 1104    HB2  LYS 133           HB2      LYS 133  20.463  -0.891  15.401
 1105    HB3  LYS 133           HB3      LYS 133  20.151  -1.089  17.113
 1106    HG2  LYS 133           HG2      LYS 133  21.308  -3.116  17.233
 1107    HG3  LYS 133           HG3      LYS 133  21.296  -3.335  15.489
 1108    HD2  LYS 133           HD2      LYS 133  22.763  -1.094  16.864
 1109    HD3  LYS 133           HD3      LYS 133  23.502  -2.649  16.482
 1110    HE2  LYS 133           HE2      LYS 133  22.957  -2.279  14.098
 1111    HE3  LYS 133           HE3      LYS 133  22.317  -0.694  14.513
 1112    HZ1  LYS 133           HZ1      LYS 133  25.120  -1.582  14.891
 1113    HZ2  LYS 133           HZ2      LYS 133  24.510  -0.065  15.311
 1114    HZ3  LYS 133           HZ3      LYS 133  24.568  -0.529  13.690
 1115    H    ARG 134           H        ARG 134  18.041  -0.827  17.793
 1116    HA   ARG 134           HA       ARG 134  15.588   0.050  16.702
 1117    HB2  ARG 134           HB2      ARG 134  17.170   0.828  19.116
 1118    HB3  ARG 134           HB3      ARG 134  15.787   1.796  18.635
 1119    HG2  ARG 134           HG2      ARG 134  15.123   0.201  20.305
 1120    HG3  ARG 134           HG3      ARG 134  14.372  -0.208  18.762
 1121    HD2  ARG 134           HD2      ARG 134  15.247  -2.171  19.999
 1122    HD3  ARG 134           HD3      ARG 134  15.947  -1.970  18.394
 1123    HE   ARG 134           HE       ARG 134  17.504  -0.762  20.492
 1124   HH11  ARG 134          HH11      ARG 134  16.829  -3.729  18.770
 1125   HH12  ARG 134          HH12      ARG 134  18.392  -4.417  19.074
 1126   HH21  ARG 134          HH21      ARG 134  19.578  -1.665  20.895
 1127   HH22  ARG 134          HH22      ARG 134  19.950  -3.248  20.291
 1128    H    GLN 135           H        GLN 135  16.335   0.772  14.691
 1129    HA   GLN 135           HA       GLN 135  17.753   3.233  14.429
 1130    HB2  GLN 135           HB2      GLN 135  16.486   2.917  12.028
 1131    HB3  GLN 135           HB3      GLN 135  18.051   2.242  12.445
 1132    HG2  GLN 135           HG2      GLN 135  16.661   0.575  11.398
 1133    HG3  GLN 135           HG3      GLN 135  16.983   0.133  13.068
 1134   HE21  GLN 135          HE21      GLN 135  15.247  -1.217  13.228
 1135   HE22  GLN 135          HE22      GLN 135  13.598  -0.681  13.216
 1136    H    LYS 136           H        LYS 136  16.854   5.048  13.176
 1137    HA   LYS 136           HA       LYS 136  14.020   5.607  13.737
 1138    HB2  LYS 136           HB2      LYS 136  16.384   7.490  13.997
 1139    HB3  LYS 136           HB3      LYS 136  14.707   8.013  14.047
 1140    HG2  LYS 136           HG2      LYS 136  14.305   6.714  16.035
 1141    HG3  LYS 136           HG3      LYS 136  15.940   6.057  15.973
 1142    HD2  LYS 136           HD2      LYS 136  15.326   8.996  16.233
 1143    HD3  LYS 136           HD3      LYS 136  15.598   7.930  17.613
 1144    HE2  LYS 136           HE2      LYS 136  17.815   7.340  16.560
 1145    HE3  LYS 136           HE3      LYS 136  17.535   8.659  15.426
 1146    HZ1  LYS 136           HZ1      LYS 136  17.423  10.192  17.284
 1147    HZ2  LYS 136           HZ2      LYS 136  18.895   9.359  17.288
 1148    HZ3  LYS 136           HZ3      LYS 136  17.677   8.924  18.375
 1149    H    LYS 137           H        LYS 137  14.367   8.242  12.260
 1150    HA   LYS 137           HA       LYS 137  14.064   7.151   9.637
 1151    HB2  LYS 137           HB2      LYS 137  13.465   9.345   8.908
 1152    HB3  LYS 137           HB3      LYS 137  12.712   9.072  10.464
 1153    HG2  LYS 137           HG2      LYS 137  15.182  10.735   9.988
 1154    HG3  LYS 137           HG3      LYS 137  13.551  11.363  10.180
 1155    HD2  LYS 137           HD2      LYS 137  14.154  11.605  12.332
 1156    HD3  LYS 137           HD3      LYS 137  13.807   9.880  12.443
 1157    HE2  LYS 137           HE2      LYS 137  15.967  10.368  13.443
 1158    HE3  LYS 137           HE3      LYS 137  16.177   9.389  11.992
 1159    HZ1  LYS 137           HZ1      LYS 137  16.561  12.333  12.153
 1160    HZ2  LYS 137           HZ2      LYS 137  16.765  11.388  10.768
 1161    HZ3  LYS 137           HZ3      LYS 137  17.795  11.179  12.091
 1162    H    LEU 138           H        LEU 138  16.081   6.189   9.321
 1163    HA   LEU 138           HA       LEU 138  17.935   8.024   8.035
 1164    HB2  LEU 138           HB2      LEU 138  19.898   7.164   8.986
 1165    HB3  LEU 138           HB3      LEU 138  18.826   7.441  10.341
 1166    HG   LEU 138           HG       LEU 138  19.151   4.713   9.100
 1167   HD11  LEU 138          HD11      LEU 138  20.705   5.904  11.398
 1168   HD12  LEU 138          HD12      LEU 138  21.357   5.493   9.812
 1169   HD13  LEU 138          HD13      LEU 138  20.760   4.220  10.876
 1170   HD21  LEU 138          HD21      LEU 138  17.198   5.004  10.508
 1171   HD22  LEU 138          HD22      LEU 138  18.200   5.667  11.797
 1172   HD23  LEU 138          HD23      LEU 138  18.382   3.980  11.317
 1173    H    ALA 139           H        ALA 139  19.552   6.635   6.667
 1174    HA   ALA 139           HA       ALA 139  18.087   4.978   4.926
 1175    HB1  ALA 139           HB1      ALA 139  20.149   6.182   4.282
 1176    HB2  ALA 139           HB2      ALA 139  20.217   4.466   3.884
 1177    HB3  ALA 139           HB3      ALA 139  21.083   5.080   5.293
 1178    H    SER 140           H        SER 140  18.648   2.653   4.475
 1179    HA   SER 140           HA       SER 140  18.038   1.074   6.688
 1180    HB2  SER 140           HB2      SER 140  17.633   0.470   4.288
 1181    HB3  SER 140           HB3      SER 140  19.356   0.130   4.131
 1182    HG   SER 140           HG       SER 140  18.419  -1.801   4.599
 1183    H    SER 141           H        SER 141  19.303   0.902   8.413
 1184    HA   SER 141           HA       SER 141  21.952  -0.175   8.203
 1185    HB2  SER 141           HB2      SER 141  22.105   2.398   7.847
 1186    HB3  SER 141           HB3      SER 141  21.705   2.511   9.561
 1187    HG   SER 141           HG       SER 141  23.987   1.404   8.332
  Start of MODEL   17
    1    H1   ASP   1           HT1      ASP   1 -21.261   6.128  -8.852
    2    H2   ASP   1           HT2      ASP   1 -21.087   7.642  -8.118
    3    H3   ASP   1           HT3      ASP   1 -20.493   7.386  -9.685
    4    HA   ASP   1           HA       ASP   1 -22.758   7.013 -10.475
    5    HB2  ASP   1           HB2      ASP   1 -24.632   7.490  -9.027
    6    HB3  ASP   1           HB3      ASP   1 -23.620   6.291  -8.224
    7    HA   PRO   2           HA       PRO   2 -22.697  11.502 -10.885
    8    HB2  PRO   2           HB2      PRO   2 -24.215  11.683 -13.075
    9    HB3  PRO   2           HB3      PRO   2 -22.598  10.977 -13.148
   10    HG2  PRO   2           HG2      PRO   2 -25.241   9.652 -13.287
   11    HG3  PRO   2           HG3      PRO   2 -23.685   9.135 -13.956
   12    HD2  PRO   2           HD2      PRO   2 -24.928   8.282 -11.513
   13    HD3  PRO   2           HD3      PRO   2 -23.357   7.786 -12.171
   14    H    SER   3           H        SER   3 -24.871   9.841  -9.345
   15    HA   SER   3           HA       SER   3 -27.347  11.154  -9.920
   16    HB2  SER   3           HB2      SER   3 -26.488   9.258  -7.727
   17    HB3  SER   3           HB3      SER   3 -28.140   9.836  -7.914
   18    HG   SER   3           HG       SER   3 -28.009   8.971 -10.105
   19    H    ARG   4           H        ARG   4 -25.207  11.143  -7.058
   20    HA   ARG   4           HA       ARG   4 -25.836  13.936  -6.593
   21    HB2  ARG   4           HB2      ARG   4 -26.401  13.367  -4.139
   22    HB3  ARG   4           HB3      ARG   4 -27.652  13.126  -5.353
   23    HG2  ARG   4           HG2      ARG   4 -26.987  10.717  -5.435
   24    HG3  ARG   4           HG3      ARG   4 -25.927  11.029  -4.058
   25    HD2  ARG   4           HD2      ARG   4 -28.839  11.737  -3.977
   26    HD3  ARG   4           HD3      ARG   4 -28.294  10.104  -3.620
   27    HE   ARG   4           HE       ARG   4 -26.924  12.132  -2.109
   28   HH11  ARG   4          HH11      ARG   4 -29.751  10.072  -2.232
   29   HH12  ARG   4          HH12      ARG   4 -30.027  10.131  -0.520
   30   HH21  ARG   4          HH21      ARG   4 -27.285  12.200   0.146
   31   HH22  ARG   4          HH22      ARG   4 -28.629  11.340   0.829
   32    H    ARG   5           H        ARG   5 -24.722  14.395  -4.191
   33    HA   ARG   5           HA       ARG   5 -21.970  13.635  -4.523
   34    HB2  ARG   5           HB2      ARG   5 -21.457  15.070  -2.744
   35    HB3  ARG   5           HB3      ARG   5 -22.835  15.844  -3.504
   36    HG2  ARG   5           HG2      ARG   5 -24.248  15.355  -1.764
   37    HG3  ARG   5           HG3      ARG   5 -23.282  13.978  -1.229
   38    HD2  ARG   5           HD2      ARG   5 -23.021  15.771   0.355
   39    HD3  ARG   5           HD3      ARG   5 -21.507  15.549  -0.525
   40    HE   ARG   5           HE       ARG   5 -23.315  17.575  -1.563
   41   HH11  ARG   5          HH11      ARG   5 -20.516  16.876   0.428
   42   HH12  ARG   5          HH12      ARG   5 -19.915  18.502   0.364
   43   HH21  ARG   5          HH21      ARG   5 -22.524  19.708  -1.635
   44   HH22  ARG   5          HH22      ARG   5 -21.060  20.112  -0.791
   45    H    ALA   6           H        ALA   6 -20.768  12.677  -2.638
   46    HA   ALA   6           HA       ALA   6 -21.930  10.165  -1.989
   47    HB1  ALA   6           HB1      ALA   6 -19.414  11.484  -0.989
   48    HB2  ALA   6           HB2      ALA   6 -19.548  10.385  -2.364
   49    HB3  ALA   6           HB3      ALA   6 -19.854   9.795  -0.728
   50    HA   PRO   7           HA       PRO   7 -24.080  11.431   1.758
   51    HB2  PRO   7           HB2      PRO   7 -24.092   8.505   2.149
   52    HB3  PRO   7           HB3      PRO   7 -25.450   9.636   2.134
   53    HG2  PRO   7           HG2      PRO   7 -25.008   7.944   0.111
   54    HG3  PRO   7           HG3      PRO   7 -25.633   9.582  -0.167
   55    HD2  PRO   7           HD2      PRO   7 -22.886   8.494  -0.585
   56    HD3  PRO   7           HD3      PRO   7 -23.788   9.691  -1.538
   57    H    THR   8           H        THR   8 -23.410  11.667   3.842
   58    HA   THR   8           HA       THR   8 -20.744  10.869   4.512
   59    HB   THR   8           HB       THR   8 -21.387  11.899   6.778
   60    HG1  THR   8           HG1      THR   8 -23.750  11.670   6.090
   61   HG21  THR   8          HG21      THR   8 -21.573  13.589   4.281
   62   HG22  THR   8          HG22      THR   8 -20.080  13.068   5.061
   63   HG23  THR   8          HG23      THR   8 -21.174  14.171   5.896
   64    H    TRP   9           H        TRP   9 -20.071   9.296   5.877
   65    HA   TRP   9           HA       TRP   9 -21.926   7.130   6.266
   66    HB2  TRP   9           HB2      TRP   9 -18.982   7.380   6.893
   67    HB3  TRP   9           HB3      TRP   9 -19.923   5.911   7.117
   68    HD1  TRP   9           HD1      TRP   9 -18.540   8.174   4.349
   69    HE1  TRP   9           HE1      TRP   9 -18.464   6.832   2.163
   70    HE3  TRP   9           HE3      TRP   9 -20.935   3.926   5.906
   71    HZ2  TRP   9           HZ2      TRP   9 -19.294   4.312   1.217
   72    HZ3  TRP   9           HZ3      TRP   9 -21.261   2.098   4.283
   73    HH2  TRP   9           HH2      TRP   9 -20.456   2.293   1.990
   74    H    SER  10           H        SER  10 -23.122   6.871   8.002
   75    HA   SER  10           HA       SER  10 -22.498   8.022  10.558
   76    HB2  SER  10           HB2      SER  10 -24.838   7.646   9.929
   77    HB3  SER  10           HB3      SER  10 -24.532   5.926   9.709
   78    HG   SER  10           HG       SER  10 -25.509   6.360  11.728
   79    HA   PRO  11           HA       PRO  11 -19.734   4.877  12.140
   80    HB2  PRO  11           HB2      PRO  11 -20.909   4.537  14.658
   81    HB3  PRO  11           HB3      PRO  11 -19.651   5.706  14.255
   82    HG2  PRO  11           HG2      PRO  11 -22.598   6.090  14.469
   83    HG3  PRO  11           HG3      PRO  11 -21.286   7.196  14.913
   84    HD2  PRO  11           HD2      PRO  11 -22.720   7.564  12.683
   85    HD3  PRO  11           HD3      PRO  11 -20.977   7.905  12.723
   86    H    GLU  12           H        GLU  12 -23.203   4.522  12.428
   87    HA   GLU  12           HA       GLU  12 -23.268   1.721  12.898
   88    HB2  GLU  12           HB2      GLU  12 -25.369   3.482  11.626
   89    HB3  GLU  12           HB3      GLU  12 -25.632   1.910  12.368
   90    HG2  GLU  12           HG2      GLU  12 -25.179   2.761  14.536
   91    HG3  GLU  12           HG3      GLU  12 -24.576   4.281  13.877
   92    H    GLU  13           H        GLU  13 -23.017   3.714  10.066
   93    HA   GLU  13           HA       GLU  13 -23.750   1.593   8.241
   94    HB2  GLU  13           HB2      GLU  13 -24.280   4.071   7.926
   95    HB3  GLU  13           HB3      GLU  13 -22.584   4.273   7.510
   96    HG2  GLU  13           HG2      GLU  13 -23.885   4.069   5.503
   97    HG3  GLU  13           HG3      GLU  13 -22.862   2.643   5.686
   98    H    GLU  14           H        GLU  14 -20.823   3.320   9.248
   99    HA   GLU  14           HA       GLU  14 -19.067   2.068   7.417
  100    HB2  GLU  14           HB2      GLU  14 -18.450   3.149  10.179
  101    HB3  GLU  14           HB3      GLU  14 -17.266   2.773   8.934
  102    HG2  GLU  14           HG2      GLU  14 -18.397   4.464   7.477
  103    HG3  GLU  14           HG3      GLU  14 -19.363   4.922   8.879
  104    H    ALA  15           H        ALA  15 -20.288   1.131  10.577
  105    HA   ALA  15           HA       ALA  15 -18.691  -1.205  10.851
  106    HB1  ALA  15           HB1      ALA  15 -20.313  -1.870  12.561
  107    HB2  ALA  15           HB2      ALA  15 -21.389  -0.568  12.050
  108    HB3  ALA  15           HB3      ALA  15 -19.819  -0.190  12.763
  109    H    HIS  16           H        HIS  16 -21.735  -0.485   9.315
  110    HA   HIS  16           HA       HIS  16 -22.444  -3.127   8.604
  111    HB2  HIS  16           HB2      HIS  16 -24.096  -1.306   8.697
  112    HB3  HIS  16           HB3      HIS  16 -23.272  -0.482   7.380
  113    HD1  HIS  16           HD1      HIS  16 -25.117  -0.534   5.705
  114    HD2  HIS  16           HD2      HIS  16 -24.219  -4.303   7.228
  115    HE1  HIS  16           HE1      HIS  16 -26.436  -2.177   4.316
  116    HE2  HIS  16           HE2      HIS  16 -26.022  -4.419   5.382
  117    H    LEU  17           H        LEU  17 -20.411  -0.673   7.231
  118    HA   LEU  17           HA       LEU  17 -20.118  -1.764   4.646
  119    HB2  LEU  17           HB2      LEU  17 -19.444   0.550   5.472
  120    HB3  LEU  17           HB3      LEU  17 -18.030  -0.214   6.168
  121    HG   LEU  17           HG       LEU  17 -17.308  -0.931   3.926
  122   HD11  LEU  17          HD11      LEU  17 -18.454   0.061   1.959
  123   HD12  LEU  17          HD12      LEU  17 -19.765   0.558   3.026
  124   HD13  LEU  17          HD13      LEU  17 -19.411  -1.155   2.801
  125   HD21  LEU  17          HD21      LEU  17 -16.701   1.264   3.086
  126   HD22  LEU  17          HD22      LEU  17 -16.531   1.192   4.841
  127   HD23  LEU  17          HD23      LEU  17 -17.920   2.009   4.122
  128    H    ARG  18           H        ARG  18 -18.203  -2.115   7.626
  129    HA   ARG  18           HA       ARG  18 -16.520  -4.132   6.504
  130    HB2  ARG  18           HB2      ARG  18 -15.609  -4.396   8.705
  131    HB3  ARG  18           HB3      ARG  18 -15.856  -2.678   8.440
  132    HG2  ARG  18           HG2      ARG  18 -17.867  -2.727   9.782
  133    HG3  ARG  18           HG3      ARG  18 -17.710  -4.469   9.992
  134    HD2  ARG  18           HD2      ARG  18 -16.894  -3.449  11.974
  135    HD3  ARG  18           HD3      ARG  18 -15.496  -4.046  11.084
  136    HE   ARG  18           HE       ARG  18 -15.832  -1.410  10.320
  137   HH11  ARG  18          HH11      ARG  18 -15.187  -3.169  13.270
  138   HH12  ARG  18          HH12      ARG  18 -14.296  -1.877  14.003
  139   HH21  ARG  18          HH21      ARG  18 -14.654   0.309  11.282
  140   HH22  ARG  18          HH22      ARG  18 -14.016   0.109  12.884
  141    H    GLU  19           H        GLU  19 -19.558  -3.995   8.166
  142    HA   GLU  19           HA       GLU  19 -19.878  -6.549   9.099
  143    HB2  GLU  19           HB2      GLU  19 -21.513  -4.820   9.517
  144    HB3  GLU  19           HB3      GLU  19 -21.927  -4.764   7.810
  145    HG2  GLU  19           HG2      GLU  19 -23.603  -5.938   9.133
  146    HG3  GLU  19           HG3      GLU  19 -22.859  -6.978   7.922
  147    H    LEU  20           H        LEU  20 -20.814  -5.306   5.928
  148    HA   LEU  20           HA       LEU  20 -21.581  -7.806   4.849
  149    HB2  LEU  20           HB2      LEU  20 -21.684  -5.091   4.121
  150    HB3  LEU  20           HB3      LEU  20 -20.802  -5.896   2.841
  151    HG   LEU  20           HG       LEU  20 -23.446  -6.953   3.791
  152   HD11  LEU  20          HD11      LEU  20 -23.003  -4.881   1.649
  153   HD12  LEU  20          HD12      LEU  20 -23.768  -4.599   3.210
  154   HD13  LEU  20          HD13      LEU  20 -24.530  -5.670   2.035
  155   HD21  LEU  20          HD21      LEU  20 -22.107  -8.427   2.408
  156   HD22  LEU  20          HD22      LEU  20 -21.926  -7.159   1.196
  157   HD23  LEU  20          HD23      LEU  20 -23.515  -7.859   1.509
  158    H    TYR  21           H        TYR  21 -18.546  -6.129   5.077
  159    HA   TYR  21           HA       TYR  21 -17.185  -7.620   3.050
  160    HB2  TYR  21           HB2      TYR  21 -16.362  -5.417   3.743
  161    HB3  TYR  21           HB3      TYR  21 -16.105  -6.011   5.379
  162    HD1  TYR  21           HD1      TYR  21 -14.138  -7.241   5.949
  163    HD2  TYR  21           HD2      TYR  21 -14.914  -6.240   1.889
  164    HE1  TYR  21           HE1      TYR  21 -11.850  -7.923   5.351
  165    HE2  TYR  21           HE2      TYR  21 -12.632  -6.918   1.281
  166    HH   TYR  21           HH       TYR  21 -10.512  -7.285   2.216
  167    H    LEU  22           H        LEU  22 -17.171  -7.686   6.588
  168    HA   LEU  22           HA       LEU  22 -15.433  -9.864   6.892
  169    HB2  LEU  22           HB2      LEU  22 -17.660  -9.057   8.769
  170    HB3  LEU  22           HB3      LEU  22 -16.205  -9.944   9.178
  171    HG   LEU  22           HG       LEU  22 -16.294  -7.066   8.266
  172   HD11  LEU  22          HD11      LEU  22 -15.654  -6.532  10.558
  173   HD12  LEU  22          HD12      LEU  22 -15.807  -8.235  10.997
  174   HD13  LEU  22          HD13      LEU  22 -17.227  -7.326  10.484
  175   HD21  LEU  22          HD21      LEU  22 -13.960  -6.965   8.742
  176   HD22  LEU  22          HD22      LEU  22 -14.230  -8.319   7.642
  177   HD23  LEU  22          HD23      LEU  22 -13.956  -8.618   9.359
  178    H    ALA  23           H        ALA  23 -18.804  -9.688   6.151
  179    HA   ALA  23           HA       ALA  23 -19.421 -12.414   6.723
  180    HB1  ALA  23           HB1      ALA  23 -20.850 -10.461   4.920
  181    HB2  ALA  23           HB2      ALA  23 -21.142 -10.665   6.647
  182    HB3  ALA  23           HB3      ALA  23 -21.497 -11.983   5.531
  183    H    ASN  24           H        ASN  24 -18.847 -10.647   3.660
  184    HA   ASN  24           HA       ASN  24 -18.878 -13.208   2.252
  185    HB2  ASN  24           HB2      ASN  24 -19.104 -10.358   1.294
  186    HB3  ASN  24           HB3      ASN  24 -19.005 -11.735   0.203
  187   HD21  ASN  24          HD21      ASN  24 -20.951 -10.059   2.545
  188   HD22  ASN  24          HD22      ASN  24 -22.437 -10.876   2.190
  189    H    LYS  25           H        LYS  25 -16.494 -11.991   3.794
  190    HA   LYS  25           HA       LYS  25 -14.568 -11.538   1.698
  191    HB2  LYS  25           HB2      LYS  25 -12.904 -11.531   3.549
  192    HB3  LYS  25           HB3      LYS  25 -14.216 -10.388   3.775
  193    HG2  LYS  25           HG2      LYS  25 -15.276 -11.835   5.373
  194    HG3  LYS  25           HG3      LYS  25 -14.079 -13.098   5.074
  195    HD2  LYS  25           HD2      LYS  25 -13.380 -10.354   6.112
  196    HD3  LYS  25           HD3      LYS  25 -13.717 -11.733   7.158
  197    HE2  LYS  25           HE2      LYS  25 -11.580 -11.698   5.035
  198    HE3  LYS  25           HE3      LYS  25 -11.294 -11.329   6.733
  199    HZ1  LYS  25           HZ1      LYS  25 -11.732 -13.508   7.359
  200    HZ2  LYS  25           HZ2      LYS  25 -10.859 -13.698   5.922
  201    HZ3  LYS  25           HZ3      LYS  25 -12.545 -13.887   5.919
  202    H    ASP  26           H        ASP  26 -15.832 -14.244   3.349
  203    HA   ASP  26           HA       ASP  26 -13.510 -15.908   2.699
  204    HB2  ASP  26           HB2      ASP  26 -15.813 -16.265   4.596
  205    HB3  ASP  26           HB3      ASP  26 -14.783 -17.615   4.136
  206    H    VAL  27           H        VAL  27 -15.957 -14.977   0.966
  207    HA   VAL  27           HA       VAL  27 -16.894 -17.562   0.075
  208    HB   VAL  27           HB       VAL  27 -18.358 -16.347  -1.399
  209   HG11  VAL  27          HG11      VAL  27 -19.163 -16.645   0.845
  210   HG12  VAL  27          HG12      VAL  27 -19.668 -15.057   0.261
  211   HG13  VAL  27          HG13      VAL  27 -18.310 -15.198   1.376
  212   HG21  VAL  27          HG21      VAL  27 -16.874 -14.549  -2.048
  213   HG22  VAL  27          HG22      VAL  27 -16.983 -13.863  -0.426
  214   HG23  VAL  27          HG23      VAL  27 -18.409 -13.906  -1.465
  215    H    GLU  28           H        GLU  28 -16.392 -18.467  -1.876
  216    HA   GLU  28           HA       GLU  28 -14.283 -17.101  -3.391
  217    HB2  GLU  28           HB2      GLU  28 -14.547 -20.063  -2.863
  218    HB3  GLU  28           HB3      GLU  28 -13.331 -19.324  -3.898
  219    HG2  GLU  28           HG2      GLU  28 -12.603 -18.001  -1.870
  220    HG3  GLU  28           HG3      GLU  28 -13.642 -19.063  -0.922
  221    H    GLY  29           H        GLY  29 -14.447 -17.095  -5.566
  222    HA2  GLY  29           HA2      GLY  29 -15.455 -17.527  -7.655
  223    HA3  GLY  29           HA3      GLY  29 -16.735 -18.415  -6.831
  224    H    GLN  30           H        GLN  30 -16.250 -15.778  -5.058
  225    HA   GLN  30           HA       GLN  30 -17.998 -13.998  -6.585
  226    HB2  GLN  30           HB2      GLN  30 -19.527 -15.117  -5.128
  227    HB3  GLN  30           HB3      GLN  30 -18.420 -15.004  -3.767
  228    HG2  GLN  30           HG2      GLN  30 -18.683 -12.475  -3.989
  229    HG3  GLN  30           HG3      GLN  30 -20.062 -12.836  -5.024
  230   HE21  GLN  30          HE21      GLN  30 -19.710 -11.609  -2.297
  231   HE22  GLN  30          HE22      GLN  30 -20.846 -12.458  -1.302
  232    H    ASP  31           H        ASP  31 -17.668 -11.806  -6.137
  233    HA   ASP  31           HA       ASP  31 -15.239 -11.126  -4.705
  234    HB2  ASP  31           HB2      ASP  31 -17.246  -9.447  -6.218
  235    HB3  ASP  31           HB3      ASP  31 -15.863  -8.771  -5.368
  236    H    VAL  32           H        VAL  32 -15.144 -10.265  -2.698
  237    HA   VAL  32           HA       VAL  32 -17.463 -10.074  -1.073
  238    HB   VAL  32           HB       VAL  32 -15.173 -10.427  -0.139
  239   HG11  VAL  32          HG11      VAL  32 -13.925  -8.869  -1.524
  240   HG12  VAL  32          HG12      VAL  32 -13.694  -8.504   0.184
  241   HG13  VAL  32          HG13      VAL  32 -14.781  -7.512  -0.793
  242   HG21  VAL  32          HG21      VAL  32 -15.450  -8.898   1.792
  243   HG22  VAL  32          HG22      VAL  32 -16.929  -9.746   1.343
  244   HG23  VAL  32          HG23      VAL  32 -16.713  -8.055   0.893
  245    H    VAL  33           H        VAL  33 -15.566  -7.833  -2.955
  246    HA   VAL  33           HA       VAL  33 -16.633  -5.394  -2.205
  247    HB   VAL  33           HB       VAL  33 -16.204  -5.681  -5.089
  248   HG11  VAL  33          HG11      VAL  33 -16.320  -3.530  -4.084
  249   HG12  VAL  33          HG12      VAL  33 -14.680  -3.784  -4.676
  250   HG13  VAL  33          HG13      VAL  33 -15.031  -3.928  -2.954
  251   HG21  VAL  33          HG21      VAL  33 -13.671  -5.869  -4.709
  252   HG22  VAL  33          HG22      VAL  33 -14.639  -7.339  -4.665
  253   HG23  VAL  33          HG23      VAL  33 -14.104  -6.596  -3.161
  254    H    GLU  34           H        GLU  34 -17.583  -7.459  -4.924
  255    HA   GLU  34           HA       GLU  34 -19.692  -5.961  -5.904
  256    HB2  GLU  34           HB2      GLU  34 -18.585  -8.055  -6.881
  257    HB3  GLU  34           HB3      GLU  34 -19.681  -8.979  -5.865
  258    HG2  GLU  34           HG2      GLU  34 -20.743  -8.910  -7.927
  259    HG3  GLU  34           HG3      GLU  34 -21.547  -7.648  -6.993
  260    H    ALA  35           H        ALA  35 -19.629  -8.352  -3.336
  261    HA   ALA  35           HA       ALA  35 -22.385  -8.490  -2.801
  262    HB1  ALA  35           HB1      ALA  35 -21.694  -9.329  -0.594
  263    HB2  ALA  35           HB2      ALA  35 -20.036  -8.837  -0.942
  264    HB3  ALA  35           HB3      ALA  35 -20.803 -10.102  -1.905
  265    H    ILE  36           H        ILE  36 -19.827  -6.536  -1.303
  266    HA   ILE  36           HA       ILE  36 -21.497  -5.189   0.510
  267    HB   ILE  36           HB       ILE  36 -18.938  -4.109  -0.659
  268   HG12  ILE  36          HG12      ILE  36 -19.246  -5.883   1.769
  269   HG13  ILE  36          HG13      ILE  36 -18.745  -6.473   0.189
  270   HG21  ILE  36          HG21      ILE  36 -18.751  -2.992   1.524
  271   HG22  ILE  36          HG22      ILE  36 -20.319  -3.661   1.984
  272   HG23  ILE  36          HG23      ILE  36 -20.208  -2.510   0.651
  273   HD11  ILE  36          HD11      ILE  36 -16.791  -5.022   0.272
  274   HD12  ILE  36          HD12      ILE  36 -16.848  -6.131   1.642
  275   HD13  ILE  36          HD13      ILE  36 -17.296  -4.440   1.859
  276    H    LEU  37           H        LEU  37 -20.065  -4.028  -2.534
  277    HA   LEU  37           HA       LEU  37 -21.045  -1.453  -2.571
  278    HB2  LEU  37           HB2      LEU  37 -20.968  -3.075  -5.090
  279    HB3  LEU  37           HB3      LEU  37 -20.601  -1.385  -4.878
  280    HG   LEU  37           HG       LEU  37 -18.856  -3.549  -3.728
  281   HD11  LEU  37          HD11      LEU  37 -17.431  -3.273  -5.700
  282   HD12  LEU  37          HD12      LEU  37 -18.640  -2.216  -6.423
  283   HD13  LEU  37          HD13      LEU  37 -19.016  -3.912  -6.131
  284   HD21  LEU  37          HD21      LEU  37 -18.351  -0.668  -4.438
  285   HD22  LEU  37          HD22      LEU  37 -17.182  -1.788  -3.741
  286   HD23  LEU  37          HD23      LEU  37 -18.602  -1.302  -2.814
  287    H    ALA  38           H        ALA  38 -22.660  -4.394  -3.597
  288    HA   ALA  38           HA       ALA  38 -24.823  -2.920  -4.838
  289    HB1  ALA  38           HB1      ALA  38 -25.542  -5.058  -5.674
  290    HB2  ALA  38           HB2      ALA  38 -24.393  -5.885  -4.620
  291    HB3  ALA  38           HB3      ALA  38 -23.808  -4.861  -5.933
  292    H    HIS  39           H        HIS  39 -24.307  -4.854  -1.936
  293    HA   HIS  39           HA       HIS  39 -27.127  -5.305  -1.574
  294    HB2  HIS  39           HB2      HIS  39 -24.694  -6.046  -0.010
  295    HB3  HIS  39           HB3      HIS  39 -26.277  -6.134   0.753
  296    HD1  HIS  39           HD1      HIS  39 -27.790  -8.050   0.103
  297    HD2  HIS  39           HD2      HIS  39 -24.301  -7.886  -2.137
  298    HE1  HIS  39           HE1      HIS  39 -27.736 -10.191  -1.213
  299    HE2  HIS  39           HE2      HIS  39 -25.716  -9.975  -2.704
  300    H    LEU  40           H        LEU  40 -24.818  -2.944  -0.375
  301    HA   LEU  40           HA       LEU  40 -26.856  -2.015   1.484
  302    HB2  LEU  40           HB2      LEU  40 -24.997  -0.249   2.014
  303    HB3  LEU  40           HB3      LEU  40 -24.960  -1.855   2.693
  304    HG   LEU  40           HG       LEU  40 -23.346  -2.455   0.816
  305   HD11  LEU  40          HD11      LEU  40 -22.066  -0.592  -0.130
  306   HD12  LEU  40          HD12      LEU  40 -23.210   0.547   0.584
  307   HD13  LEU  40          HD13      LEU  40 -23.746  -0.581  -0.667
  308   HD21  LEU  40          HD21      LEU  40 -22.681  -2.152   3.133
  309   HD22  LEU  40          HD22      LEU  40 -22.536  -0.413   2.876
  310   HD23  LEU  40          HD23      LEU  40 -21.451  -1.522   2.038
  311    H    ASN  41           H        ASN  41 -28.338  -1.402  -0.094
  312    HA   ASN  41           HA       ASN  41 -27.738   0.824  -1.838
  313    HB2  ASN  41           HB2      ASN  41 -30.365  -0.533  -1.178
  314    HB3  ASN  41           HB3      ASN  41 -30.169   0.733  -2.385
  315   HD21  ASN  41          HD21      ASN  41 -29.689  -2.601  -1.637
  316   HD22  ASN  41          HD22      ASN  41 -29.150  -3.090  -3.204
  317    H    THR  42           H        THR  42 -27.113   1.428   0.707
  318    HA   THR  42           HA       THR  42 -29.239   3.184   1.709
  319    HB   THR  42           HB       THR  42 -28.484   1.643   3.385
  320    HG1  THR  42           HG1      THR  42 -27.132   3.324   4.738
  321   HG21  THR  42          HG21      THR  42 -25.665   2.562   2.814
  322   HG22  THR  42          HG22      THR  42 -26.356   1.009   2.347
  323   HG23  THR  42          HG23      THR  42 -26.149   1.403   4.055
  324    H    VAL  43           H        VAL  43 -26.241   3.106   0.096
  325    HA   VAL  43           HA       VAL  43 -25.977   6.012   0.371
  326    HB   VAL  43           HB       VAL  43 -23.454   5.655   0.204
  327   HG11  VAL  43          HG11      VAL  43 -24.819   4.841   2.755
  328   HG12  VAL  43          HG12      VAL  43 -24.549   6.496   2.207
  329   HG13  VAL  43          HG13      VAL  43 -23.174   5.460   2.597
  330   HG21  VAL  43          HG21      VAL  43 -23.412   3.304  -0.344
  331   HG22  VAL  43          HG22      VAL  43 -24.265   2.908   1.147
  332   HG23  VAL  43          HG23      VAL  43 -22.625   3.550   1.214
  333    HA   PRO  44           HA       PRO  44 -25.800   5.501  -4.164
  334    HB2  PRO  44           HB2      PRO  44 -26.101   8.397  -4.094
  335    HB3  PRO  44           HB3      PRO  44 -27.140   7.187  -4.849
  336    HG2  PRO  44           HG2      PRO  44 -27.808   8.632  -2.620
  337    HG3  PRO  44           HG3      PRO  44 -28.512   7.064  -3.043
  338    HD2  PRO  44           HD2      PRO  44 -26.510   7.763  -0.983
  339    HD3  PRO  44           HD3      PRO  44 -27.681   6.434  -1.015
  340    H    ARG  45           H        ARG  45 -23.604   5.055  -4.304
  341    HA   ARG  45           HA       ARG  45 -21.906   7.334  -4.777
  342    HB2  ARG  45           HB2      ARG  45 -20.156   6.717  -3.231
  343    HB3  ARG  45           HB3      ARG  45 -21.645   6.998  -2.344
  344    HG2  ARG  45           HG2      ARG  45 -21.909   4.424  -2.555
  345    HG3  ARG  45           HG3      ARG  45 -20.171   4.468  -2.850
  346    HD2  ARG  45           HD2      ARG  45 -21.696   5.192  -0.399
  347    HD3  ARG  45           HD3      ARG  45 -20.240   4.226  -0.563
  348    HE   ARG  45           HE       ARG  45 -19.098   6.396  -1.058
  349   HH11  ARG  45          HH11      ARG  45 -22.017   6.328   0.868
  350   HH12  ARG  45          HH12      ARG  45 -21.632   7.782   1.733
  351   HH21  ARG  45          HH21      ARG  45 -18.599   8.333   0.093
  352   HH22  ARG  45          HH22      ARG  45 -19.712   8.910   1.295
  353    H    THR  46           H        THR  46 -19.699   6.619  -5.494
  354    HA   THR  46           HA       THR  46 -19.948   4.469  -7.358
  355    HB   THR  46           HB       THR  46 -18.621   6.515  -7.834
  356    HG1  THR  46           HG1      THR  46 -17.375   5.356  -9.126
  357   HG21  THR  46          HG21      THR  46 -16.701   5.323  -5.842
  358   HG22  THR  46          HG22      THR  46 -17.547   6.864  -5.694
  359   HG23  THR  46          HG23      THR  46 -16.319   6.647  -6.941
  360    H    ARG  47           H        ARG  47 -18.232   2.763  -7.470
  361    HA   ARG  47           HA       ARG  47 -18.526   1.248  -5.059
  362    HB2  ARG  47           HB2      ARG  47 -17.183   0.609  -7.693
  363    HB3  ARG  47           HB3      ARG  47 -17.352  -0.540  -6.376
  364    HG2  ARG  47           HG2      ARG  47 -19.083  -0.998  -7.931
  365    HG3  ARG  47           HG3      ARG  47 -19.839  -0.224  -6.540
  366    HD2  ARG  47           HD2      ARG  47 -20.748   0.660  -8.618
  367    HD3  ARG  47           HD3      ARG  47 -19.862   1.910  -7.740
  368    HE   ARG  47           HE       ARG  47 -18.220   0.558  -9.652
  369   HH11  ARG  47          HH11      ARG  47 -20.658   3.060  -9.330
  370   HH12  ARG  47          HH12      ARG  47 -20.132   3.922 -10.739
  371   HH21  ARG  47          HH21      ARG  47 -17.537   1.694 -11.498
  372   HH22  ARG  47          HH22      ARG  47 -18.360   3.143 -11.973
  373    H    LYS  48           H        LYS  48 -16.050   3.081  -6.581
  374    HA   LYS  48           HA       LYS  48 -13.730   2.194  -5.359
  375    HB2  LYS  48           HB2      LYS  48 -13.776   3.891  -7.108
  376    HB3  LYS  48           HB3      LYS  48 -14.603   5.007  -6.035
  377    HG2  LYS  48           HG2      LYS  48 -12.587   4.935  -4.557
  378    HG3  LYS  48           HG3      LYS  48 -11.782   4.005  -5.816
  379    HD2  LYS  48           HD2      LYS  48 -11.175   6.333  -6.040
  380    HD3  LYS  48           HD3      LYS  48 -12.190   5.865  -7.405
  381    HE2  LYS  48           HE2      LYS  48 -14.143   6.844  -6.232
  382    HE3  LYS  48           HE3      LYS  48 -13.063   7.387  -4.950
  383    HZ1  LYS  48           HZ1      LYS  48 -13.436   9.187  -6.434
  384    HZ2  LYS  48           HZ2      LYS  48 -13.054   8.248  -7.787
  385    HZ3  LYS  48           HZ3      LYS  48 -11.847   8.665  -6.679
  386    H    GLN  49           H        GLN  49 -16.332   4.154  -4.062
  387    HA   GLN  49           HA       GLN  49 -14.973   5.206  -1.823
  388    HB2  GLN  49           HB2      GLN  49 -17.921   4.708  -2.266
  389    HB3  GLN  49           HB3      GLN  49 -17.253   5.674  -0.957
  390    HG2  GLN  49           HG2      GLN  49 -16.665   6.316  -3.811
  391    HG3  GLN  49           HG3      GLN  49 -18.146   6.873  -3.038
  392   HE21  GLN  49          HE21      GLN  49 -17.569   9.018  -3.225
  393   HE22  GLN  49          HE22      GLN  49 -16.327   9.737  -2.257
  394    H    ILE  50           H        ILE  50 -16.986   2.325  -2.248
  395    HA   ILE  50           HA       ILE  50 -17.039   1.547   0.452
  396    HB   ILE  50           HB       ILE  50 -17.382  -0.003  -2.101
  397   HG12  ILE  50          HG12      ILE  50 -19.700  -0.266  -0.735
  398   HG13  ILE  50          HG13      ILE  50 -19.154   1.281  -0.101
  399   HG21  ILE  50          HG21      ILE  50 -17.505  -1.079   0.705
  400   HG22  ILE  50          HG22      ILE  50 -16.422  -1.588  -0.590
  401   HG23  ILE  50          HG23      ILE  50 -18.150  -1.916  -0.706
  402   HD11  ILE  50          HD11      ILE  50 -18.965   2.097  -2.452
  403   HD12  ILE  50          HD12      ILE  50 -20.604   1.686  -1.947
  404   HD13  ILE  50          HD13      ILE  50 -19.697   0.572  -2.979
  405    H    ILE  51           H        ILE  51 -14.962   0.487  -2.220
  406    HA   ILE  51           HA       ILE  51 -13.300  -1.251  -0.817
  407    HB   ILE  51           HB       ILE  51 -12.515   0.554  -3.110
  408   HG12  ILE  51          HG12      ILE  51 -13.578  -2.273  -3.179
  409   HG13  ILE  51          HG13      ILE  51 -14.523  -0.837  -3.561
  410   HG21  ILE  51          HG21      ILE  51 -10.803  -1.117  -3.585
  411   HG22  ILE  51          HG22      ILE  51 -11.305  -2.035  -2.164
  412   HG23  ILE  51          HG23      ILE  51 -10.599  -0.432  -1.971
  413   HD11  ILE  51          HD11      ILE  51 -13.773  -1.946  -5.577
  414   HD12  ILE  51          HD12      ILE  51 -12.095  -1.807  -5.050
  415   HD13  ILE  51          HD13      ILE  51 -13.023  -0.356  -5.431
  416    H    HIS  52           H        HIS  52 -13.123   2.225  -1.271
  417    HA   HIS  52           HA       HIS  52 -10.528   2.569  -0.272
  418    HB2  HIS  52           HB2      HIS  52 -12.742   4.302  -1.087
  419    HB3  HIS  52           HB3      HIS  52 -11.710   5.001   0.159
  420    HD1  HIS  52           HD1      HIS  52 -10.016   6.439  -0.896
  421    HD2  HIS  52           HD2      HIS  52 -10.756   3.031  -3.175
  422    HE1  HIS  52           HE1      HIS  52  -8.426   6.562  -2.832
  423    HE2  HIS  52           HE2      HIS  52  -8.800   4.435  -4.126
  424    H    HIS  53           H        HIS  53 -13.683   2.895   1.413
  425    HA   HIS  53           HA       HIS  53 -12.459   3.764   3.835
  426    HB2  HIS  53           HB2      HIS  53 -15.161   2.490   3.408
  427    HB3  HIS  53           HB3      HIS  53 -14.620   3.210   4.920
  428    HD1  HIS  53           HD1      HIS  53 -13.618   5.860   4.296
  429    HD2  HIS  53           HD2      HIS  53 -16.787   4.188   2.175
  430    HE1  HIS  53           HE1      HIS  53 -14.787   7.795   3.199
  431    HE2  HIS  53           HE2      HIS  53 -16.498   6.739   1.709
  432    H    LEU  54           H        LEU  54 -12.962   0.656   2.451
  433    HA   LEU  54           HA       LEU  54 -12.882  -0.824   4.895
  434    HB2  LEU  54           HB2      LEU  54 -12.606  -1.601   2.001
  435    HB3  LEU  54           HB3      LEU  54 -12.443  -2.769   3.295
  436    HG   LEU  54           HG       LEU  54 -14.916  -1.085   2.884
  437   HD11  LEU  54          HD11      LEU  54 -14.502  -2.527   0.937
  438   HD12  LEU  54          HD12      LEU  54 -15.920  -3.037   1.853
  439   HD13  LEU  54          HD13      LEU  54 -14.404  -3.923   2.008
  440   HD21  LEU  54          HD21      LEU  54 -14.460  -3.615   4.477
  441   HD22  LEU  54          HD22      LEU  54 -15.962  -2.700   4.365
  442   HD23  LEU  54          HD23      LEU  54 -14.557  -1.991   5.159
  443    H    VAL  55           H        VAL  55 -10.556  -0.128   2.326
  444    HA   VAL  55           HA       VAL  55  -8.416  -1.513   3.624
  445    HB   VAL  55           HB       VAL  55  -6.988  -0.594   1.894
  446   HG11  VAL  55          HG11      VAL  55  -8.200  -1.420  -0.083
  447   HG12  VAL  55          HG12      VAL  55  -9.693  -1.417   0.857
  448   HG13  VAL  55          HG13      VAL  55  -8.365  -2.489   1.309
  449   HG21  VAL  55          HG21      VAL  55  -7.805   0.982   0.229
  450   HG22  VAL  55          HG22      VAL  55  -7.886   1.694   1.841
  451   HG23  VAL  55          HG23      VAL  55  -9.350   1.090   1.069
  452    H    GLN  56           H        GLN  56  -9.752   1.647   3.750
  453    HA   GLN  56           HA       GLN  56  -7.487   2.843   5.074
  454    HB2  GLN  56           HB2      GLN  56 -10.210   3.749   4.246
  455    HB3  GLN  56           HB3      GLN  56  -9.312   4.696   5.411
  456    HG2  GLN  56           HG2      GLN  56  -7.465   4.905   3.809
  457    HG3  GLN  56           HG3      GLN  56  -8.392   3.965   2.639
  458   HE21  GLN  56          HE21      GLN  56 -10.215   4.868   1.702
  459   HE22  GLN  56          HE22      GLN  56 -10.478   6.579   1.676
  460    H    MET  57           H        MET  57 -10.222   1.010   5.976
  461    HA   MET  57           HA       MET  57 -10.217   2.012   8.706
  462    HB2  MET  57           HB2      MET  57 -12.334   1.462   7.481
  463    HB3  MET  57           HB3      MET  57 -11.857  -0.227   7.514
  464    HG2  MET  57           HG2      MET  57 -12.352  -0.469   9.714
  465    HG3  MET  57           HG3      MET  57 -11.958   1.205  10.103
  466    HE1  MET  57           HE1      MET  57 -14.191   0.367   7.056
  467    HE2  MET  57           HE2      MET  57 -15.812   0.271   7.742
  468    HE3  MET  57           HE3      MET  57 -14.632  -0.992   8.089
  469    H    GLY  58           H        GLY  58  -8.258   0.073   7.061
  470    HA2  GLY  58           HA2      GLY  58  -6.462  -1.114   7.892
  471    HA3  GLY  58           HA3      GLY  58  -7.144  -0.951   9.500
  472    H    LEU  59           H        LEU  59  -9.534  -2.207   7.587
  473    HA   LEU  59           HA       LEU  59  -8.989  -4.881   8.583
  474    HB2  LEU  59           HB2      LEU  59 -11.296  -5.392   7.872
  475    HB3  LEU  59           HB3      LEU  59 -11.192  -4.073   9.019
  476    HG   LEU  59           HG       LEU  59 -11.264  -2.589   6.848
  477   HD11  LEU  59          HD11      LEU  59 -11.152  -4.508   5.307
  478   HD12  LEU  59          HD12      LEU  59 -12.604  -3.534   5.086
  479   HD13  LEU  59          HD13      LEU  59 -12.699  -5.076   5.935
  480   HD21  LEU  59          HD21      LEU  59 -12.899  -2.509   8.620
  481   HD22  LEU  59          HD22      LEU  59 -13.653  -3.989   8.030
  482   HD23  LEU  59          HD23      LEU  59 -13.712  -2.520   7.056
  483    H    ALA  60           H        ALA  60  -8.622  -3.088   5.767
  484    HA   ALA  60           HA       ALA  60  -7.786  -5.527   4.364
  485    HB1  ALA  60           HB1      ALA  60  -9.391  -3.293   3.122
  486    HB2  ALA  60           HB2      ALA  60  -9.929  -4.950   3.390
  487    HB3  ALA  60           HB3      ALA  60  -8.639  -4.618   2.234
  488    H    ASP  61           H        ASP  61  -6.288  -4.936   2.478
  489    HA   ASP  61           HA       ASP  61  -4.303  -3.134   3.568
  490    HB2  ASP  61           HB2      ASP  61  -3.578  -5.291   2.701
  491    HB3  ASP  61           HB3      ASP  61  -4.229  -4.899   1.115
  492    H    SER  62           H        SER  62  -5.609  -3.479   0.255
  493    HA   SER  62           HA       SER  62  -5.661  -0.590  -0.048
  494    HB2  SER  62           HB2      SER  62  -3.849  -2.338  -1.729
  495    HB3  SER  62           HB3      SER  62  -4.161  -0.627  -2.019
  496    HG   SER  62           HG       SER  62  -2.706  -1.864   0.058
  497    H    VAL  63           H        VAL  63  -6.368  -0.006  -2.337
  498    HA   VAL  63           HA       VAL  63  -8.683  -1.352  -3.145
  499    HB   VAL  63           HB       VAL  63  -6.851   0.542  -4.623
  500   HG11  VAL  63          HG11      VAL  63  -9.484  -0.572  -5.587
  501   HG12  VAL  63          HG12      VAL  63  -7.898  -0.836  -6.317
  502   HG13  VAL  63          HG13      VAL  63  -8.618   0.775  -6.328
  503   HG21  VAL  63          HG21      VAL  63  -8.098   1.479  -2.761
  504   HG22  VAL  63          HG22      VAL  63  -9.605   0.874  -3.452
  505   HG23  VAL  63          HG23      VAL  63  -8.686   2.121  -4.296
  506    H    LYS  64           H        LYS  64  -5.356  -1.785  -3.889
  507    HA   LYS  64           HA       LYS  64  -5.547  -3.341  -6.228
  508    HB2  LYS  64           HB2      LYS  64  -3.373  -3.605  -4.179
  509    HB3  LYS  64           HB3      LYS  64  -3.250  -3.746  -5.921
  510    HG2  LYS  64           HG2      LYS  64  -3.475  -1.406  -6.228
  511    HG3  LYS  64           HG3      LYS  64  -3.927  -1.163  -4.541
  512    HD2  LYS  64           HD2      LYS  64  -1.706  -1.829  -3.826
  513    HD3  LYS  64           HD3      LYS  64  -1.249  -2.169  -5.494
  514    HE2  LYS  64           HE2      LYS  64  -0.346  -0.040  -4.922
  515    HE3  LYS  64           HE3      LYS  64  -1.693   0.232  -6.023
  516    HZ1  LYS  64           HZ1      LYS  64  -3.078   0.811  -4.136
  517    HZ2  LYS  64           HZ2      LYS  64  -1.705   1.791  -4.177
  518    HZ3  LYS  64           HZ3      LYS  64  -1.799   0.520  -3.069
  519    H    ASP  65           H        ASP  65  -6.091  -4.063  -2.905
  520    HA   ASP  65           HA       ASP  65  -5.657  -6.908  -3.124
  521    HB2  ASP  65           HB2      ASP  65  -5.290  -5.709  -0.994
  522    HB3  ASP  65           HB3      ASP  65  -6.997  -5.289  -0.941
  523    H    PHE  66           H        PHE  66  -8.320  -4.669  -3.312
  524    HA   PHE  66           HA       PHE  66 -10.348  -6.725  -3.584
  525    HB2  PHE  66           HB2      PHE  66 -10.341  -3.729  -3.985
  526    HB3  PHE  66           HB3      PHE  66 -11.754  -4.727  -4.297
  527    HD1  PHE  66           HD1      PHE  66 -13.282  -4.951  -2.675
  528    HD2  PHE  66           HD2      PHE  66  -9.291  -4.042  -1.582
  529    HE1  PHE  66           HE1      PHE  66 -13.988  -4.763  -0.347
  530    HE2  PHE  66           HE2      PHE  66  -9.978  -3.842   0.763
  531    HZ   PHE  66           HZ       PHE  66 -12.330  -4.199   1.395
  532    H    GLN  67           H        GLN  67  -8.681  -4.379  -5.542
  533    HA   GLN  67           HA       GLN  67  -9.479  -5.745  -8.000
  534    HB2  GLN  67           HB2      GLN  67  -9.972  -2.910  -7.166
  535    HB3  GLN  67           HB3      GLN  67  -9.590  -3.231  -8.865
  536    HG2  GLN  67           HG2      GLN  67 -11.481  -4.884  -8.870
  537    HG3  GLN  67           HG3      GLN  67 -11.908  -4.289  -7.265
  538   HE21  GLN  67          HE21      GLN  67 -13.908  -3.569  -8.007
  539   HE22  GLN  67          HE22      GLN  67 -14.060  -2.138  -8.966
  540    H    ARG  68           H        ARG  68  -7.289  -6.564  -7.921
  541    HA   ARG  68           HA       ARG  68  -5.049  -4.869  -8.066
  542    HB2  ARG  68           HB2      ARG  68  -3.891  -6.867  -9.056
  543    HB3  ARG  68           HB3      ARG  68  -4.670  -7.145  -7.507
  544    HG2  ARG  68           HG2      ARG  68  -6.617  -8.101  -8.797
  545    HG3  ARG  68           HG3      ARG  68  -5.579  -8.046 -10.224
  546    HD2  ARG  68           HD2      ARG  68  -3.919  -9.432  -9.012
  547    HD3  ARG  68           HD3      ARG  68  -5.049  -9.552  -7.666
  548    HE   ARG  68           HE       ARG  68  -5.628 -10.594 -10.364
  549   HH11  ARG  68          HH11      ARG  68  -5.791 -10.877  -6.868
  550   HH12  ARG  68          HH12      ARG  68  -6.562 -12.429  -6.909
  551   HH21  ARG  68          HH21      ARG  68  -6.638 -12.646 -10.402
  552   HH22  ARG  68          HH22      ARG  68  -7.045 -13.427  -8.903
  553    H    LYS  69           H        LYS  69  -5.800  -3.242  -9.395
  554    HA   LYS  69           HA       LYS  69  -5.732  -3.792 -12.285
  555    HB2  LYS  69           HB2      LYS  69  -7.785  -2.733 -11.205
  556    HB3  LYS  69           HB3      LYS  69  -6.788  -1.326 -10.889
  557    HG2  LYS  69           HG2      LYS  69  -6.463  -0.973 -13.256
  558    HG3  LYS  69           HG3      LYS  69  -7.361  -2.448 -13.621
  559    HD2  LYS  69           HD2      LYS  69  -8.482  -0.024 -12.212
  560    HD3  LYS  69           HD3      LYS  69  -8.745  -0.432 -13.906
  561    HE2  LYS  69           HE2      LYS  69  -9.863  -2.497 -13.248
  562    HE3  LYS  69           HE3      LYS  69  -9.564  -2.137 -11.552
  563    HZ1  LYS  69           HZ1      LYS  69 -10.943  -0.157 -11.781
  564    HZ2  LYS  69           HZ2      LYS  69 -11.811  -1.557 -12.159
  565    HZ3  LYS  69           HZ3      LYS  69 -11.258  -0.546 -13.397
  566    H    GLY  70           H        GLY  70  -4.557  -1.756  -9.690
  567    HA2  GLY  70           HA2      GLY  70  -2.077  -1.362 -11.214
  568    HA3  GLY  70           HA3      GLY  70  -2.805  -0.020 -10.330
  569    H    THR  71           H        THR  71  -1.168  -3.093 -10.043
  570    HA   THR  71           HA       THR  71  -1.611  -3.447  -7.271
  571    HB   THR  71           HB       THR  71   0.494  -5.032  -7.638
  572    HG1  THR  71           HG1      THR  71  -0.483  -5.133 -10.258
  573   HG21  THR  71          HG21      THR  71  -2.241  -5.532  -8.819
  574   HG22  THR  71          HG22      THR  71  -1.770  -5.783  -7.138
  575   HG23  THR  71          HG23      THR  71  -1.056  -6.773  -8.412
  576    H    HIS  72           H        HIS  72   0.148  -3.738  -5.705
  577    HA   HIS  72           HA       HIS  72   1.839  -1.411  -5.515
  578    HB2  HIS  72           HB2      HIS  72   2.246  -2.089  -3.307
  579    HB3  HIS  72           HB3      HIS  72   0.639  -2.736  -3.594
  580    HD1  HIS  72           HD1      HIS  72   0.624  -5.410  -4.239
  581    HD2  HIS  72           HD2      HIS  72   4.079  -3.924  -2.491
  582    HE1  HIS  72           HE1      HIS  72   1.942  -7.422  -3.532
  583    HE2  HIS  72           HE2      HIS  72   3.850  -6.486  -2.187
  584    H    ILE  73           H        ILE  73   2.112  -3.809  -7.483
  585    HA   ILE  73           HA       ILE  73   4.504  -5.101  -6.582
  586    HB   ILE  73           HB       ILE  73   2.405  -5.685  -8.495
  587   HG12  ILE  73          HG12      ILE  73   2.722  -6.934  -6.440
  588   HG13  ILE  73          HG13      ILE  73   2.941  -7.995  -7.826
  589   HG21  ILE  73          HG21      ILE  73   3.861  -7.210  -9.869
  590   HG22  ILE  73          HG22      ILE  73   5.237  -6.280  -9.262
  591   HG23  ILE  73          HG23      ILE  73   3.987  -5.485 -10.216
  592   HD11  ILE  73          HD11      ILE  73   5.404  -7.708  -7.559
  593   HD12  ILE  73          HD12      ILE  73   4.606  -8.516  -6.210
  594   HD13  ILE  73          HD13      ILE  73   5.084  -6.827  -6.063
  595    H    VAL  74           H        VAL  74   6.387  -4.548  -6.997
  596    HA   VAL  74           HA       VAL  74   7.445  -2.756  -8.810
  597    HB   VAL  74           HB       VAL  74   8.919  -3.524  -7.157
  598   HG11  VAL  74          HG11      VAL  74   9.403  -5.933  -6.768
  599   HG12  VAL  74          HG12      VAL  74   8.156  -6.332  -7.950
  600   HG13  VAL  74          HG13      VAL  74   7.721  -5.500  -6.460
  601   HG21  VAL  74          HG21      VAL  74   9.712  -5.113  -9.597
  602   HG22  VAL  74          HG22      VAL  74  10.781  -4.611  -8.288
  603   HG23  VAL  74          HG23      VAL  74  10.048  -3.401  -9.340
  604    H    LEU  75           H        LEU  75   7.864  -2.855 -10.986
  605    HA   LEU  75           HA       LEU  75   6.505  -4.533 -12.668
  606    HB2  LEU  75           HB2      LEU  75   7.953  -3.776 -14.466
  607    HB3  LEU  75           HB3      LEU  75   7.528  -2.443 -13.413
  608    HG   LEU  75           HG       LEU  75  10.090  -3.782 -12.789
  609   HD11  LEU  75          HD11      LEU  75  10.133  -3.828 -15.220
  610   HD12  LEU  75          HD12      LEU  75  11.278  -2.644 -14.590
  611   HD13  LEU  75          HD13      LEU  75   9.740  -2.110 -15.269
  612   HD21  LEU  75          HD21      LEU  75   9.414  -1.818 -11.555
  613   HD22  LEU  75          HD22      LEU  75   9.201  -0.910 -13.050
  614   HD23  LEU  75          HD23      LEU  75  10.811  -1.428 -12.553
  615    H    TRP  76           H        TRP  76   6.579  -6.667 -12.709
  616    HA   TRP  76           HA       TRP  76   9.148  -8.020 -12.326
  617    HB2  TRP  76           HB2      TRP  76   6.300  -8.865 -11.910
  618    HB3  TRP  76           HB3      TRP  76   7.556 -10.079 -12.136
  619    HD1  TRP  76           HD1      TRP  76   5.873  -8.207  -9.493
  620    HE1  TRP  76           HE1      TRP  76   7.161  -8.345  -7.274
  621    HE3  TRP  76           HE3      TRP  76  10.299 -10.045 -11.245
  622    HZ2  TRP  76           HZ2      TRP  76   9.716  -9.109  -6.386
  623    HZ3  TRP  76           HZ3      TRP  76  12.117 -10.445  -9.639
  624    HH2  TRP  76           HH2      TRP  76  11.829  -9.984  -7.264
  625    H    THR  77           H        THR  77  10.156  -8.431 -14.147
  626    HA   THR  77           HA       THR  77   8.663  -9.394 -16.470
  627    HB   THR  77           HB       THR  77  10.824  -9.207 -17.658
  628    HG1  THR  77           HG1      THR  77  12.620  -8.330 -16.507
  629   HG21  THR  77          HG21      THR  77  11.071  -6.752 -17.536
  630   HG22  THR  77          HG22      THR  77  10.114  -6.738 -16.053
  631   HG23  THR  77          HG23      THR  77   9.373  -7.232 -17.576
  632    H    GLY  78           H        GLY  78   9.305 -11.450 -17.441
  633    HA2  GLY  78           HA2      GLY  78   9.435 -13.573 -15.657
  634    HA3  GLY  78           HA3      GLY  78   9.854 -13.679 -17.361
  635    H    ASP  79           H        ASP  79  12.029 -11.855 -17.254
  636    HA   ASP  79           HA       ASP  79  14.150 -13.540 -16.434
  637    HB2  ASP  79           HB2      ASP  79  14.454 -11.966 -18.251
  638    HB3  ASP  79           HB3      ASP  79  14.103 -10.611 -17.185
  639    H    GLN  80           H        GLN  80  12.859 -10.501 -15.083
  640    HA   GLN  80           HA       GLN  80  14.670 -10.393 -12.914
  641    HB2  GLN  80           HB2      GLN  80  13.361  -8.448 -13.772
  642    HB3  GLN  80           HB3      GLN  80  11.914  -9.165 -13.079
  643    HG2  GLN  80           HG2      GLN  80  12.925  -9.026 -10.852
  644    HG3  GLN  80           HG3      GLN  80  14.347  -8.264 -11.557
  645   HE21  GLN  80          HE21      GLN  80  11.010  -7.885 -10.711
  646   HE22  GLN  80          HE22      GLN  80  10.929  -6.170 -10.919
  647    H    GLU  81           H        GLU  81  11.529 -11.898 -13.340
  648    HA   GLU  81           HA       GLU  81  11.015 -12.562 -10.647
  649    HB2  GLU  81           HB2      GLU  81  10.208 -14.029 -13.172
  650    HB3  GLU  81           HB3      GLU  81   9.524 -14.313 -11.575
  651    HG2  GLU  81           HG2      GLU  81   8.661 -12.044 -11.523
  652    HG3  GLU  81           HG3      GLU  81   9.379 -11.719 -13.097
  653    H    LEU  82           H        LEU  82  12.795 -14.216 -13.203
  654    HA   LEU  82           HA       LEU  82  13.464 -16.514 -11.698
  655    HB2  LEU  82           HB2      LEU  82  13.674 -16.501 -14.109
  656    HB3  LEU  82           HB3      LEU  82  14.863 -15.210 -14.032
  657    HG   LEU  82           HG       LEU  82  16.333 -16.804 -12.730
  658   HD11  LEU  82          HD11      LEU  82  14.610 -18.373 -12.039
  659   HD12  LEU  82          HD12      LEU  82  15.870 -19.188 -12.968
  660   HD13  LEU  82          HD13      LEU  82  14.321 -18.812 -13.724
  661   HD21  LEU  82          HD21      LEU  82  17.110 -17.947 -14.727
  662   HD22  LEU  82          HD22      LEU  82  16.708 -16.266 -15.071
  663   HD23  LEU  82          HD23      LEU  82  15.600 -17.552 -15.551
  664    H    GLU  83           H        GLU  83  15.080 -13.410 -12.213
  665    HA   GLU  83           HA       GLU  83  17.429 -13.940 -10.805
  666    HB2  GLU  83           HB2      GLU  83  15.925 -11.338 -11.122
  667    HB3  GLU  83           HB3      GLU  83  17.550 -11.467 -10.460
  668    HG2  GLU  83           HG2      GLU  83  16.667 -12.175 -13.244
  669    HG3  GLU  83           HG3      GLU  83  17.701 -10.830 -12.756
  670    H    LEU  84           H        LEU  84  14.258 -12.906  -9.680
  671    HA   LEU  84           HA       LEU  84  14.938 -12.609  -6.955
  672    HB2  LEU  84           HB2      LEU  84  12.830 -11.762  -7.760
  673    HB3  LEU  84           HB3      LEU  84  12.331 -13.361  -8.278
  674    HG   LEU  84           HG       LEU  84  12.287 -14.091  -5.911
  675   HD11  LEU  84          HD11      LEU  84  13.933 -12.512  -5.033
  676   HD12  LEU  84          HD12      LEU  84  12.418 -12.446  -4.134
  677   HD13  LEU  84          HD13      LEU  84  12.803 -11.186  -5.306
  678   HD21  LEU  84          HD21      LEU  84  10.235 -13.340  -6.953
  679   HD22  LEU  84          HD22      LEU  84  10.615 -11.668  -6.545
  680   HD23  LEU  84          HD23      LEU  84  10.280 -12.831  -5.265
  681    H    GLN  85           H        GLN  85  13.630 -15.344  -8.793
  682    HA   GLN  85           HA       GLN  85  13.364 -17.172  -6.725
  683    HB2  GLN  85           HB2      GLN  85  12.689 -17.283  -9.247
  684    HB3  GLN  85           HB3      GLN  85  14.263 -18.031  -9.457
  685    HG2  GLN  85           HG2      GLN  85  12.184 -19.032  -7.552
  686    HG3  GLN  85           HG3      GLN  85  12.330 -19.602  -9.204
  687   HE21  GLN  85          HE21      GLN  85  15.237 -19.606  -9.202
  688   HE22  GLN  85          HE22      GLN  85  15.733 -20.910  -8.174
  689    H    ARG  86           H        ARG  86  16.123 -16.724  -8.934
  690    HA   ARG  86           HA       ARG  86  17.657 -18.812  -7.825
  691    HB2  ARG  86           HB2      ARG  86  18.590 -16.403  -9.386
  692    HB3  ARG  86           HB3      ARG  86  19.522 -17.871  -9.108
  693    HG2  ARG  86           HG2      ARG  86  17.606 -19.105 -10.241
  694    HG3  ARG  86           HG3      ARG  86  17.045 -17.517 -10.763
  695    HD2  ARG  86           HD2      ARG  86  19.778 -18.656 -11.330
  696    HD3  ARG  86           HD3      ARG  86  18.425 -18.684 -12.456
  697    HE   ARG  86           HE       ARG  86  18.621 -16.071 -11.995
  698   HH11  ARG  86          HH11      ARG  86  21.095 -18.448 -12.656
  699   HH12  ARG  86          HH12      ARG  86  22.162 -17.318 -13.422
  700   HH21  ARG  86          HH21      ARG  86  19.991 -14.576 -13.043
  701   HH22  ARG  86          HH22      ARG  86  21.536 -15.110 -13.648
  702    H    LEU  87           H        LEU  87  17.613 -15.328  -7.133
  703    HA   LEU  87           HA       LEU  87  19.786 -15.477  -5.274
  704    HB2  LEU  87           HB2      LEU  87  18.113 -13.424  -6.377
  705    HB3  LEU  87           HB3      LEU  87  18.178 -13.250  -4.632
  706    HG   LEU  87           HG       LEU  87  20.649 -13.219  -4.747
  707   HD11  LEU  87          HD11      LEU  87  20.190 -13.236  -7.724
  708   HD12  LEU  87          HD12      LEU  87  20.983 -14.494  -6.776
  709   HD13  LEU  87          HD13      LEU  87  21.728 -12.902  -6.929
  710   HD21  LEU  87          HD21      LEU  87  19.372 -11.142  -4.732
  711   HD22  LEU  87          HD22      LEU  87  19.290 -11.178  -6.492
  712   HD23  LEU  87          HD23      LEU  87  20.845 -10.986  -5.686
  713    H    PHE  88           H        PHE  88  16.328 -15.781  -5.087
  714    HA   PHE  88           HA       PHE  88  15.971 -15.738  -2.327
  715    HB2  PHE  88           HB2      PHE  88  14.011 -15.688  -3.568
  716    HB3  PHE  88           HB3      PHE  88  14.534 -16.981  -4.638
  717    HD1  PHE  88           HD1      PHE  88  13.537 -19.010  -4.428
  718    HD2  PHE  88           HD2      PHE  88  13.691 -16.439  -1.042
  719    HE1  PHE  88           HE1      PHE  88  12.204 -20.627  -3.145
  720    HE2  PHE  88           HE2      PHE  88  12.361 -18.048   0.246
  721    HZ   PHE  88           HZ       PHE  88  11.626 -20.153  -0.811
  722    H    GLU  89           H        GLU  89  17.052 -18.346  -4.449
  723    HA   GLU  89           HA       GLU  89  17.132 -20.275  -2.311
  724    HB2  GLU  89           HB2      GLU  89  18.333 -20.337  -5.079
  725    HB3  GLU  89           HB3      GLU  89  18.243 -21.709  -3.978
  726    HG2  GLU  89           HG2      GLU  89  15.791 -21.513  -3.996
  727    HG3  GLU  89           HG3      GLU  89  15.938 -20.207  -5.173
  728    H    GLU  90           H        GLU  90  19.323 -18.085  -3.874
  729    HA   GLU  90           HA       GLU  90  21.810 -18.904  -3.089
  730    HB2  GLU  90           HB2      GLU  90  20.500 -16.305  -3.610
  731    HB3  GLU  90           HB3      GLU  90  22.081 -16.244  -2.833
  732    HG2  GLU  90           HG2      GLU  90  21.539 -17.734  -5.385
  733    HG3  GLU  90           HG3      GLU  90  22.072 -16.055  -5.336
  734    H    PHE  91           H        PHE  91  19.619 -16.823  -1.196
  735    HA   PHE  91           HA       PHE  91  21.384 -17.220   1.130
  736    HB2  PHE  91           HB2      PHE  91  19.386 -15.006   0.616
  737    HB3  PHE  91           HB3      PHE  91  20.448 -15.132   2.013
  738    HD1  PHE  91           HD1      PHE  91  22.928 -14.992   1.667
  739    HD2  PHE  91           HD2      PHE  91  20.122 -14.039  -1.392
  740    HE1  PHE  91           HE1      PHE  91  24.671 -13.756   0.456
  741    HE2  PHE  91           HE2      PHE  91  21.867 -12.806  -2.608
  742    HZ   PHE  91           HZ       PHE  91  24.145 -12.663  -1.686
  743    H    ARG  92           H        ARG  92  19.050 -18.850   0.050
  744    HA   ARG  92           HA       ARG  92  16.875 -18.587   1.837
  745    HB2  ARG  92           HB2      ARG  92  16.618 -19.668  -0.304
  746    HB3  ARG  92           HB3      ARG  92  17.807 -20.888   0.123
  747    HG2  ARG  92           HG2      ARG  92  16.340 -21.917   1.655
  748    HG3  ARG  92           HG3      ARG  92  15.223 -20.547   1.614
  749    HD2  ARG  92           HD2      ARG  92  14.500 -21.059  -0.547
  750    HD3  ARG  92           HD3      ARG  92  15.871 -22.119  -0.855
  751    HE   ARG  92           HE       ARG  92  14.811 -23.826   0.297
  752   HH11  ARG  92          HH11      ARG  92  12.957 -20.871   0.624
  753   HH12  ARG  92          HH12      ARG  92  11.505 -21.689   1.092
  754   HH21  ARG  92          HH21      ARG  92  12.913 -24.896   0.890
  755   HH22  ARG  92          HH22      ARG  92  11.476 -23.987   1.240
  756    H    ASP  93           H        ASP  93  19.917 -20.226   2.040
  757    HA   ASP  93           HA       ASP  93  19.085 -21.809   4.331
  758    HB2  ASP  93           HB2      ASP  93  20.635 -22.675   2.527
  759    HB3  ASP  93           HB3      ASP  93  21.861 -21.585   3.164
  760    H    SER  94           H        SER  94  19.576 -18.707   4.115
  761    HA   SER  94           HA       SER  94  21.248 -18.467   6.524
  762    HB2  SER  94           HB2      SER  94  20.203 -16.256   4.731
  763    HB3  SER  94           HB3      SER  94  21.430 -16.113   5.991
  764    HG   SER  94           HG       SER  94  22.367 -17.956   4.465
  765    H    ASP  95           H        ASP  95  20.325 -16.514   7.974
  766    HA   ASP  95           HA       ASP  95  17.741 -17.445   8.820
  767    HB2  ASP  95           HB2      ASP  95  17.981 -16.095  10.746
  768    HB3  ASP  95           HB3      ASP  95  19.597 -16.688  10.390
  769    H    ASP  96           H        ASP  96  18.960 -14.775   6.971
  770    HA   ASP  96           HA       ASP  96  16.190 -13.984   6.438
  771    HB2  ASP  96           HB2      ASP  96  17.066 -12.303   7.976
  772    HB3  ASP  96           HB3      ASP  96  18.473 -12.070   6.948
  773    H    VAL  97           H        VAL  97  15.956 -14.664   4.419
  774    HA   VAL  97           HA       VAL  97  18.105 -14.637   2.525
  775    HB   VAL  97           HB       VAL  97  16.395 -16.401   2.480
  776   HG11  VAL  97          HG11      VAL  97  14.431 -15.194   3.131
  777   HG12  VAL  97          HG12      VAL  97  14.157 -15.910   1.541
  778   HG13  VAL  97          HG13      VAL  97  14.518 -14.191   1.684
  779   HG21  VAL  97          HG21      VAL  97  15.881 -16.343   0.051
  780   HG22  VAL  97          HG22      VAL  97  17.577 -16.046   0.442
  781   HG23  VAL  97          HG23      VAL  97  16.524 -14.699   0.004
  782    H    LEU  98           H        LEU  98  15.309 -12.598   3.171
  783    HA   LEU  98           HA       LEU  98  15.190 -11.475   0.574
  784    HB2  LEU  98           HB2      LEU  98  13.713 -11.264   3.045
  785    HB3  LEU  98           HB3      LEU  98  13.889  -9.702   2.265
  786    HG   LEU  98           HG       LEU  98  12.961 -10.671   0.187
  787   HD11  LEU  98          HD11      LEU  98  11.763 -12.829   0.352
  788   HD12  LEU  98          HD12      LEU  98  12.538 -13.097   1.914
  789   HD13  LEU  98          HD13      LEU  98  13.515 -12.981   0.451
  790   HD21  LEU  98          HD21      LEU  98  11.493  -9.466   1.653
  791   HD22  LEU  98          HD22      LEU  98  11.253 -10.898   2.651
  792   HD23  LEU  98          HD23      LEU  98  10.641 -10.862   0.999
  793    H    GLY  99           H        GLY  99  16.528 -10.235   3.639
  794    HA2  GLY  99           HA2      GLY  99  17.078  -7.644   2.663
  795    HA3  GLY  99           HA3      GLY  99  17.869  -8.413   4.036
  796    H    HIS 100           H        HIS 100  18.745 -10.659   2.300
  797    HA   HIS 100           HA       HIS 100  21.189  -9.372   1.429
  798    HB2  HIS 100           HB2      HIS 100  20.375 -12.268   1.660
  799    HB3  HIS 100           HB3      HIS 100  21.919 -11.759   0.984
  800    HD1  HIS 100           HD1      HIS 100  23.773 -11.351   2.606
  801    HD2  HIS 100           HD2      HIS 100  20.053 -11.486   4.458
  802    HE1  HIS 100           HE1      HIS 100  24.243 -11.274   5.075
  803    HE2  HIS 100           HE2      HIS 100  21.986 -11.476   6.174
  804    H    ILE 101           H        ILE 101  18.346 -10.873   0.083
  805    HA   ILE 101           HA       ILE 101  19.151 -10.981  -2.612
  806    HB   ILE 101           HB       ILE 101  16.406 -10.381  -1.484
  807   HG12  ILE 101          HG12      ILE 101  17.571 -12.983  -2.505
  808   HG13  ILE 101          HG13      ILE 101  17.303 -12.583  -0.810
  809   HG21  ILE 101          HG21      ILE 101  16.556  -9.619  -3.777
  810   HG22  ILE 101          HG22      ILE 101  15.560 -11.073  -3.695
  811   HG23  ILE 101          HG23      ILE 101  17.219 -11.173  -4.280
  812   HD11  ILE 101          HD11      ILE 101  15.196 -12.891  -2.936
  813   HD12  ILE 101          HD12      ILE 101  14.892 -12.392  -1.273
  814   HD13  ILE 101          HD13      ILE 101  15.530 -14.000  -1.605
  815    H    MET 102           H        MET 102  17.506  -8.450  -0.759
  816    HA   MET 102           HA       MET 102  17.111  -6.662  -2.872
  817    HB2  MET 102           HB2      MET 102  17.422  -5.989   0.059
  818    HB3  MET 102           HB3      MET 102  16.622  -5.005  -1.163
  819    HG2  MET 102           HG2      MET 102  14.805  -6.441  -1.311
  820    HG3  MET 102           HG3      MET 102  15.675  -7.781  -0.583
  821    HE1  MET 102           HE1      MET 102  13.754  -4.246   1.604
  822    HE2  MET 102           HE2      MET 102  13.340  -4.798  -0.021
  823    HE3  MET 102           HE3      MET 102  14.906  -4.040   0.280
  824    H    LYS 103           H        LYS 103  19.846  -7.021  -0.668
  825    HA   LYS 103           HA       LYS 103  21.082  -4.601  -1.660
  826    HB2  LYS 103           HB2      LYS 103  21.804  -6.617   0.429
  827    HB3  LYS 103           HB3      LYS 103  23.045  -5.545  -0.199
  828    HG2  LYS 103           HG2      LYS 103  22.141  -4.623   1.824
  829    HG3  LYS 103           HG3      LYS 103  21.669  -3.605   0.465
  830    HD2  LYS 103           HD2      LYS 103  19.456  -4.588   0.460
  831    HD3  LYS 103           HD3      LYS 103  19.921  -5.706   1.744
  832    HE2  LYS 103           HE2      LYS 103  20.315  -3.791   3.237
  833    HE3  LYS 103           HE3      LYS 103  19.793  -2.700   1.954
  834    HZ1  LYS 103           HZ1      LYS 103  18.014  -3.152   3.524
  835    HZ2  LYS 103           HZ2      LYS 103  18.120  -4.806   3.210
  836    HZ3  LYS 103           HZ3      LYS 103  17.621  -3.746   1.992
  837    H    ASN 104           H        ASN 104  21.026  -7.881  -2.583
  838    HA   ASN 104           HA       ASN 104  23.589  -7.566  -4.004
  839    HB2  ASN 104           HB2      ASN 104  22.169 -10.019  -2.995
  840    HB3  ASN 104           HB3      ASN 104  23.418 -10.124  -4.231
  841   HD21  ASN 104          HD21      ASN 104  24.798 -11.297  -2.940
  842   HD22  ASN 104          HD22      ASN 104  25.635 -10.599  -1.595
  843    H    ILE 105           H        ILE 105  20.547  -6.991  -4.706
  844    HA   ILE 105           HA       ILE 105  20.697  -8.295  -7.342
  845    HB   ILE 105           HB       ILE 105  18.739  -8.995  -6.066
  846   HG12  ILE 105          HG12      ILE 105  16.991  -8.445  -7.759
  847   HG13  ILE 105          HG13      ILE 105  18.106  -7.283  -8.466
  848   HG21  ILE 105          HG21      ILE 105  17.940  -6.094  -6.118
  849   HG22  ILE 105          HG22      ILE 105  18.374  -7.042  -4.695
  850   HG23  ILE 105          HG23      ILE 105  16.907  -7.425  -5.595
  851   HD11  ILE 105          HD11      ILE 105  19.676  -9.100  -8.944
  852   HD12  ILE 105          HD12      ILE 105  18.110  -9.350  -9.716
  853   HD13  ILE 105          HD13      ILE 105  18.530 -10.252  -8.261
  854    H    THR 106           H        THR 106  19.994  -7.110  -9.160
  855    HA   THR 106           HA       THR 106  21.199  -4.614  -9.367
  856    HB   THR 106           HB       THR 106  20.895  -6.259 -11.191
  857    HG1  THR 106           HG1      THR 106  20.390  -4.601 -12.803
  858   HG21  THR 106          HG21      THR 106  18.560  -6.859 -10.828
  859   HG22  THR 106          HG22      THR 106  18.802  -6.275 -12.475
  860   HG23  THR 106          HG23      THR 106  18.060  -5.227 -11.268
  861    H    ALA 107           H        ALA 107  17.839  -5.469  -8.751
  862    HA   ALA 107           HA       ALA 107  17.165  -2.601  -8.760
  863    HB1  ALA 107           HB1      ALA 107  14.834  -3.288  -9.005
  864    HB2  ALA 107           HB2      ALA 107  15.330  -4.980  -8.996
  865    HB3  ALA 107           HB3      ALA 107  15.826  -3.923 -10.318
  866    H    LYS 108           H        LYS 108  16.765  -1.681  -6.837
  867    HA   LYS 108           HA       LYS 108  16.708  -3.366  -4.488
  868    HB2  LYS 108           HB2      LYS 108  17.036  -0.462  -5.018
  869    HB3  LYS 108           HB3      LYS 108  16.347  -0.913  -3.465
  870    HG2  LYS 108           HG2      LYS 108  18.817  -0.602  -3.454
  871    HG3  LYS 108           HG3      LYS 108  18.275  -2.179  -2.882
  872    HD2  LYS 108           HD2      LYS 108  18.736  -3.089  -5.157
  873    HD3  LYS 108           HD3      LYS 108  19.425  -1.524  -5.593
  874    HE2  LYS 108           HE2      LYS 108  20.383  -3.146  -3.250
  875    HE3  LYS 108           HE3      LYS 108  21.065  -3.313  -4.870
  876    HZ1  LYS 108           HZ1      LYS 108  22.361  -1.797  -3.514
  877    HZ2  LYS 108           HZ2      LYS 108  21.010  -0.813  -3.266
  878    HZ3  LYS 108           HZ3      LYS 108  21.664  -0.973  -4.817
  879    H    ARG 109           H        ARG 109  14.877  -4.382  -4.186
  880    HA   ARG 109           HA       ARG 109  12.341  -3.032  -4.737
  881    HB2  ARG 109           HB2      ARG 109  12.781  -5.931  -4.013
  882    HB3  ARG 109           HB3      ARG 109  11.337  -5.213  -4.716
  883    HG2  ARG 109           HG2      ARG 109  12.464  -4.828  -6.793
  884    HG3  ARG 109           HG3      ARG 109  14.008  -5.337  -6.102
  885    HD2  ARG 109           HD2      ARG 109  12.877  -7.567  -5.633
  886    HD3  ARG 109           HD3      ARG 109  11.582  -7.011  -6.689
  887    HE   ARG 109           HE       ARG 109  13.357  -6.776  -8.436
  888   HH11  ARG 109          HH11      ARG 109  13.724  -9.041  -5.792
  889   HH12  ARG 109          HH12      ARG 109  14.769 -10.102  -6.669
  890   HH21  ARG 109          HH21      ARG 109  14.742  -8.174  -9.607
  891   HH22  ARG 109          HH22      ARG 109  15.344  -9.613  -8.854
  892    H    SER 110           H        SER 110  10.546  -3.820  -3.147
  893    HA   SER 110           HA       SER 110  11.515  -3.284  -0.440
  894    HB2  SER 110           HB2      SER 110   9.809  -1.725  -1.265
  895    HB3  SER 110           HB3      SER 110   8.715  -3.069  -1.583
  896    HG   SER 110           HG       SER 110   9.652  -2.134   0.933
  897    H    ARG 111           H        ARG 111  10.595  -4.452   1.330
  898    HA   ARG 111           HA       ARG 111  10.838  -7.217   1.052
  899    HB2  ARG 111           HB2      ARG 111   9.676  -5.505   3.239
  900    HB3  ARG 111           HB3      ARG 111   9.814  -7.252   3.381
  901    HG2  ARG 111           HG2      ARG 111  12.148  -5.432   2.837
  902    HG3  ARG 111           HG3      ARG 111  11.662  -5.955   4.450
  903    HD2  ARG 111           HD2      ARG 111  11.919  -8.301   3.720
  904    HD3  ARG 111           HD3      ARG 111  12.495  -7.722   2.160
  905    HE   ARG 111           HE       ARG 111  14.486  -7.028   3.155
  906   HH11  ARG 111          HH11      ARG 111  12.275  -8.372   5.516
  907   HH12  ARG 111          HH12      ARG 111  13.518  -8.722   6.673
  908   HH21  ARG 111          HH21      ARG 111  16.122  -7.458   4.707
  909   HH22  ARG 111          HH22      ARG 111  15.706  -8.218   6.206
  910    H    ALA 112           H        ALA 112   7.886  -5.271   1.531
  911    HA   ALA 112           HA       ALA 112   6.140  -7.479   1.648
  912    HB1  ALA 112           HB1      ALA 112   4.350  -5.899   1.513
  913    HB2  ALA 112           HB2      ALA 112   5.421  -4.671   0.844
  914    HB3  ALA 112           HB3      ALA 112   5.630  -5.209   2.509
  915    H    ARG 113           H        ARG 113   7.622  -5.918  -1.031
  916    HA   ARG 113           HA       ARG 113   5.669  -6.876  -2.951
  917    HB2  ARG 113           HB2      ARG 113   8.430  -5.737  -3.389
  918    HB3  ARG 113           HB3      ARG 113   7.253  -6.083  -4.646
  919    HG2  ARG 113           HG2      ARG 113   5.756  -4.414  -3.702
  920    HG3  ARG 113           HG3      ARG 113   6.946  -4.064  -2.444
  921    HD2  ARG 113           HD2      ARG 113   8.580  -3.580  -4.286
  922    HD3  ARG 113           HD3      ARG 113   7.220  -3.666  -5.407
  923    HE   ARG 113           HE       ARG 113   6.325  -1.903  -3.582
  924   HH11  ARG 113          HH11      ARG 113   9.294  -2.052  -5.428
  925   HH12  ARG 113          HH12      ARG 113   9.503  -0.336  -5.471
  926   HH21  ARG 113          HH21      ARG 113   6.573   0.356  -3.677
  927   HH22  ARG 113          HH22      ARG 113   7.962   1.033  -4.470
  928    H    ILE 114           H        ILE 114   8.785  -7.778  -1.668
  929    HA   ILE 114           HA       ILE 114   9.339  -9.722  -3.650
  930    HB   ILE 114           HB       ILE 114  10.517  -9.282  -0.907
  931   HG12  ILE 114          HG12      ILE 114  11.600  -8.773  -3.687
  932   HG13  ILE 114          HG13      ILE 114  10.957  -7.545  -2.604
  933   HG21  ILE 114          HG21      ILE 114  12.323 -10.821  -1.645
  934   HG22  ILE 114          HG22      ILE 114  11.322 -11.264  -3.026
  935   HG23  ILE 114          HG23      ILE 114  10.767 -11.615  -1.387
  936   HD11  ILE 114          HD11      ILE 114  12.758  -7.976  -1.024
  937   HD12  ILE 114          HD12      ILE 114  13.394  -7.566  -2.618
  938   HD13  ILE 114          HD13      ILE 114  13.386  -9.244  -2.080
  939    H    VAL 115           H        VAL 115   8.182  -9.910  -0.283
  940    HA   VAL 115           HA       VAL 115   7.892 -12.715  -0.248
  941    HB   VAL 115           HB       VAL 115   6.434 -12.412   1.707
  942   HG11  VAL 115          HG11      VAL 115   8.073 -11.455   3.177
  943   HG12  VAL 115          HG12      VAL 115   8.846 -10.626   1.825
  944   HG13  VAL 115          HG13      VAL 115   8.887 -12.387   1.922
  945   HG21  VAL 115          HG21      VAL 115   5.272 -10.364   1.001
  946   HG22  VAL 115          HG22      VAL 115   6.765  -9.454   1.240
  947   HG23  VAL 115          HG23      VAL 115   5.964 -10.214   2.616
  948    H    ASP 116           H        ASP 116   5.681 -10.112  -1.127
  949    HA   ASP 116           HA       ASP 116   3.358 -11.610  -1.485
  950    HB2  ASP 116           HB2      ASP 116   3.343  -9.194  -1.506
  951    HB3  ASP 116           HB3      ASP 116   4.364  -9.156  -2.940
  952    H    LYS 117           H        LYS 117   6.017 -10.924  -3.709
  953    HA   LYS 117           HA       LYS 117   4.897 -12.279  -5.921
  954    HB2  LYS 117           HB2      LYS 117   6.753 -10.581  -6.017
  955    HB3  LYS 117           HB3      LYS 117   7.832 -11.816  -5.383
  956    HG2  LYS 117           HG2      LYS 117   8.115 -11.740  -7.739
  957    HG3  LYS 117           HG3      LYS 117   7.257 -13.234  -7.352
  958    HD2  LYS 117           HD2      LYS 117   5.124 -12.102  -7.921
  959    HD3  LYS 117           HD3      LYS 117   6.045 -10.668  -8.395
  960    HE2  LYS 117           HE2      LYS 117   7.217 -12.003 -10.080
  961    HE3  LYS 117           HE3      LYS 117   6.271 -13.415  -9.621
  962    HZ1  LYS 117           HZ1      LYS 117   5.087 -10.896 -10.655
  963    HZ2  LYS 117           HZ2      LYS 117   4.288 -12.362 -10.389
  964    HZ3  LYS 117           HZ3      LYS 117   5.448 -12.239 -11.620
  965    H    LEU 118           H        LEU 118   7.111 -13.291  -3.341
  966    HA   LEU 118           HA       LEU 118   7.771 -15.834  -4.288
  967    HB2  LEU 118           HB2      LEU 118   7.852 -14.445  -1.738
  968    HB3  LEU 118           HB3      LEU 118   7.512 -16.156  -1.547
  969    HG   LEU 118           HG       LEU 118   9.560 -16.629  -2.919
  970   HD11  LEU 118          HD11      LEU 118  10.068 -13.695  -2.479
  971   HD12  LEU 118          HD12      LEU 118   9.744 -14.468  -4.029
  972   HD13  LEU 118          HD13      LEU 118  11.216 -14.860  -3.140
  973   HD21  LEU 118          HD21      LEU 118  11.098 -16.162  -1.061
  974   HD22  LEU 118          HD22      LEU 118   9.565 -16.850  -0.522
  975   HD23  LEU 118          HD23      LEU 118   9.871 -15.121  -0.338
  976    H    LEU 119           H        LEU 119   5.059 -14.832  -2.242
  977    HA   LEU 119           HA       LEU 119   3.972 -17.436  -1.923
  978    HB2  LEU 119           HB2      LEU 119   2.966 -14.652  -1.483
  979    HB3  LEU 119           HB3      LEU 119   1.846 -15.997  -1.399
  980    HG   LEU 119           HG       LEU 119   2.640 -15.335   0.833
  981   HD11  LEU 119          HD11      LEU 119   3.610 -18.052  -0.035
  982   HD12  LEU 119          HD12      LEU 119   1.964 -17.635   0.438
  983   HD13  LEU 119          HD13      LEU 119   3.268 -17.554   1.621
  984   HD21  LEU 119          HD21      LEU 119   5.366 -16.168  -0.164
  985   HD22  LEU 119          HD22      LEU 119   4.957 -15.811   1.515
  986   HD23  LEU 119          HD23      LEU 119   4.869 -14.539   0.293
  987    H    ALA 120           H        ALA 120   3.741 -15.028  -4.361
  988    HA   ALA 120           HA       ALA 120   1.376 -16.120  -5.593
  989    HB1  ALA 120           HB1      ALA 120   3.322 -14.110  -6.707
  990    HB2  ALA 120           HB2      ALA 120   1.981 -13.708  -5.633
  991    HB3  ALA 120           HB3      ALA 120   1.659 -14.395  -7.230
  992    H    LEU 121           H        LEU 121   4.862 -16.167  -6.143
  993    HA   LEU 121           HA       LEU 121   4.796 -17.775  -8.490
  994    HB2  LEU 121           HB2      LEU 121   6.950 -17.402  -6.413
  995    HB3  LEU 121           HB3      LEU 121   7.172 -18.257  -7.926
  996    HG   LEU 121           HG       LEU 121   6.455 -15.336  -7.703
  997   HD11  LEU 121          HD11      LEU 121   8.775 -14.926  -8.333
  998   HD12  LEU 121          HD12      LEU 121   9.100 -16.659  -8.281
  999   HD13  LEU 121          HD13      LEU 121   8.674 -15.797  -6.802
 1000   HD21  LEU 121          HD21      LEU 121   5.697 -16.314  -9.783
 1001   HD22  LEU 121          HD22      LEU 121   7.278 -17.047 -10.047
 1002   HD23  LEU 121          HD23      LEU 121   7.102 -15.295 -10.083
 1003    H    GLY 122           H        GLY 122   4.433 -18.411  -5.136
 1004    HA2  GLY 122           HA2      GLY 122   3.914 -20.369  -4.043
 1005    HA3  GLY 122           HA3      GLY 122   4.008 -21.219  -5.585
 1006    H    LEU 123           H        LEU 123   6.519 -19.186  -4.237
 1007    HA   LEU 123           HA       LEU 123   8.431 -21.339  -4.372
 1008    HB2  LEU 123           HB2      LEU 123   8.632 -18.484  -3.411
 1009    HB3  LEU 123           HB3      LEU 123   9.989 -19.598  -3.433
 1010    HG   LEU 123           HG       LEU 123   8.451 -18.614  -5.839
 1011   HD11  LEU 123          HD11      LEU 123   9.906 -16.919  -4.887
 1012   HD12  LEU 123          HD12      LEU 123  10.550 -17.503  -6.421
 1013   HD13  LEU 123          HD13      LEU 123  11.259 -18.050  -4.900
 1014   HD21  LEU 123          HD21      LEU 123  10.182 -19.790  -7.143
 1015   HD22  LEU 123          HD22      LEU 123   9.172 -20.888  -6.204
 1016   HD23  LEU 123          HD23      LEU 123  10.800 -20.495  -5.649
 1017    H    VAL 124           H        VAL 124   6.389 -19.872  -2.086
 1018    HA   VAL 124           HA       VAL 124   7.220 -21.744  -0.010
 1019    HB   VAL 124           HB       VAL 124   7.062 -19.934   1.713
 1020   HG11  VAL 124          HG11      VAL 124   9.323 -19.055   1.326
 1021   HG12  VAL 124          HG12      VAL 124   9.260 -19.646  -0.333
 1022   HG13  VAL 124          HG13      VAL 124   9.226 -20.787   1.012
 1023   HG21  VAL 124          HG21      VAL 124   5.834 -18.318   0.312
 1024   HG22  VAL 124          HG22      VAL 124   7.282 -18.093  -0.670
 1025   HG23  VAL 124          HG23      VAL 124   7.284 -17.620   1.029
 1026    H    ALA 125           H        ALA 125   5.602 -21.434   1.908
 1027    HA   ALA 125           HA       ALA 125   2.905 -21.033   0.768
 1028    HB1  ALA 125           HB1      ALA 125   3.290 -23.351   1.347
 1029    HB2  ALA 125           HB2      ALA 125   2.122 -22.644   2.465
 1030    HB3  ALA 125           HB3      ALA 125   3.793 -22.890   2.972
 1031    H    GLU 126           H        GLU 126   5.191 -20.072   3.097
 1032    HA   GLU 126           HA       GLU 126   3.312 -18.136   4.190
 1033    HB2  GLU 126           HB2      GLU 126   3.965 -18.643   6.504
 1034    HB3  GLU 126           HB3      GLU 126   3.177 -20.021   5.743
 1035    HG2  GLU 126           HG2      GLU 126   5.413 -20.978   5.288
 1036    HG3  GLU 126           HG3      GLU 126   6.127 -19.648   6.193
 1037    H    ARG 127           H        ARG 127   4.562 -16.559   5.662
 1038    HA   ARG 127           HA       ARG 127   6.884 -15.700   4.204
 1039    HB2  ARG 127           HB2      ARG 127   5.265 -14.546   6.428
 1040    HB3  ARG 127           HB3      ARG 127   6.875 -13.906   6.131
 1041    HG2  ARG 127           HG2      ARG 127   5.472 -12.517   4.903
 1042    HG3  ARG 127           HG3      ARG 127   6.135 -13.627   3.709
 1043    HD2  ARG 127           HD2      ARG 127   3.894 -13.586   3.151
 1044    HD3  ARG 127           HD3      ARG 127   3.990 -15.012   4.182
 1045    HE   ARG 127           HE       ARG 127   3.383 -12.934   5.881
 1046   HH11  ARG 127          HH11      ARG 127   1.918 -14.389   3.055
 1047   HH12  ARG 127          HH12      ARG 127   0.308 -13.918   3.484
 1048   HH21  ARG 127          HH21      ARG 127   1.251 -12.300   6.451
 1049   HH22  ARG 127          HH22      ARG 127  -0.074 -12.738   5.415
 1050    H    ARG 128           H        ARG 128   6.385 -17.605   6.996
 1051    HA   ARG 128           HA       ARG 128   8.670 -17.014   8.506
 1052    HB2  ARG 128           HB2      ARG 128   6.862 -18.339   9.417
 1053    HB3  ARG 128           HB3      ARG 128   7.133 -19.597   8.219
 1054    HG2  ARG 128           HG2      ARG 128   9.440 -19.880   9.233
 1055    HG3  ARG 128           HG3      ARG 128   8.867 -18.858  10.557
 1056    HD2  ARG 128           HD2      ARG 128   7.868 -21.563   9.710
 1057    HD3  ARG 128           HD3      ARG 128   8.521 -21.074  11.273
 1058    HE   ARG 128           HE       ARG 128   5.884 -20.268  10.214
 1059   HH11  ARG 128          HH11      ARG 128   8.014 -20.991  12.917
 1060   HH12  ARG 128          HH12      ARG 128   6.782 -20.752  14.110
 1061   HH21  ARG 128          HH21      ARG 128   4.273 -19.942  11.792
 1062   HH22  ARG 128          HH22      ARG 128   4.654 -20.143  13.473
 1063    H    GLU 129           H        GLU 129   8.194 -19.251   5.840
 1064    HA   GLU 129           HA       GLU 129  10.428 -20.877   6.246
 1065    HB2  GLU 129           HB2      GLU 129   9.005 -20.245   3.668
 1066    HB3  GLU 129           HB3      GLU 129  10.021 -21.645   3.969
 1067    HG2  GLU 129           HG2      GLU 129   8.487 -22.434   5.657
 1068    HG3  GLU 129           HG3      GLU 129   7.508 -20.980   5.453
 1069    H    LEU 130           H        LEU 130  10.180 -17.785   4.699
 1070    HA   LEU 130           HA       LEU 130  12.603 -18.198   3.193
 1071    HB2  LEU 130           HB2      LEU 130  12.075 -15.571   2.835
 1072    HB3  LEU 130           HB3      LEU 130  11.416 -16.859   1.848
 1073    HG   LEU 130           HG       LEU 130   9.909 -15.931   4.271
 1074   HD11  LEU 130          HD11      LEU 130   8.734 -14.315   2.844
 1075   HD12  LEU 130          HD12      LEU 130   9.889 -14.633   1.551
 1076   HD13  LEU 130          HD13      LEU 130  10.432 -13.897   3.057
 1077   HD21  LEU 130          HD21      LEU 130   9.170 -17.955   3.100
 1078   HD22  LEU 130          HD22      LEU 130   9.088 -17.047   1.588
 1079   HD23  LEU 130          HD23      LEU 130   7.996 -16.649   2.913
 1080    H    TYR 131           H        TYR 131  11.577 -16.374   6.054
 1081    HA   TYR 131           HA       TYR 131  14.353 -16.039   6.771
 1082    HB2  TYR 131           HB2      TYR 131  14.350 -13.582   6.809
 1083    HB3  TYR 131           HB3      TYR 131  14.186 -14.221   5.183
 1084    HD1  TYR 131           HD1      TYR 131  11.028 -14.666   6.551
 1085    HD2  TYR 131           HD2      TYR 131  13.618 -11.557   5.249
 1086    HE1  TYR 131           HE1      TYR 131   9.089 -13.203   6.211
 1087    HE2  TYR 131           HE2      TYR 131  11.684 -10.088   4.906
 1088    HH   TYR 131           HH       TYR 131   8.567 -10.845   6.080
 1089    H    LYS 132           H        LYS 132  12.023 -17.154   8.049
 1090    HA   LYS 132           HA       LYS 132  12.605 -15.771  10.556
 1091    HB2  LYS 132           HB2      LYS 132  10.254 -15.266   9.893
 1092    HB3  LYS 132           HB3      LYS 132   9.914 -16.989   9.921
 1093    HG2  LYS 132           HG2      LYS 132   9.175 -15.792  11.954
 1094    HG3  LYS 132           HG3      LYS 132  10.309 -17.102  12.274
 1095    HD2  LYS 132           HD2      LYS 132  10.810 -15.107  13.613
 1096    HD3  LYS 132           HD3      LYS 132  12.125 -15.505  12.510
 1097    HE2  LYS 132           HE2      LYS 132  11.365 -13.775  10.967
 1098    HE3  LYS 132           HE3      LYS 132  10.014 -13.399  12.035
 1099    HZ1  LYS 132           HZ1      LYS 132  11.583 -12.715  13.731
 1100    HZ2  LYS 132           HZ2      LYS 132  11.855 -11.847  12.305
 1101    HZ3  LYS 132           HZ3      LYS 132  12.887 -13.116  12.731
 1102    H    LYS 133           H        LYS 133  14.327 -17.411  10.432
 1103    HA   LYS 133           HA       LYS 133  13.545 -20.156  10.529
 1104    HB2  LYS 133           HB2      LYS 133  16.167 -18.743  10.779
 1105    HB3  LYS 133           HB3      LYS 133  16.032 -20.428  11.275
 1106    HG2  LYS 133           HG2      LYS 133  16.830 -20.318   9.010
 1107    HG3  LYS 133           HG3      LYS 133  15.206 -20.997   9.023
 1108    HD2  LYS 133           HD2      LYS 133  14.382 -18.650   8.501
 1109    HD3  LYS 133           HD3      LYS 133  16.067 -18.240   8.183
 1110    HE2  LYS 133           HE2      LYS 133  14.370 -20.280   6.755
 1111    HE3  LYS 133           HE3      LYS 133  15.042 -18.790   6.096
 1112    HZ1  LYS 133           HZ1      LYS 133  16.335 -20.672   5.380
 1113    HZ2  LYS 133           HZ2      LYS 133  16.580 -21.174   6.975
 1114    HZ3  LYS 133           HZ3      LYS 133  17.269 -19.722   6.429
 1115    H    ARG 134           H        ARG 134  12.030 -19.876  12.204
 1116    HA   ARG 134           HA       ARG 134  13.289 -20.542  14.765
 1117    HB2  ARG 134           HB2      ARG 134  10.733 -18.976  14.330
 1118    HB3  ARG 134           HB3      ARG 134  11.266 -19.596  15.888
 1119    HG2  ARG 134           HG2      ARG 134  13.016 -17.800  14.273
 1120    HG3  ARG 134           HG3      ARG 134  11.739 -17.142  15.300
 1121    HD2  ARG 134           HD2      ARG 134  13.922 -18.992  16.250
 1122    HD3  ARG 134           HD3      ARG 134  13.976 -17.235  16.389
 1123    HE   ARG 134           HE       ARG 134  11.769 -18.749  17.611
 1124   HH11  ARG 134          HH11      ARG 134  14.563 -16.671  17.949
 1125   HH12  ARG 134          HH12      ARG 134  14.196 -16.235  19.588
 1126   HH21  ARG 134          HH21      ARG 134  11.282 -18.177  19.758
 1127   HH22  ARG 134          HH22      ARG 134  12.325 -17.083  20.614
 1128    H    GLN 135           H        GLN 135  13.238 -22.608  13.863
 1129    HA   GLN 135           HA       GLN 135  10.569 -23.855  13.801
 1130    HB2  GLN 135           HB2      GLN 135  13.092 -24.626  12.317
 1131    HB3  GLN 135           HB3      GLN 135  11.648 -25.628  12.382
 1132    HG2  GLN 135           HG2      GLN 135  11.678 -22.826  11.284
 1133    HG3  GLN 135           HG3      GLN 135  11.939 -24.266  10.299
 1134   HE21  GLN 135          HE21      GLN 135  10.123 -23.969   9.053
 1135   HE22  GLN 135          HE22      GLN 135   8.514 -24.167   9.673
 1136    H    LYS 136           H        LYS 136  10.350 -24.668  15.833
 1137    HA   LYS 136           HA       LYS 136  12.589 -26.167  16.948
 1138    HB2  LYS 136           HB2      LYS 136   9.882 -25.463  18.102
 1139    HB3  LYS 136           HB3      LYS 136  11.121 -26.377  18.960
 1140    HG2  LYS 136           HG2      LYS 136  12.662 -24.476  18.725
 1141    HG3  LYS 136           HG3      LYS 136  11.390 -23.562  17.920
 1142    HD2  LYS 136           HD2      LYS 136  10.029 -23.663  19.934
 1143    HD3  LYS 136           HD3      LYS 136  11.277 -24.616  20.742
 1144    HE2  LYS 136           HE2      LYS 136  12.860 -22.752  20.426
 1145    HE3  LYS 136           HE3      LYS 136  11.571 -21.801  19.692
 1146    HZ1  LYS 136           HZ1      LYS 136  10.353 -21.939  21.786
 1147    HZ2  LYS 136           HZ2      LYS 136  11.864 -21.215  22.000
 1148    HZ3  LYS 136           HZ3      LYS 136  11.619 -22.816  22.483
 1149    H    LYS 137           H        LYS 137  11.839 -27.114  14.699
 1150    HA   LYS 137           HA       LYS 137  11.100 -29.823  15.337
 1151    HB2  LYS 137           HB2      LYS 137   8.969 -28.584  14.611
 1152    HB3  LYS 137           HB3      LYS 137   9.727 -28.400  13.038
 1153    HG2  LYS 137           HG2      LYS 137   9.368 -31.103  14.278
 1154    HG3  LYS 137           HG3      LYS 137   8.070 -30.318  13.384
 1155    HD2  LYS 137           HD2      LYS 137   9.348 -30.282  11.389
 1156    HD3  LYS 137           HD3      LYS 137  10.822 -30.736  12.245
 1157    HE2  LYS 137           HE2      LYS 137   9.867 -32.914  12.758
 1158    HE3  LYS 137           HE3      LYS 137   8.373 -32.465  11.939
 1159    HZ1  LYS 137           HZ1      LYS 137   9.831 -33.834  10.554
 1160    HZ2  LYS 137           HZ2      LYS 137  11.038 -32.656  10.639
 1161    HZ3  LYS 137           HZ3      LYS 137   9.573 -32.311   9.871
 1162    H    LEU 138           H        LEU 138  12.289 -31.227  13.970
 1163    HA   LEU 138           HA       LEU 138  14.440 -30.026  12.535
 1164    HB2  LEU 138           HB2      LEU 138  13.527 -32.872  12.848
 1165    HB3  LEU 138           HB3      LEU 138  14.853 -32.448  11.785
 1166    HG   LEU 138           HG       LEU 138  15.987 -31.405  13.801
 1167   HD11  LEU 138          HD11      LEU 138  13.879 -32.953  15.292
 1168   HD12  LEU 138          HD12      LEU 138  14.032 -31.196  15.237
 1169   HD13  LEU 138          HD13      LEU 138  15.291 -32.168  16.001
 1170   HD21  LEU 138          HD21      LEU 138  16.766 -33.569  14.658
 1171   HD22  LEU 138          HD22      LEU 138  16.698 -33.530  12.897
 1172   HD23  LEU 138          HD23      LEU 138  15.442 -34.368  13.809
 1173    H    ALA 139           H        ALA 139  13.633 -28.778  10.914
 1174    HA   ALA 139           HA       ALA 139  12.263 -30.190   8.716
 1175    HB1  ALA 139           HB1      ALA 139  10.970 -28.201   8.260
 1176    HB2  ALA 139           HB2      ALA 139  11.803 -27.321   9.541
 1177    HB3  ALA 139           HB3      ALA 139  10.736 -28.670   9.945
 1178    H    SER 140           H        SER 140  12.353 -28.574   6.685
 1179    HA   SER 140           HA       SER 140  15.124 -27.602   6.491
 1180    HB2  SER 140           HB2      SER 140  14.559 -29.468   4.922
 1181    HB3  SER 140           HB3      SER 140  13.305 -28.452   4.219
 1182    HG   SER 140           HG       SER 140  15.103 -26.911   3.826
 1183    H    SER 141           H        SER 141  14.517 -25.611   7.440
 1184    HA   SER 141           HA       SER 141  13.090 -23.842   5.580
 1185    HB2  SER 141           HB2      SER 141  13.083 -23.736   8.614
 1186    HB3  SER 141           HB3      SER 141  12.335 -22.531   7.561
 1187    HG   SER 141           HG       SER 141  11.446 -24.899   6.799
  Start of MODEL   18
    1    H1   ASP   1           HT1      ASP   1 -29.836  11.684 -10.266
    2    H2   ASP   1           HT2      ASP   1 -29.603  10.606  -8.989
    3    H3   ASP   1           HT3      ASP   1 -28.272  11.314  -9.751
    4    HA   ASP   1           HA       ASP   1 -28.895  13.472  -8.987
    5    HB2  ASP   1           HB2      ASP   1 -31.258  11.996  -7.872
    6    HB3  ASP   1           HB3      ASP   1 -30.726  13.516  -7.164
    7    HA   PRO   2           HA       PRO   2 -27.892  12.050  -4.593
    8    HB2  PRO   2           HB2      PRO   2 -28.313   9.553  -3.723
    9    HB3  PRO   2           HB3      PRO   2 -29.607  10.756  -3.767
   10    HG2  PRO   2           HG2      PRO   2 -29.006   8.548  -5.705
   11    HG3  PRO   2           HG3      PRO   2 -30.569   9.052  -5.034
   12    HD2  PRO   2           HD2      PRO   2 -29.691   9.798  -7.499
   13    HD3  PRO   2           HD3      PRO   2 -30.786  10.784  -6.516
   14    H    SER   3           H        SER   3 -26.962  10.328  -7.316
   15    HA   SER   3           HA       SER   3 -24.646   9.051  -6.147
   16    HB2  SER   3           HB2      SER   3 -24.141   8.715  -8.687
   17    HB3  SER   3           HB3      SER   3 -25.461   7.816  -7.942
   18    HG   SER   3           HG       SER   3 -26.474   8.653  -9.621
   19    H    ARG   4           H        ARG   4 -25.086  11.904  -5.948
   20    HA   ARG   4           HA       ARG   4 -22.900  13.174  -7.377
   21    HB2  ARG   4           HB2      ARG   4 -23.634  15.186  -6.141
   22    HB3  ARG   4           HB3      ARG   4 -24.979  14.425  -6.982
   23    HG2  ARG   4           HG2      ARG   4 -25.541  13.280  -4.805
   24    HG3  ARG   4           HG3      ARG   4 -24.359  14.345  -4.045
   25    HD2  ARG   4           HD2      ARG   4 -26.833  15.180  -5.548
   26    HD3  ARG   4           HD3      ARG   4 -26.584  15.267  -3.805
   27    HE   ARG   4           HE       ARG   4 -24.545  16.739  -4.882
   28   HH11  ARG   4          HH11      ARG   4 -28.037  16.821  -5.078
   29   HH12  ARG   4          HH12      ARG   4 -28.108  18.536  -5.319
   30   HH21  ARG   4          HH21      ARG   4 -24.627  18.981  -5.218
   31   HH22  ARG   4          HH22      ARG   4 -26.159  19.773  -5.399
   32    H    ARG   5           H        ARG   5 -21.846  14.828  -5.330
   33    HA   ARG   5           HA       ARG   5 -20.094  13.302  -3.834
   34    HB2  ARG   5           HB2      ARG   5 -20.292  15.898  -4.027
   35    HB3  ARG   5           HB3      ARG   5 -21.358  15.765  -2.638
   36    HG2  ARG   5           HG2      ARG   5 -18.545  14.695  -2.678
   37    HG3  ARG   5           HG3      ARG   5 -18.965  16.312  -2.120
   38    HD2  ARG   5           HD2      ARG   5 -20.199  13.819  -0.968
   39    HD3  ARG   5           HD3      ARG   5 -18.712  14.521  -0.339
   40    HE   ARG   5           HE       ARG   5 -20.704  16.504  -0.468
   41   HH11  ARG   5          HH11      ARG   5 -19.896  13.626   1.359
   42   HH12  ARG   5          HH12      ARG   5 -20.644  14.188   2.819
   43   HH21  ARG   5          HH21      ARG   5 -21.691  17.239   1.447
   44   HH22  ARG   5          HH22      ARG   5 -21.681  16.237   2.862
   45    H    ALA   6           H        ALA   6 -20.553  11.682  -2.524
   46    HA   ALA   6           HA       ALA   6 -23.316  11.197  -1.938
   47    HB1  ALA   6           HB1      ALA   6 -22.545   8.967  -1.350
   48    HB2  ALA   6           HB2      ALA   6 -20.869   9.512  -1.445
   49    HB3  ALA   6           HB3      ALA   6 -21.874   9.489  -2.894
   50    HA   PRO   7           HA       PRO   7 -23.944  12.216   2.278
   51    HB2  PRO   7           HB2      PRO   7 -24.565   9.563   3.123
   52    HB3  PRO   7           HB3      PRO   7 -25.690  10.857   2.722
   53    HG2  PRO   7           HG2      PRO   7 -24.738   8.598   1.061
   54    HG3  PRO   7           HG3      PRO   7 -26.273   9.482   0.987
   55    HD2  PRO   7           HD2      PRO   7 -24.389   9.824  -0.873
   56    HD3  PRO   7           HD3      PRO   7 -25.365  11.194  -0.297
   57    H    THR   8           H        THR   8 -22.637  12.455   3.950
   58    HA   THR   8           HA       THR   8 -20.144  11.151   4.139
   59    HB   THR   8           HB       THR   8 -21.580  12.675   6.325
   60    HG1  THR   8           HG1      THR   8 -20.616  14.523   5.420
   61   HG21  THR   8          HG21      THR   8 -18.641  12.254   5.768
   62   HG22  THR   8          HG22      THR   8 -19.568  11.458   7.039
   63   HG23  THR   8          HG23      THR   8 -19.320  13.203   7.090
   64    H    TRP   9           H        TRP   9 -19.528   9.361   5.242
   65    HA   TRP   9           HA       TRP   9 -21.529   7.497   5.977
   66    HB2  TRP   9           HB2      TRP   9 -18.529   7.446   6.267
   67    HB3  TRP   9           HB3      TRP   9 -19.563   6.103   6.730
   68    HD1  TRP   9           HD1      TRP   9 -18.573   8.108   3.590
   69    HE1  TRP   9           HE1      TRP   9 -18.817   6.561   1.554
   70    HE3  TRP   9           HE3      TRP   9 -20.600   4.018   5.897
   71    HZ2  TRP   9           HZ2      TRP   9 -19.737   3.964   0.991
   72    HZ3  TRP   9           HZ3      TRP   9 -21.139   2.042   4.527
   73    HH2  TRP   9           HH2      TRP   9 -20.716   2.021   2.126
   74    H    SER  10           H        SER  10 -22.256   6.840   7.900
   75    HA   SER  10           HA       SER  10 -21.228   8.120  10.309
   76    HB2  SER  10           HB2      SER  10 -23.188   6.981  11.391
   77    HB3  SER  10           HB3      SER  10 -23.645   8.098  10.106
   78    HG   SER  10           HG       SER  10 -24.780   6.237   9.754
   79    HA   PRO  11           HA       PRO  11 -18.748   4.616  11.449
   80    HB2  PRO  11           HB2      PRO  11 -19.995   4.783  14.144
   81    HB3  PRO  11           HB3      PRO  11 -18.288   4.807  13.693
   82    HG2  PRO  11           HG2      PRO  11 -19.515   7.037  14.462
   83    HG3  PRO  11           HG3      PRO  11 -18.328   7.062  13.145
   84    HD2  PRO  11           HD2      PRO  11 -21.314   7.158  13.008
   85    HD3  PRO  11           HD3      PRO  11 -20.111   8.021  12.027
   86    H    GLU  12           H        GLU  12 -22.143   4.695  12.313
   87    HA   GLU  12           HA       GLU  12 -22.523   1.942  12.797
   88    HB2  GLU  12           HB2      GLU  12 -24.117   3.786  13.397
   89    HB3  GLU  12           HB3      GLU  12 -24.528   3.921  11.695
   90    HG2  GLU  12           HG2      GLU  12 -26.210   2.641  12.834
   91    HG3  GLU  12           HG3      GLU  12 -25.325   1.594  11.725
   92    H    GLU  13           H        GLU  13 -22.747   3.914   9.848
   93    HA   GLU  13           HA       GLU  13 -23.600   1.709   8.229
   94    HB2  GLU  13           HB2      GLU  13 -24.063   4.181   7.792
   95    HB3  GLU  13           HB3      GLU  13 -22.405   4.284   7.213
   96    HG2  GLU  13           HG2      GLU  13 -23.899   4.011   5.346
   97    HG3  GLU  13           HG3      GLU  13 -22.910   2.563   5.526
   98    H    GLU  14           H        GLU  14 -20.496   3.284   8.915
   99    HA   GLU  14           HA       GLU  14 -19.002   1.792   7.020
  100    HB2  GLU  14           HB2      GLU  14 -18.112   3.091   9.602
  101    HB3  GLU  14           HB3      GLU  14 -17.021   2.410   8.404
  102    HG2  GLU  14           HG2      GLU  14 -18.020   4.002   6.741
  103    HG3  GLU  14           HG3      GLU  14 -18.847   4.774   8.093
  104    H    ALA  15           H        ALA  15 -20.043   1.154  10.313
  105    HA   ALA  15           HA       ALA  15 -18.607  -1.246  10.712
  106    HB1  ALA  15           HB1      ALA  15 -21.289  -0.419  11.817
  107    HB2  ALA  15           HB2      ALA  15 -19.716  -0.085  12.541
  108    HB3  ALA  15           HB3      ALA  15 -20.295  -1.745  12.417
  109    H    HIS  16           H        HIS  16 -21.605  -0.496   9.116
  110    HA   HIS  16           HA       HIS  16 -22.360  -3.177   8.535
  111    HB2  HIS  16           HB2      HIS  16 -24.033  -1.397   8.687
  112    HB3  HIS  16           HB3      HIS  16 -23.278  -0.551   7.343
  113    HD1  HIS  16           HD1      HIS  16 -25.174  -0.630   5.732
  114    HD2  HIS  16           HD2      HIS  16 -24.197  -4.389   7.234
  115    HE1  HIS  16           HE1      HIS  16 -26.547  -2.279   4.403
  116    HE2  HIS  16           HE2      HIS  16 -26.119  -4.502   5.508
  117    H    LEU  17           H        LEU  17 -20.419  -0.719   7.019
  118    HA   LEU  17           HA       LEU  17 -20.222  -1.837   4.443
  119    HB2  LEU  17           HB2      LEU  17 -19.491   0.464   5.164
  120    HB3  LEU  17           HB3      LEU  17 -18.104  -0.282   5.932
  121    HG   LEU  17           HG       LEU  17 -17.313  -1.077   3.746
  122   HD11  LEU  17          HD11      LEU  17 -19.359  -1.382   2.564
  123   HD12  LEU  17          HD12      LEU  17 -18.428  -0.152   1.711
  124   HD13  LEU  17          HD13      LEU  17 -19.779   0.320   2.739
  125   HD21  LEU  17          HD21      LEU  17 -17.947   1.866   3.825
  126   HD22  LEU  17          HD22      LEU  17 -16.730   1.099   2.806
  127   HD23  LEU  17          HD23      LEU  17 -16.550   1.078   4.560
  128    H    ARG  18           H        ARG  18 -18.178  -2.177   7.335
  129    HA   ARG  18           HA       ARG  18 -16.631  -4.275   6.165
  130    HB2  ARG  18           HB2      ARG  18 -15.669  -4.569   8.390
  131    HB3  ARG  18           HB3      ARG  18 -15.661  -2.884   7.907
  132    HG2  ARG  18           HG2      ARG  18 -17.699  -2.548   9.299
  133    HG3  ARG  18           HG3      ARG  18 -17.503  -4.205   9.876
  134    HD2  ARG  18           HD2      ARG  18 -15.262  -3.636  10.706
  135    HD3  ARG  18           HD3      ARG  18 -15.488  -1.978  10.157
  136    HE   ARG  18           HE       ARG  18 -17.190  -3.225  12.220
  137   HH11  ARG  18          HH11      ARG  18 -15.338  -0.501  11.009
  138   HH12  ARG  18          HH12      ARG  18 -15.665   0.498  12.384
  139   HH21  ARG  18          HH21      ARG  18 -17.601  -1.902  14.045
  140   HH22  ARG  18          HH22      ARG  18 -16.948  -0.297  14.107
  141    H    GLU  19           H        GLU  19 -19.553  -4.055   8.015
  142    HA   GLU  19           HA       GLU  19 -19.920  -6.584   8.982
  143    HB2  GLU  19           HB2      GLU  19 -21.543  -4.856   9.374
  144    HB3  GLU  19           HB3      GLU  19 -21.908  -4.756   7.657
  145    HG2  GLU  19           HG2      GLU  19 -23.673  -5.890   8.845
  146    HG3  GLU  19           HG3      GLU  19 -22.872  -6.985   7.725
  147    H    LEU  20           H        LEU  20 -20.715  -5.390   5.760
  148    HA   LEU  20           HA       LEU  20 -21.546  -7.895   4.716
  149    HB2  LEU  20           HB2      LEU  20 -21.476  -5.172   3.904
  150    HB3  LEU  20           HB3      LEU  20 -20.724  -6.127   2.644
  151    HG   LEU  20           HG       LEU  20 -23.397  -6.918   3.749
  152   HD11  LEU  20          HD11      LEU  20 -24.453  -5.616   1.974
  153   HD12  LEU  20          HD12      LEU  20 -22.888  -4.935   1.536
  154   HD13  LEU  20          HD13      LEU  20 -23.597  -4.573   3.108
  155   HD21  LEU  20          HD21      LEU  20 -22.061  -7.296   1.071
  156   HD22  LEU  20          HD22      LEU  20 -23.643  -7.920   1.536
  157   HD23  LEU  20          HD23      LEU  20 -22.190  -8.511   2.342
  158    H    TYR  21           H        TYR  21 -18.474  -6.211   4.836
  159    HA   TYR  21           HA       TYR  21 -17.189  -7.786   2.832
  160    HB2  TYR  21           HB2      TYR  21 -16.290  -5.591   3.358
  161    HB3  TYR  21           HB3      TYR  21 -16.034  -6.061   5.035
  162    HD1  TYR  21           HD1      TYR  21 -15.051  -7.173   1.592
  163    HD2  TYR  21           HD2      TYR  21 -13.913  -6.706   5.662
  164    HE1  TYR  21           HE1      TYR  21 -12.780  -7.932   1.037
  165    HE2  TYR  21           HE2      TYR  21 -11.638  -7.461   5.120
  166    HH   TYR  21           HH       TYR  21 -10.505  -7.758   1.892
  167    H    LEU  22           H        LEU  22 -17.082  -7.756   6.372
  168    HA   LEU  22           HA       LEU  22 -15.313  -9.905   6.684
  169    HB2  LEU  22           HB2      LEU  22 -17.550  -9.114   8.551
  170    HB3  LEU  22           HB3      LEU  22 -16.107 -10.011   8.969
  171    HG   LEU  22           HG       LEU  22 -16.261  -7.108   8.173
  172   HD11  LEU  22          HD11      LEU  22 -15.407  -6.721  10.433
  173   HD12  LEU  22          HD12      LEU  22 -15.495  -8.452  10.755
  174   HD13  LEU  22          HD13      LEU  22 -16.969  -7.538  10.445
  175   HD21  LEU  22          HD21      LEU  22 -13.812  -8.731   8.850
  176   HD22  LEU  22          HD22      LEU  22 -13.869  -6.997   8.525
  177   HD23  LEU  22          HD23      LEU  22 -14.244  -8.148   7.242
  178    H    ALA  23           H        ALA  23 -18.713  -9.792   6.014
  179    HA   ALA  23           HA       ALA  23 -19.265 -12.515   6.673
  180    HB1  ALA  23           HB1      ALA  23 -21.006 -10.802   6.689
  181    HB2  ALA  23           HB2      ALA  23 -21.413 -12.112   5.579
  182    HB3  ALA  23           HB3      ALA  23 -20.809 -10.578   4.950
  183    H    ASN  24           H        ASN  24 -18.568 -10.794   3.626
  184    HA   ASN  24           HA       ASN  24 -18.904 -13.302   2.166
  185    HB2  ASN  24           HB2      ASN  24 -18.785 -10.423   1.293
  186    HB3  ASN  24           HB3      ASN  24 -18.734 -11.758   0.145
  187   HD21  ASN  24          HD21      ASN  24 -20.681 -10.026   2.450
  188   HD22  ASN  24          HD22      ASN  24 -22.199 -10.713   1.976
  189    H    LYS  25           H        LYS  25 -16.359 -11.722   3.588
  190    HA   LYS  25           HA       LYS  25 -14.409 -11.908   1.514
  191    HB2  LYS  25           HB2      LYS  25 -12.753 -11.489   3.232
  192    HB3  LYS  25           HB3      LYS  25 -14.123 -10.414   3.462
  193    HG2  LYS  25           HG2      LYS  25 -14.946 -11.796   5.271
  194    HG3  LYS  25           HG3      LYS  25 -13.645 -12.956   5.004
  195    HD2  LYS  25           HD2      LYS  25 -13.215 -10.068   5.758
  196    HD3  LYS  25           HD3      LYS  25 -13.257 -11.399   6.913
  197    HE2  LYS  25           HE2      LYS  25 -11.325 -11.169   4.606
  198    HE3  LYS  25           HE3      LYS  25 -10.963 -10.740   6.276
  199    HZ1  LYS  25           HZ1      LYS  25 -10.175 -12.968   5.682
  200    HZ2  LYS  25           HZ2      LYS  25 -11.762 -13.452   5.361
  201    HZ3  LYS  25           HZ3      LYS  25 -11.315 -13.017   6.929
  202    H    ASP  26           H        ASP  26 -15.955 -14.238   3.329
  203    HA   ASP  26           HA       ASP  26 -13.684 -16.082   3.366
  204    HB2  ASP  26           HB2      ASP  26 -15.252 -15.683   5.366
  205    HB3  ASP  26           HB3      ASP  26 -16.438 -16.623   4.468
  206    H    VAL  27           H        VAL  27 -15.698 -15.161   1.114
  207    HA   VAL  27           HA       VAL  27 -16.389 -17.856   0.158
  208    HB   VAL  27           HB       VAL  27 -17.708 -15.244  -0.622
  209   HG11  VAL  27          HG11      VAL  27 -17.805 -16.930  -2.367
  210   HG12  VAL  27          HG12      VAL  27 -19.400 -16.690  -1.654
  211   HG13  VAL  27          HG13      VAL  27 -18.444 -18.107  -1.220
  212   HG21  VAL  27          HG21      VAL  27 -18.180 -15.799   1.716
  213   HG22  VAL  27          HG22      VAL  27 -18.725 -17.404   1.228
  214   HG23  VAL  27          HG23      VAL  27 -19.618 -15.974   0.709
  215    H    GLU  28           H        GLU  28 -14.897 -18.471  -1.256
  216    HA   GLU  28           HA       GLU  28 -13.406 -16.559  -2.815
  217    HB2  GLU  28           HB2      GLU  28 -13.384 -19.578  -2.776
  218    HB3  GLU  28           HB3      GLU  28 -12.306 -18.595  -3.757
  219    HG2  GLU  28           HG2      GLU  28 -11.414 -17.572  -1.711
  220    HG3  GLU  28           HG3      GLU  28 -12.453 -18.631  -0.750
  221    H    GLY  29           H        GLY  29 -13.542 -16.181  -4.971
  222    HA2  GLY  29           HA2      GLY  29 -14.213 -16.606  -7.189
  223    HA3  GLY  29           HA3      GLY  29 -15.375 -17.777  -6.588
  224    H    GLN  30           H        GLN  30 -16.168 -15.634  -4.533
  225    HA   GLN  30           HA       GLN  30 -18.127 -14.379  -6.278
  226    HB2  GLN  30           HB2      GLN  30 -18.924 -15.446  -4.198
  227    HB3  GLN  30           HB3      GLN  30 -17.939 -14.327  -3.260
  228    HG2  GLN  30           HG2      GLN  30 -19.231 -12.470  -4.405
  229    HG3  GLN  30           HG3      GLN  30 -20.332 -13.713  -4.947
  230   HE21  GLN  30          HE21      GLN  30 -19.202 -11.882  -2.342
  231   HE22  GLN  30          HE22      GLN  30 -20.420 -12.317  -1.203
  232    H    ASP  31           H        ASP  31 -18.328 -12.212  -6.572
  233    HA   ASP  31           HA       ASP  31 -16.131 -10.474  -6.096
  234    HB2  ASP  31           HB2      ASP  31 -19.010  -9.911  -6.819
  235    HB3  ASP  31           HB3      ASP  31 -17.744  -8.687  -6.793
  236    H    VAL  32           H        VAL  32 -15.672 -10.366  -3.879
  237    HA   VAL  32           HA       VAL  32 -17.622 -10.024  -1.885
  238    HB   VAL  32           HB       VAL  32 -15.209 -10.691  -1.492
  239   HG11  VAL  32          HG11      VAL  32 -14.069  -8.970  -2.730
  240   HG12  VAL  32          HG12      VAL  32 -13.616  -8.854  -1.028
  241   HG13  VAL  32          HG13      VAL  32 -14.783  -7.715  -1.714
  242   HG21  VAL  32          HG21      VAL  32 -16.391  -8.508   0.217
  243   HG22  VAL  32          HG22      VAL  32 -15.096  -9.597   0.714
  244   HG23  VAL  32          HG23      VAL  32 -16.699 -10.239   0.352
  245    H    VAL  33           H        VAL  33 -15.807  -7.713  -3.813
  246    HA   VAL  33           HA       VAL  33 -16.644  -5.404  -2.472
  247    HB   VAL  33           HB       VAL  33 -15.267  -4.331  -3.861
  248   HG11  VAL  33          HG11      VAL  33 -13.721  -5.625  -5.183
  249   HG12  VAL  33          HG12      VAL  33 -14.826  -6.997  -5.189
  250   HG13  VAL  33          HG13      VAL  33 -14.079  -6.470  -3.679
  251   HG21  VAL  33          HG21      VAL  33 -15.457  -4.219  -6.272
  252   HG22  VAL  33          HG22      VAL  33 -17.048  -4.060  -5.529
  253   HG23  VAL  33          HG23      VAL  33 -16.572  -5.584  -6.271
  254    H    GLU  34           H        GLU  34 -17.928  -7.010  -5.396
  255    HA   GLU  34           HA       GLU  34 -19.996  -5.129  -5.817
  256    HB2  GLU  34           HB2      GLU  34 -19.142  -6.707  -7.548
  257    HB3  GLU  34           HB3      GLU  34 -19.917  -8.024  -6.683
  258    HG2  GLU  34           HG2      GLU  34 -21.276  -7.375  -8.549
  259    HG3  GLU  34           HG3      GLU  34 -22.098  -6.957  -7.047
  260    H    ALA  35           H        ALA  35 -19.749  -8.073  -3.943
  261    HA   ALA  35           HA       ALA  35 -22.397  -8.407  -3.154
  262    HB1  ALA  35           HB1      ALA  35 -20.610  -9.983  -2.568
  263    HB2  ALA  35           HB2      ALA  35 -21.502  -9.462  -1.137
  264    HB3  ALA  35           HB3      ALA  35 -19.909  -8.781  -1.480
  265    H    ILE  36           H        ILE  36 -19.833  -6.423  -1.727
  266    HA   ILE  36           HA       ILE  36 -21.458  -5.307   0.302
  267    HB   ILE  36           HB       ILE  36 -18.934  -4.137  -0.869
  268   HG12  ILE  36          HG12      ILE  36 -19.177  -5.983   1.511
  269   HG13  ILE  36          HG13      ILE  36 -18.762  -6.547  -0.104
  270   HG21  ILE  36          HG21      ILE  36 -20.310  -3.780   1.790
  271   HG22  ILE  36          HG22      ILE  36 -20.121  -2.571   0.520
  272   HG23  ILE  36          HG23      ILE  36 -18.707  -3.155   1.398
  273   HD11  ILE  36          HD11      ILE  36 -16.786  -5.113  -0.081
  274   HD12  ILE  36          HD12      ILE  36 -16.787  -6.268   1.250
  275   HD13  ILE  36          HD13      ILE  36 -17.205  -4.581   1.546
  276    H    LEU  37           H        LEU  37 -20.175  -3.906  -2.728
  277    HA   LEU  37           HA       LEU  37 -21.253  -1.373  -2.584
  278    HB2  LEU  37           HB2      LEU  37 -21.333  -2.877  -5.175
  279    HB3  LEU  37           HB3      LEU  37 -21.059  -1.180  -4.927
  280    HG   LEU  37           HG       LEU  37 -19.080  -3.321  -4.162
  281   HD11  LEU  37          HD11      LEU  37 -19.299  -3.419  -6.526
  282   HD12  LEU  37          HD12      LEU  37 -17.848  -2.479  -6.180
  283   HD13  LEU  37          HD13      LEU  37 -19.333  -1.664  -6.659
  284   HD21  LEU  37          HD21      LEU  37 -17.513  -1.460  -4.083
  285   HD22  LEU  37          HD22      LEU  37 -18.832  -1.250  -2.931
  286   HD23  LEU  37          HD23      LEU  37 -18.825  -0.338  -4.440
  287    H    ALA  38           H        ALA  38 -22.861  -4.325  -3.591
  288    HA   ALA  38           HA       ALA  38 -25.175  -2.885  -4.581
  289    HB1  ALA  38           HB1      ALA  38 -24.247  -4.758  -5.840
  290    HB2  ALA  38           HB2      ALA  38 -25.931  -5.029  -5.388
  291    HB3  ALA  38           HB3      ALA  38 -24.638  -5.838  -4.501
  292    H    HIS  39           H        HIS  39 -24.395  -5.037  -1.868
  293    HA   HIS  39           HA       HIS  39 -27.168  -5.516  -1.295
  294    HB2  HIS  39           HB2      HIS  39 -24.616  -6.326   0.031
  295    HB3  HIS  39           HB3      HIS  39 -26.132  -6.474   0.913
  296    HD1  HIS  39           HD1      HIS  39 -27.785  -8.284   0.137
  297    HD2  HIS  39           HD2      HIS  39 -24.281  -8.116  -2.091
  298    HE1  HIS  39           HE1      HIS  39 -27.765 -10.384  -1.244
  299    HE2  HIS  39           HE2      HIS  39 -25.541 -10.349  -2.431
  300    H    LEU  40           H        LEU  40 -24.812  -3.173  -0.203
  301    HA   LEU  40           HA       LEU  40 -26.837  -2.226   1.679
  302    HB2  LEU  40           HB2      LEU  40 -24.970  -0.469   2.216
  303    HB3  LEU  40           HB3      LEU  40 -24.935  -2.069   2.911
  304    HG   LEU  40           HG       LEU  40 -23.330  -2.653   0.974
  305   HD11  LEU  40          HD11      LEU  40 -21.975  -0.736   0.208
  306   HD12  LEU  40          HD12      LEU  40 -23.157   0.355   0.937
  307   HD13  LEU  40          HD13      LEU  40 -23.631  -0.702  -0.398
  308   HD21  LEU  40          HD21      LEU  40 -22.500  -0.789   3.191
  309   HD22  LEU  40          HD22      LEU  40 -21.426  -1.852   2.281
  310   HD23  LEU  40          HD23      LEU  40 -22.683  -2.540   3.309
  311    H    ASN  41           H        ASN  41 -28.286  -1.626   0.083
  312    HA   ASN  41           HA       ASN  41 -27.544   0.477  -1.781
  313    HB2  ASN  41           HB2      ASN  41 -29.190  -1.527  -2.167
  314    HB3  ASN  41           HB3      ASN  41 -30.354  -0.496  -1.343
  315   HD21  ASN  41          HD21      ASN  41 -28.325  -0.860  -4.145
  316   HD22  ASN  41          HD22      ASN  41 -29.133   0.308  -5.131
  317    H    THR  42           H        THR  42 -27.189   1.106   0.846
  318    HA   THR  42           HA       THR  42 -29.389   2.861   1.648
  319    HB   THR  42           HB       THR  42 -28.672   1.413   3.413
  320    HG1  THR  42           HG1      THR  42 -27.358   3.198   4.714
  321   HG21  THR  42          HG21      THR  42 -26.354   1.261   4.183
  322   HG22  THR  42          HG22      THR  42 -25.850   2.350   2.890
  323   HG23  THR  42          HG23      THR  42 -26.503   0.760   2.497
  324    H    VAL  43           H        VAL  43 -26.354   2.834   0.157
  325    HA   VAL  43           HA       VAL  43 -26.150   5.746   0.408
  326    HB   VAL  43           HB       VAL  43 -23.603   5.389   0.270
  327   HG11  VAL  43          HG11      VAL  43 -23.407   5.215   2.704
  328   HG12  VAL  43          HG12      VAL  43 -25.087   4.683   2.797
  329   HG13  VAL  43          HG13      VAL  43 -24.707   6.311   2.227
  330   HG21  VAL  43          HG21      VAL  43 -24.435   2.686   1.315
  331   HG22  VAL  43          HG22      VAL  43 -22.789   3.320   1.317
  332   HG23  VAL  43          HG23      VAL  43 -23.613   3.010  -0.210
  333    HA   PRO  44           HA       PRO  44 -25.897   5.125  -4.089
  334    HB2  PRO  44           HB2      PRO  44 -26.625   7.947  -4.168
  335    HB3  PRO  44           HB3      PRO  44 -27.505   6.558  -4.810
  336    HG2  PRO  44           HG2      PRO  44 -28.374   8.006  -2.676
  337    HG3  PRO  44           HG3      PRO  44 -28.736   6.286  -2.894
  338    HD2  PRO  44           HD2      PRO  44 -26.686   7.591  -1.149
  339    HD3  PRO  44           HD3      PRO  44 -27.732   6.194  -0.813
  340    H    ARG  45           H        ARG  45 -23.701   5.014  -4.345
  341    HA   ARG  45           HA       ARG  45 -22.234   7.482  -4.611
  342    HB2  ARG  45           HB2      ARG  45 -20.394   6.319  -3.071
  343    HB3  ARG  45           HB3      ARG  45 -21.588   7.441  -2.436
  344    HG2  ARG  45           HG2      ARG  45 -22.941   5.633  -1.636
  345    HG3  ARG  45           HG3      ARG  45 -21.894   4.450  -2.422
  346    HD2  ARG  45           HD2      ARG  45 -21.637   5.012   0.136
  347    HD3  ARG  45           HD3      ARG  45 -20.239   4.683  -0.886
  348    HE   ARG  45           HE       ARG  45 -19.696   6.954  -0.881
  349   HH11  ARG  45          HH11      ARG  45 -22.519   6.337   1.116
  350   HH12  ARG  45          HH12      ARG  45 -22.399   7.854   1.947
  351   HH21  ARG  45          HH21      ARG  45 -19.540   8.919   0.234
  352   HH22  ARG  45          HH22      ARG  45 -20.718   9.315   1.454
  353    H    THR  46           H        THR  46 -19.827   6.926  -4.981
  354    HA   THR  46           HA       THR  46 -19.746   5.143  -7.209
  355    HB   THR  46           HB       THR  46 -17.424   5.872  -7.443
  356    HG1  THR  46           HG1      THR  46 -16.530   7.284  -5.869
  357   HG21  THR  46          HG21      THR  46 -19.277   8.119  -6.661
  358   HG22  THR  46          HG22      THR  46 -19.152   7.379  -8.260
  359   HG23  THR  46          HG23      THR  46 -17.800   8.304  -7.606
  360    H    ARG  47           H        ARG  47 -18.442   3.281  -7.385
  361    HA   ARG  47           HA       ARG  47 -18.710   1.603  -5.107
  362    HB2  ARG  47           HB2      ARG  47 -17.162   0.972  -7.619
  363    HB3  ARG  47           HB3      ARG  47 -17.955  -0.158  -6.531
  364    HG2  ARG  47           HG2      ARG  47 -19.285   1.801  -8.395
  365    HG3  ARG  47           HG3      ARG  47 -19.259   0.045  -8.537
  366    HD2  ARG  47           HD2      ARG  47 -20.671  -0.221  -6.653
  367    HD3  ARG  47           HD3      ARG  47 -20.455   1.457  -6.164
  368    HE   ARG  47           HE       ARG  47 -21.630   1.896  -8.438
  369   HH11  ARG  47          HH11      ARG  47 -22.354  -0.734  -6.244
  370   HH12  ARG  47          HH12      ARG  47 -24.030  -0.801  -6.670
  371   HH21  ARG  47          HH21      ARG  47 -23.843   1.822  -8.994
  372   HH22  ARG  47          HH22      ARG  47 -24.877   0.646  -8.248
  373    H    LYS  48           H        LYS  48 -16.141   3.383  -6.578
  374    HA   LYS  48           HA       LYS  48 -13.851   2.351  -5.462
  375    HB2  LYS  48           HB2      LYS  48 -13.842   4.190  -7.058
  376    HB3  LYS  48           HB3      LYS  48 -14.611   5.245  -5.884
  377    HG2  LYS  48           HG2      LYS  48 -12.579   4.925  -4.430
  378    HG3  LYS  48           HG3      LYS  48 -11.822   4.135  -5.813
  379    HD2  LYS  48           HD2      LYS  48 -11.139   6.434  -5.786
  380    HD3  LYS  48           HD3      LYS  48 -12.238   6.196  -7.145
  381    HE2  LYS  48           HE2      LYS  48 -14.069   7.158  -5.865
  382    HE3  LYS  48           HE3      LYS  48 -13.019   7.326  -4.458
  383    HZ1  LYS  48           HZ1      LYS  48 -12.594   8.692  -7.060
  384    HZ2  LYS  48           HZ2      LYS  48 -11.676   8.901  -5.656
  385    HZ3  LYS  48           HZ3      LYS  48 -13.287   9.407  -5.693
  386    H    GLN  49           H        GLN  49 -16.326   4.333  -3.938
  387    HA   GLN  49           HA       GLN  49 -14.814   5.112  -1.688
  388    HB2  GLN  49           HB2      GLN  49 -17.814   4.838  -1.927
  389    HB3  GLN  49           HB3      GLN  49 -16.959   5.719  -0.667
  390    HG2  GLN  49           HG2      GLN  49 -15.957   7.094  -2.569
  391    HG3  GLN  49           HG3      GLN  49 -17.209   6.383  -3.577
  392   HE21  GLN  49          HE21      GLN  49 -18.221   8.300  -3.948
  393   HE22  GLN  49          HE22      GLN  49 -19.092   9.166  -2.725
  394    H    ILE  50           H        ILE  50 -17.043   2.397  -2.204
  395    HA   ILE  50           HA       ILE  50 -17.080   1.434   0.413
  396    HB   ILE  50           HB       ILE  50 -17.469   0.084  -2.235
  397   HG12  ILE  50          HG12      ILE  50 -19.714  -0.357  -0.774
  398   HG13  ILE  50          HG13      ILE  50 -19.162   1.150  -0.054
  399   HG21  ILE  50          HG21      ILE  50 -17.438  -1.279   0.450
  400   HG22  ILE  50          HG22      ILE  50 -16.434  -1.644  -0.953
  401   HG23  ILE  50          HG23      ILE  50 -18.166  -1.971  -0.999
  402   HD11  ILE  50          HD11      ILE  50 -19.110   2.134  -2.354
  403   HD12  ILE  50          HD12      ILE  50 -20.711   1.673  -1.774
  404   HD13  ILE  50          HD13      ILE  50 -19.872   0.642  -2.937
  405    H    ILE  51           H        ILE  51 -14.938   0.483  -2.280
  406    HA   ILE  51           HA       ILE  51 -13.364  -1.326  -0.830
  407    HB   ILE  51           HB       ILE  51 -12.701   0.353  -3.251
  408   HG12  ILE  51          HG12      ILE  51 -12.684  -1.983  -4.308
  409   HG13  ILE  51          HG13      ILE  51 -13.453  -2.534  -2.827
  410   HG21  ILE  51          HG21      ILE  51 -10.694  -1.023  -3.548
  411   HG22  ILE  51          HG22      ILE  51 -10.997  -1.791  -1.991
  412   HG23  ILE  51          HG23      ILE  51 -10.624  -0.071  -2.065
  413   HD11  ILE  51          HD11      ILE  51 -15.032  -2.119  -4.660
  414   HD12  ILE  51          HD12      ILE  51 -14.568  -0.419  -4.646
  415   HD13  ILE  51          HD13      ILE  51 -15.354  -1.130  -3.237
  416    H    HIS  52           H        HIS  52 -13.045   2.156  -1.334
  417    HA   HIS  52           HA       HIS  52 -10.503   2.419  -0.168
  418    HB2  HIS  52           HB2      HIS  52 -12.616   4.245  -1.080
  419    HB3  HIS  52           HB3      HIS  52 -11.569   4.892   0.179
  420    HD1  HIS  52           HD1      HIS  52  -9.682   6.152  -0.772
  421    HD2  HIS  52           HD2      HIS  52 -10.783   2.962  -3.203
  422    HE1  HIS  52           HE1      HIS  52  -8.114   6.222  -2.729
  423    HE2  HIS  52           HE2      HIS  52  -8.718   4.220  -4.133
  424    H    HIS  53           H        HIS  53 -13.753   2.832   1.273
  425    HA   HIS  53           HA       HIS  53 -12.735   3.825   3.737
  426    HB2  HIS  53           HB2      HIS  53 -15.386   2.498   3.163
  427    HB3  HIS  53           HB3      HIS  53 -14.981   3.323   4.661
  428    HD1  HIS  53           HD1      HIS  53 -13.883   5.926   3.859
  429    HD2  HIS  53           HD2      HIS  53 -17.009   4.119   1.792
  430    HE1  HIS  53           HE1      HIS  53 -14.956   7.770   2.529
  431    HE2  HIS  53           HE2      HIS  53 -16.699   6.622   1.132
  432    H    LEU  54           H        LEU  54 -13.138   0.657   2.457
  433    HA   LEU  54           HA       LEU  54 -13.076  -0.717   4.961
  434    HB2  LEU  54           HB2      LEU  54 -12.754  -1.578   2.101
  435    HB3  LEU  54           HB3      LEU  54 -12.554  -2.705   3.426
  436    HG   LEU  54           HG       LEU  54 -15.074  -1.116   2.936
  437   HD11  LEU  54          HD11      LEU  54 -16.026  -3.170   2.067
  438   HD12  LEU  54          HD12      LEU  54 -14.483  -3.995   2.274
  439   HD13  LEU  54          HD13      LEU  54 -14.632  -2.686   1.102
  440   HD21  LEU  54          HD21      LEU  54 -16.071  -2.688   4.514
  441   HD22  LEU  54          HD22      LEU  54 -14.734  -1.812   5.261
  442   HD23  LEU  54          HD23      LEU  54 -14.508  -3.478   4.729
  443    H    VAL  55           H        VAL  55 -10.693  -0.108   2.398
  444    HA   VAL  55           HA       VAL  55  -8.557  -1.328   3.853
  445    HB   VAL  55           HB       VAL  55  -7.077  -0.443   2.152
  446   HG11  VAL  55          HG11      VAL  55  -9.691  -1.457   1.050
  447   HG12  VAL  55          HG12      VAL  55  -8.319  -2.425   1.590
  448   HG13  VAL  55          HG13      VAL  55  -8.173  -1.411   0.155
  449   HG21  VAL  55          HG21      VAL  55  -9.457   1.103   1.129
  450   HG22  VAL  55          HG22      VAL  55  -7.876   1.004   0.355
  451   HG23  VAL  55          HG23      VAL  55  -8.043   1.798   1.922
  452    H    GLN  56           H        GLN  56 -10.056   1.736   3.892
  453    HA   GLN  56           HA       GLN  56  -7.901   3.088   5.254
  454    HB2  GLN  56           HB2      GLN  56 -10.672   3.779   4.391
  455    HB3  GLN  56           HB3      GLN  56  -9.928   4.752   5.644
  456    HG2  GLN  56           HG2      GLN  56  -8.102   5.324   4.167
  457    HG3  GLN  56           HG3      GLN  56  -8.740   4.251   2.924
  458   HE21  GLN  56          HE21      GLN  56 -10.575   4.841   1.804
  459   HE22  GLN  56          HE22      GLN  56 -11.145   6.473   1.744
  460    H    MET  57           H        MET  57 -10.464   1.000   6.118
  461    HA   MET  57           HA       MET  57 -10.645   2.070   8.822
  462    HB2  MET  57           HB2      MET  57 -12.678   1.457   7.482
  463    HB3  MET  57           HB3      MET  57 -12.181  -0.224   7.614
  464    HG2  MET  57           HG2      MET  57 -12.775  -0.375   9.799
  465    HG3  MET  57           HG3      MET  57 -12.452   1.327  10.122
  466    HE1  MET  57           HE1      MET  57 -14.908  -0.988   7.983
  467    HE2  MET  57           HE2      MET  57 -14.492   0.396   6.973
  468    HE3  MET  57           HE3      MET  57 -16.136   0.213   7.580
  469    H    GLY  58           H        GLY  58  -8.472   0.267   7.419
  470    HA2  GLY  58           HA2      GLY  58  -6.774  -0.981   8.337
  471    HA3  GLY  58           HA3      GLY  58  -7.512  -0.706   9.905
  472    H    LEU  59           H        LEU  59  -9.480  -2.163   7.497
  473    HA   LEU  59           HA       LEU  59  -9.091  -4.772   8.787
  474    HB2  LEU  59           HB2      LEU  59 -11.362  -5.315   7.935
  475    HB3  LEU  59           HB3      LEU  59 -11.330  -4.005   9.097
  476    HG   LEU  59           HG       LEU  59 -11.224  -2.545   6.878
  477   HD11  LEU  59          HD11      LEU  59 -11.182  -4.494   5.395
  478   HD12  LEU  59          HD12      LEU  59 -12.610  -3.493   5.139
  479   HD13  LEU  59          HD13      LEU  59 -12.745  -5.002   6.035
  480   HD21  LEU  59          HD21      LEU  59 -13.717  -3.769   8.031
  481   HD22  LEU  59          HD22      LEU  59 -13.646  -2.303   7.054
  482   HD23  LEU  59          HD23      LEU  59 -12.876  -2.345   8.640
  483    H    ALA  60           H        ALA  60  -8.714  -2.992   5.949
  484    HA   ALA  60           HA       ALA  60  -7.783  -5.407   4.559
  485    HB1  ALA  60           HB1      ALA  60  -9.405  -3.190   3.301
  486    HB2  ALA  60           HB2      ALA  60  -9.939  -4.849   3.571
  487    HB3  ALA  60           HB3      ALA  60  -8.640  -4.516   2.425
  488    H    ASP  61           H        ASP  61  -6.003  -5.007   3.121
  489    HA   ASP  61           HA       ASP  61  -4.313  -2.936   4.169
  490    HB2  ASP  61           HB2      ASP  61  -3.912  -5.228   2.304
  491    HB3  ASP  61           HB3      ASP  61  -2.731  -3.923   2.298
  492    H    SER  62           H        SER  62  -5.464  -3.670   0.847
  493    HA   SER  62           HA       SER  62  -5.304  -0.830   0.233
  494    HB2  SER  62           HB2      SER  62  -3.781  -2.831  -1.431
  495    HB3  SER  62           HB3      SER  62  -3.802  -1.082  -1.631
  496    HG   SER  62           HG       SER  62  -3.040  -1.412   0.817
  497    H    VAL  63           H        VAL  63  -5.928  -0.463  -2.127
  498    HA   VAL  63           HA       VAL  63  -8.514  -1.402  -2.589
  499    HB   VAL  63           HB       VAL  63  -6.499  -0.072  -4.389
  500   HG11  VAL  63          HG11      VAL  63  -8.283   0.350  -6.001
  501   HG12  VAL  63          HG12      VAL  63  -9.386  -0.647  -5.051
  502   HG13  VAL  63          HG13      VAL  63  -7.978  -1.379  -5.827
  503   HG21  VAL  63          HG21      VAL  63  -9.002   0.896  -3.035
  504   HG22  VAL  63          HG22      VAL  63  -7.985   1.859  -4.105
  505   HG23  VAL  63          HG23      VAL  63  -7.342   1.269  -2.572
  506    H    LYS  64           H        LYS  64  -5.447  -2.684  -3.469
  507    HA   LYS  64           HA       LYS  64  -6.107  -4.226  -5.706
  508    HB2  LYS  64           HB2      LYS  64  -4.045  -5.115  -3.738
  509    HB3  LYS  64           HB3      LYS  64  -3.993  -5.150  -5.489
  510    HG2  LYS  64           HG2      LYS  64  -3.761  -2.707  -5.527
  511    HG3  LYS  64           HG3      LYS  64  -3.764  -2.694  -3.764
  512    HD2  LYS  64           HD2      LYS  64  -1.781  -4.229  -3.855
  513    HD3  LYS  64           HD3      LYS  64  -1.722  -3.930  -5.591
  514    HE2  LYS  64           HE2      LYS  64  -1.465  -1.873  -3.404
  515    HE3  LYS  64           HE3      LYS  64  -0.168  -2.478  -4.432
  516    HZ1  LYS  64           HZ1      LYS  64  -0.960  -0.339  -5.198
  517    HZ2  LYS  64           HZ2      LYS  64  -2.531  -0.937  -5.348
  518    HZ3  LYS  64           HZ3      LYS  64  -1.308  -1.530  -6.351
  519    H    ASP  65           H        ASP  65  -6.757  -4.700  -2.361
  520    HA   ASP  65           HA       ASP  65  -7.068  -7.518  -2.297
  521    HB2  ASP  65           HB2      ASP  65  -6.837  -6.050  -0.292
  522    HB3  ASP  65           HB3      ASP  65  -8.439  -5.401  -0.613
  523    H    PHE  66           H        PHE  66  -8.994  -4.900  -3.395
  524    HA   PHE  66           HA       PHE  66 -11.353  -6.621  -3.752
  525    HB2  PHE  66           HB2      PHE  66 -11.124  -3.605  -3.707
  526    HB3  PHE  66           HB3      PHE  66 -12.620  -4.509  -3.893
  527    HD1  PHE  66           HD1      PHE  66  -9.890  -3.676  -1.578
  528    HD2  PHE  66           HD2      PHE  66 -13.761  -5.384  -2.015
  529    HE1  PHE  66           HE1      PHE  66 -10.155  -3.685   0.863
  530    HE2  PHE  66           HE2      PHE  66 -14.032  -5.398   0.424
  531    HZ   PHE  66           HZ       PHE  66 -12.228  -4.545   1.871
  532    H    GLN  67           H        GLN  67  -9.386  -4.126  -5.270
  533    HA   GLN  67           HA       GLN  67 -10.271  -5.054  -7.911
  534    HB2  GLN  67           HB2      GLN  67  -9.853  -2.184  -7.027
  535    HB3  GLN  67           HB3      GLN  67 -10.163  -2.693  -8.684
  536    HG2  GLN  67           HG2      GLN  67 -12.346  -3.549  -8.022
  537    HG3  GLN  67           HG3      GLN  67 -12.032  -3.066  -6.355
  538   HE21  GLN  67          HE21      GLN  67 -14.158  -2.233  -8.163
  539   HE22  GLN  67          HE22      GLN  67 -14.037  -0.509  -8.278
  540    H    ARG  68           H        ARG  68  -8.318  -6.317  -7.873
  541    HA   ARG  68           HA       ARG  68  -5.757  -5.111  -7.801
  542    HB2  ARG  68           HB2      ARG  68  -5.981  -7.483  -7.413
  543    HB3  ARG  68           HB3      ARG  68  -6.702  -7.717  -9.000
  544    HG2  ARG  68           HG2      ARG  68  -4.578  -7.027 -10.038
  545    HG3  ARG  68           HG3      ARG  68  -3.866  -6.886  -8.427
  546    HD2  ARG  68           HD2      ARG  68  -3.373  -9.034  -9.610
  547    HD3  ARG  68           HD3      ARG  68  -4.120  -9.215  -8.024
  548    HE   ARG  68           HE       ARG  68  -6.251  -9.264  -9.687
  549   HH11  ARG  68          HH11      ARG  68  -3.228 -11.022  -9.740
  550   HH12  ARG  68          HH12      ARG  68  -3.918 -12.441 -10.452
  551   HH21  ARG  68          HH21      ARG  68  -7.173 -11.137 -10.599
  552   HH22  ARG  68          HH22      ARG  68  -6.175 -12.519 -10.921
  553    H    LYS  69           H        LYS  69  -6.009  -3.274  -9.124
  554    HA   LYS  69           HA       LYS  69  -6.020  -3.835 -12.010
  555    HB2  LYS  69           HB2      LYS  69  -6.522  -1.264 -10.501
  556    HB3  LYS  69           HB3      LYS  69  -6.431  -1.380 -12.251
  557    HG2  LYS  69           HG2      LYS  69  -8.451  -2.784 -10.511
  558    HG3  LYS  69           HG3      LYS  69  -8.740  -1.317 -11.445
  559    HD2  LYS  69           HD2      LYS  69  -7.988  -4.018 -12.567
  560    HD3  LYS  69           HD3      LYS  69  -9.593  -3.291 -12.606
  561    HE2  LYS  69           HE2      LYS  69  -7.113  -2.231 -13.965
  562    HE3  LYS  69           HE3      LYS  69  -8.474  -3.027 -14.751
  563    HZ1  LYS  69           HZ1      LYS  69  -8.621  -0.459 -13.272
  564    HZ2  LYS  69           HZ2      LYS  69  -9.898  -1.216 -14.077
  565    HZ3  LYS  69           HZ3      LYS  69  -8.586  -0.616 -14.954
  566    H    GLY  70           H        GLY  70  -4.107  -2.702  -9.373
  567    HA2  GLY  70           HA2      GLY  70  -1.834  -2.425 -11.170
  568    HA3  GLY  70           HA3      GLY  70  -2.277  -1.006 -10.234
  569    H    THR  71           H        THR  71  -0.313  -3.643 -10.320
  570    HA   THR  71           HA       THR  71   0.193  -3.378  -7.436
  571    HB   THR  71           HB       THR  71   1.325  -5.705  -7.742
  572    HG1  THR  71           HG1      THR  71   0.539  -5.478 -10.121
  573   HG21  THR  71          HG21      THR  71  -0.479  -5.344  -6.212
  574   HG22  THR  71          HG22      THR  71  -0.821  -6.808  -7.136
  575   HG23  THR  71          HG23      THR  71  -1.655  -5.302  -7.528
  576    H    HIS  72           H        HIS  72   1.729  -1.847  -7.563
  577    HA   HIS  72           HA       HIS  72   4.027  -1.721  -9.097
  578    HB2  HIS  72           HB2      HIS  72   5.011  -0.504  -7.205
  579    HB3  HIS  72           HB3      HIS  72   3.304  -0.075  -7.315
  580    HD1  HIS  72           HD1      HIS  72   5.782  -1.342  -4.976
  581    HD2  HIS  72           HD2      HIS  72   1.697  -1.767  -5.456
  582    HE1  HIS  72           HE1      HIS  72   4.944  -2.565  -2.941
  583    HE2  HIS  72           HE2      HIS  72   2.445  -2.413  -3.078
  584    H    ILE  73           H        ILE  73   3.205  -3.620  -6.349
  585    HA   ILE  73           HA       ILE  73   5.090  -5.703  -6.703
  586    HB   ILE  73           HB       ILE  73   5.586  -3.558  -4.682
  587   HG12  ILE  73          HG12      ILE  73   6.920  -4.383  -6.847
  588   HG13  ILE  73          HG13      ILE  73   7.661  -3.557  -5.498
  589   HG21  ILE  73          HG21      ILE  73   6.173  -6.445  -4.128
  590   HG22  ILE  73          HG22      ILE  73   5.112  -5.380  -3.207
  591   HG23  ILE  73          HG23      ILE  73   6.853  -5.092  -3.230
  592   HD11  ILE  73          HD11      ILE  73   7.544  -6.535  -5.924
  593   HD12  ILE  73          HD12      ILE  73   8.356  -5.721  -4.587
  594   HD13  ILE  73          HD13      ILE  73   8.945  -5.512  -6.239
  595    H    VAL  74           H        VAL  74   4.424  -7.450  -5.463
  596    HA   VAL  74           HA       VAL  74   2.192  -6.990  -3.633
  597    HB   VAL  74           HB       VAL  74   1.713  -9.399  -3.856
  598   HG11  VAL  74          HG11      VAL  74   0.781  -9.264  -6.124
  599   HG12  VAL  74          HG12      VAL  74   1.822  -7.874  -6.454
  600   HG13  VAL  74          HG13      VAL  74   0.555  -7.754  -5.234
  601   HG21  VAL  74          HG21      VAL  74   2.782 -10.716  -5.606
  602   HG22  VAL  74          HG22      VAL  74   3.981 -10.142  -4.447
  603   HG23  VAL  74          HG23      VAL  74   3.821  -9.351  -6.014
  604    H    LEU  75           H        LEU  75   2.333  -8.090  -1.548
  605    HA   LEU  75           HA       LEU  75   4.684  -7.504  -0.269
  606    HB2  LEU  75           HB2      LEU  75   3.851  -8.887   1.610
  607    HB3  LEU  75           HB3      LEU  75   2.659  -7.774   0.971
  608    HG   LEU  75           HG       LEU  75   2.377 -10.282  -0.375
  609   HD11  LEU  75          HD11      LEU  75   1.794 -11.715   1.494
  610   HD12  LEU  75          HD12      LEU  75   2.285 -10.463   2.633
  611   HD13  LEU  75          HD13      LEU  75   3.487 -11.228   1.595
  612   HD21  LEU  75          HD21      LEU  75   0.112 -10.142   0.558
  613   HD22  LEU  75          HD22      LEU  75   0.627  -8.606  -0.140
  614   HD23  LEU  75          HD23      LEU  75   0.630  -8.824   1.610
  615    H    TRP  76           H        TRP  76   6.558  -8.256  -1.036
  616    HA   TRP  76           HA       TRP  76   6.765 -11.042  -1.819
  617    HB2  TRP  76           HB2      TRP  76   8.263  -8.545  -2.462
  618    HB3  TRP  76           HB3      TRP  76   9.173 -10.065  -2.499
  619    HD1  TRP  76           HD1      TRP  76   7.432  -7.897  -4.724
  620    HE1  TRP  76           HE1      TRP  76   6.575  -9.106  -6.826
  621    HE3  TRP  76           HE3      TRP  76   7.847 -12.714  -3.117
  622    HZ2  TRP  76           HZ2      TRP  76   6.127 -11.742  -7.693
  623    HZ3  TRP  76           HZ3      TRP  76   7.181 -14.520  -4.644
  624    HH2  TRP  76           HH2      TRP  76   6.339 -14.043  -6.878
  625    H    THR  77           H        THR  77   7.189 -12.379  -0.267
  626    HA   THR  77           HA       THR  77   9.315 -11.751   1.663
  627    HB   THR  77           HB       THR  77   8.322 -13.567   3.048
  628    HG1  THR  77           HG1      THR  77   6.127 -14.220   2.359
  629   HG21  THR  77          HG21      THR  77   6.268 -12.352   3.710
  630   HG22  THR  77          HG22      THR  77   6.399 -11.371   2.249
  631   HG23  THR  77          HG23      THR  77   7.646 -11.272   3.494
  632    H    GLY  78           H        GLY  78  10.575 -13.758   2.329
  633    HA2  GLY  78           HA2      GLY  78  11.860 -14.930   0.153
  634    HA3  GLY  78           HA3      GLY  78  11.914 -15.551   1.796
  635    H    ASP  79           H        ASP  79   9.165 -16.128   2.075
  636    HA   ASP  79           HA       ASP  79   9.002 -18.712   0.972
  637    HB2  ASP  79           HB2      ASP  79   6.843 -16.937   2.130
  638    HB3  ASP  79           HB3      ASP  79   6.627 -18.643   1.753
  639    H    GLN  80           H        GLN  80   7.117 -15.793   0.230
  640    HA   GLN  80           HA       GLN  80   5.665 -16.896  -1.896
  641    HB2  GLN  80           HB2      GLN  80   5.125 -14.792  -0.613
  642    HB3  GLN  80           HB3      GLN  80   6.382 -13.980  -1.538
  643    HG2  GLN  80           HG2      GLN  80   5.182 -14.423  -3.597
  644    HG3  GLN  80           HG3      GLN  80   3.942 -15.298  -2.701
  645   HE21  GLN  80          HE21      GLN  80   5.290 -12.189  -3.430
  646   HE22  GLN  80          HE22      GLN  80   3.997 -11.248  -2.780
  647    H    GLU  81           H        GLU  81   8.769 -15.299  -1.759
  648    HA   GLU  81           HA       GLU  81   9.172 -14.958  -4.541
  649    HB2  GLU  81           HB2      GLU  81  10.420 -13.816  -2.682
  650    HB3  GLU  81           HB3      GLU  81  11.254 -15.332  -2.386
  651    HG2  GLU  81           HG2      GLU  81  12.307 -15.252  -4.526
  652    HG3  GLU  81           HG3      GLU  81  11.335 -13.859  -5.003
  653    H    LEU  82           H        LEU  82  10.098 -17.482  -2.246
  654    HA   LEU  82           HA       LEU  82  11.468 -19.156  -4.025
  655    HB2  LEU  82           HB2      LEU  82  11.615 -19.408  -1.618
  656    HB3  LEU  82           HB3      LEU  82   9.910 -19.796  -1.520
  657    HG   LEU  82           HG       LEU  82  11.380 -21.620  -3.266
  658   HD11  LEU  82          HD11      LEU  82  13.183 -21.168  -1.691
  659   HD12  LEU  82          HD12      LEU  82  12.534 -22.790  -1.445
  660   HD13  LEU  82          HD13      LEU  82  12.097 -21.489  -0.337
  661   HD21  LEU  82          HD21      LEU  82  10.174 -23.278  -1.932
  662   HD22  LEU  82          HD22      LEU  82   9.097 -21.999  -2.493
  663   HD23  LEU  82          HD23      LEU  82   9.657 -22.007  -0.821
  664    H    GLU  83           H        GLU  83   8.042 -18.765  -3.363
  665    HA   GLU  83           HA       GLU  83   7.070 -21.043  -4.688
  666    HB2  GLU  83           HB2      GLU  83   5.801 -18.305  -4.571
  667    HB3  GLU  83           HB3      GLU  83   4.987 -19.803  -4.981
  668    HG2  GLU  83           HG2      GLU  83   5.386 -20.630  -2.713
  669    HG3  GLU  83           HG3      GLU  83   6.169 -19.099  -2.309
  670    H    LEU  84           H        LEU  84   7.525 -17.726  -5.891
  671    HA   LEU  84           HA       LEU  84   6.510 -18.208  -8.454
  672    HB2  LEU  84           HB2      LEU  84   6.772 -15.964  -7.479
  673    HB3  LEU  84           HB3      LEU  84   8.514 -16.113  -7.614
  674    HG   LEU  84           HG       LEU  84   8.333 -16.203 -10.060
  675   HD11  LEU  84          HD11      LEU  84   6.209 -15.786 -11.166
  676   HD12  LEU  84          HD12      LEU  84   5.384 -15.771  -9.608
  677   HD13  LEU  84          HD13      LEU  84   6.129 -17.257 -10.196
  678   HD21  LEU  84          HD21      LEU  84   7.667 -13.899 -10.440
  679   HD22  LEU  84          HD22      LEU  84   8.595 -14.031  -8.945
  680   HD23  LEU  84          HD23      LEU  84   6.839 -13.862  -8.883
  681    H    GLN  85           H        GLN  85   9.819 -18.365  -7.213
  682    HA   GLN  85           HA       GLN  85  11.192 -18.713  -9.599
  683    HB2  GLN  85           HB2      GLN  85  12.342 -18.386  -7.501
  684    HB3  GLN  85           HB3      GLN  85  11.688 -19.888  -6.863
  685    HG2  GLN  85           HG2      GLN  85  12.943 -21.080  -8.684
  686    HG3  GLN  85           HG3      GLN  85  13.736 -19.547  -9.027
  687   HE21  GLN  85          HE21      GLN  85  13.370 -22.128  -6.777
  688   HE22  GLN  85          HE22      GLN  85  14.725 -21.724  -5.793
  689    H    ARG  86           H        ARG  86   9.773 -21.171  -7.472
  690    HA   ARG  86           HA       ARG  86  10.642 -23.400  -8.920
  691    HB2  ARG  86           HB2      ARG  86   8.266 -23.073  -7.097
  692    HB3  ARG  86           HB3      ARG  86   8.840 -24.617  -7.707
  693    HG2  ARG  86           HG2      ARG  86  10.969 -24.296  -6.568
  694    HG3  ARG  86           HG3      ARG  86  10.424 -22.721  -5.986
  695    HD2  ARG  86           HD2      ARG  86   9.077 -25.345  -5.361
  696    HD3  ARG  86           HD3      ARG  86  10.212 -24.520  -4.294
  697    HE   ARG  86           HE       ARG  86   8.605 -22.720  -4.102
  698   HH11  ARG  86          HH11      ARG  86   7.411 -25.667  -5.566
  699   HH12  ARG  86          HH12      ARG  86   5.765 -25.383  -5.095
  700   HH21  ARG  86          HH21      ARG  86   6.417 -22.356  -3.471
  701   HH22  ARG  86          HH22      ARG  86   5.202 -23.510  -3.917
  702    H    LEU  87           H        LEU  87   7.441 -21.839  -8.908
  703    HA   LEU  87           HA       LEU  87   6.300 -23.578 -10.795
  704    HB2  LEU  87           HB2      LEU  87   5.571 -20.861  -9.800
  705    HB3  LEU  87           HB3      LEU  87   4.701 -21.559 -11.151
  706    HG   LEU  87           HG       LEU  87   4.305 -23.579  -9.611
  707   HD11  LEU  87          HD11      LEU  87   4.275 -23.089  -7.231
  708   HD12  LEU  87          HD12      LEU  87   4.990 -21.507  -7.534
  709   HD13  LEU  87          HD13      LEU  87   5.913 -22.971  -7.876
  710   HD21  LEU  87          HD21      LEU  87   2.337 -22.512  -8.655
  711   HD22  LEU  87          HD22      LEU  87   2.584 -22.033 -10.334
  712   HD23  LEU  87          HD23      LEU  87   3.012 -20.925  -9.031
  713    H    PHE  88           H        PHE  88   8.001 -20.523 -11.179
  714    HA   PHE  88           HA       PHE  88   7.497 -20.027 -13.855
  715    HB2  PHE  88           HB2      PHE  88   8.623 -18.314 -12.774
  716    HB3  PHE  88           HB3      PHE  88   9.768 -19.409 -12.016
  717    HD1  PHE  88           HD1      PHE  88  11.857 -19.777 -12.934
  718    HD2  PHE  88           HD2      PHE  88   8.836 -17.906 -15.272
  719    HE1  PHE  88           HE1      PHE  88  13.518 -19.286 -14.671
  720    HE2  PHE  88           HE2      PHE  88  10.494 -17.402 -17.014
  721    HZ   PHE  88           HZ       PHE  88  12.837 -18.101 -16.713
  722    H    GLU  89           H        GLU  89   9.981 -22.111 -12.416
  723    HA   GLU  89           HA       GLU  89  11.238 -22.699 -14.900
  724    HB2  GLU  89           HB2      GLU  89  11.341 -24.289 -12.345
  725    HB3  GLU  89           HB3      GLU  89  12.495 -24.349 -13.663
  726    HG2  GLU  89           HG2      GLU  89  13.232 -22.126 -13.205
  727    HG3  GLU  89           HG3      GLU  89  11.955 -21.909 -12.011
  728    H    GLU  90           H        GLU  90   8.616 -24.186 -13.070
  729    HA   GLU  90           HA       GLU  90   8.857 -26.616 -14.639
  730    HB2  GLU  90           HB2      GLU  90   7.055 -27.468 -13.155
  731    HB3  GLU  90           HB3      GLU  90   8.513 -26.948 -12.320
  732    HG2  GLU  90           HG2      GLU  90   7.475 -24.945 -11.591
  733    HG3  GLU  90           HG3      GLU  90   6.055 -25.256 -12.585
  734    H    PHE  91           H        PHE  91   6.955 -23.742 -14.649
  735    HA   PHE  91           HA       PHE  91   5.201 -24.964 -16.668
  736    HB2  PHE  91           HB2      PHE  91   4.958 -22.327 -15.205
  737    HB3  PHE  91           HB3      PHE  91   3.854 -22.875 -16.464
  738    HD1  PHE  91           HD1      PHE  91   2.970 -25.375 -16.026
  739    HD2  PHE  91           HD2      PHE  91   4.260 -22.636 -13.039
  740    HE1  PHE  91           HE1      PHE  91   1.630 -26.579 -14.351
  741    HE2  PHE  91           HE2      PHE  91   2.924 -23.838 -11.359
  742    HZ   PHE  91           HZ       PHE  91   1.609 -25.811 -12.013
  743    H    ARG  92           H        ARG  92   8.105 -23.750 -16.647
  744    HA   ARG  92           HA       ARG  92   8.076 -21.635 -18.529
  745    HB2  ARG  92           HB2      ARG  92   9.969 -22.064 -17.032
  746    HB3  ARG  92           HB3      ARG  92  10.271 -23.596 -17.833
  747    HG2  ARG  92           HG2      ARG  92  11.012 -22.538 -19.803
  748    HG3  ARG  92           HG3      ARG  92  10.376 -20.974 -19.292
  749    HD2  ARG  92           HD2      ARG  92  11.997 -20.931 -17.452
  750    HD3  ARG  92           HD3      ARG  92  12.652 -22.475 -17.994
  751    HE   ARG  92           HE       ARG  92  12.903 -20.947 -20.195
  752   HH11  ARG  92          HH11      ARG  92  13.869 -20.466 -16.869
  753   HH12  ARG  92          HH12      ARG  92  15.138 -19.352 -17.258
  754   HH21  ARG  92          HH21      ARG  92  14.603 -19.500 -20.726
  755   HH22  ARG  92          HH22      ARG  92  15.557 -18.803 -19.461
  756    H    ASP  93           H        ASP  93   7.783 -25.036 -18.817
  757    HA   ASP  93           HA       ASP  93   8.395 -24.995 -21.673
  758    HB2  ASP  93           HB2      ASP  93   8.163 -27.448 -21.558
  759    HB3  ASP  93           HB3      ASP  93   9.344 -26.835 -20.406
  760    H    SER  94           H        SER  94   5.878 -23.986 -20.098
  761    HA   SER  94           HA       SER  94   3.856 -25.494 -21.598
  762    HB2  SER  94           HB2      SER  94   3.507 -23.565 -19.289
  763    HB3  SER  94           HB3      SER  94   2.229 -24.524 -20.040
  764    HG   SER  94           HG       SER  94   4.194 -26.175 -19.374
  765    H    ASP  95           H        ASP  95   1.864 -23.900 -22.054
  766    HA   ASP  95           HA       ASP  95   2.802 -22.321 -24.205
  767    HB2  ASP  95           HB2      ASP  95   0.438 -21.797 -24.616
  768    HB3  ASP  95           HB3      ASP  95   0.661 -23.515 -24.309
  769    H    ASP  96           H        ASP  96   1.473 -21.448 -21.051
  770    HA   ASP  96           HA       ASP  96   2.899 -18.927 -21.338
  771    HB2  ASP  96           HB2      ASP  96   0.513 -18.457 -21.938
  772    HB3  ASP  96           HB3      ASP  96   0.049 -18.990 -20.323
  773    H    VAL  97           H        VAL  97   4.298 -19.032 -19.778
  774    HA   VAL  97           HA       VAL  97   4.037 -20.780 -17.592
  775    HB   VAL  97           HB       VAL  97   6.233 -20.293 -18.373
  776   HG11  VAL  97          HG11      VAL  97   7.275 -18.074 -18.139
  777   HG12  VAL  97          HG12      VAL  97   5.707 -17.414 -17.682
  778   HG13  VAL  97          HG13      VAL  97   5.942 -18.097 -19.292
  779   HG21  VAL  97          HG21      VAL  97   6.140 -20.787 -16.028
  780   HG22  VAL  97          HG22      VAL  97   5.816 -19.096 -15.642
  781   HG23  VAL  97          HG23      VAL  97   7.383 -19.565 -16.309
  782    H    LEU  98           H        LEU  98   3.492 -17.284 -17.874
  783    HA   LEU  98           HA       LEU  98   3.308 -16.828 -15.077
  784    HB2  LEU  98           HB2      LEU  98   2.203 -15.208 -17.364
  785    HB3  LEU  98           HB3      LEU  98   2.235 -14.682 -15.693
  786    HG   LEU  98           HG       LEU  98   4.854 -15.266 -16.080
  787   HD11  LEU  98          HD11      LEU  98   5.496 -14.292 -18.243
  788   HD12  LEU  98          HD12      LEU  98   3.794 -14.240 -18.704
  789   HD13  LEU  98          HD13      LEU  98   4.581 -15.790 -18.417
  790   HD21  LEU  98          HD21      LEU  98   3.499 -12.650 -16.719
  791   HD22  LEU  98          HD22      LEU  98   5.185 -12.870 -16.250
  792   HD23  LEU  98          HD23      LEU  98   3.895 -13.232 -15.102
  793    H    GLY  99           H        GLY  99   0.863 -17.403 -17.580
  794    HA2  GLY  99           HA2      GLY  99  -1.399 -17.038 -15.934
  795    HA3  GLY  99           HA3      GLY  99  -1.351 -17.980 -17.422
  796    H    HIS 100           H        HIS 100   0.520 -19.928 -16.649
  797    HA   HIS 100           HA       HIS 100  -1.212 -21.672 -15.199
  798    HB2  HIS 100           HB2      HIS 100   1.592 -22.004 -16.260
  799    HB3  HIS 100           HB3      HIS 100   0.782 -23.263 -15.336
  800    HD1  HIS 100           HD1      HIS 100  -0.477 -24.900 -16.691
  801    HD2  HIS 100           HD2      HIS 100  -0.001 -21.291 -18.688
  802    HE1  HIS 100           HE1      HIS 100  -1.415 -25.271 -18.988
  803    HE2  HIS 100           HE2      HIS 100  -0.869 -23.163 -20.252
  804    H    ILE 101           H        ILE 101   1.644 -19.778 -14.481
  805    HA   ILE 101           HA       ILE 101   2.150 -20.621 -11.871
  806    HB   ILE 101           HB       ILE 101   2.406 -17.904 -13.171
  807   HG12  ILE 101          HG12      ILE 101   4.469 -19.895 -12.184
  808   HG13  ILE 101          HG13      ILE 101   3.975 -19.694 -13.862
  809   HG21  ILE 101          HG21      ILE 101   3.222 -18.650 -10.359
  810   HG22  ILE 101          HG22      ILE 101   1.966 -17.500 -10.813
  811   HG23  ILE 101          HG23      ILE 101   3.654 -17.155 -11.189
  812   HD11  ILE 101          HD11      ILE 101   4.845 -17.415 -13.840
  813   HD12  ILE 101          HD12      ILE 101   6.091 -18.589 -13.420
  814   HD13  ILE 101          HD13      ILE 101   5.333 -17.620 -12.158
  815    H    MET 102           H        MET 102   0.012 -18.003 -12.989
  816    HA   MET 102           HA       MET 102  -0.934 -17.191 -10.510
  817    HB2  MET 102           HB2      MET 102  -2.277 -17.114 -13.206
  818    HB3  MET 102           HB3      MET 102  -2.917 -16.317 -11.774
  819    HG2  MET 102           HG2      MET 102  -0.802 -15.032 -11.617
  820    HG3  MET 102           HG3      MET 102  -0.307 -15.745 -13.154
  821    HE1  MET 102           HE1      MET 102  -0.687 -12.635 -12.241
  822    HE2  MET 102           HE2      MET 102  -1.290 -11.933 -13.744
  823    HE3  MET 102           HE3      MET 102   0.038 -13.093 -13.784
  824    H    LYS 103           H        LYS 103  -2.199 -19.710 -12.633
  825    HA   LYS 103           HA       LYS 103  -4.543 -20.185 -11.096
  826    HB2  LYS 103           HB2      LYS 103  -3.146 -21.627 -13.309
  827    HB3  LYS 103           HB3      LYS 103  -4.390 -22.473 -12.400
  828    HG2  LYS 103           HG2      LYS 103  -5.263 -21.459 -14.447
  829    HG3  LYS 103           HG3      LYS 103  -6.021 -20.784 -13.005
  830    HD2  LYS 103           HD2      LYS 103  -4.696 -18.801 -13.161
  831    HD3  LYS 103           HD3      LYS 103  -3.715 -19.497 -14.452
  832    HE2  LYS 103           HE2      LYS 103  -5.336 -17.910 -15.334
  833    HE3  LYS 103           HE3      LYS 103  -5.655 -19.540 -15.920
  834    HZ1  LYS 103           HZ1      LYS 103  -7.449 -19.760 -14.384
  835    HZ2  LYS 103           HZ2      LYS 103  -7.661 -18.309 -15.225
  836    HZ3  LYS 103           HZ3      LYS 103  -7.080 -18.285 -13.636
  837    H    ASN 104           H        ASN 104  -1.273 -21.478 -10.982
  838    HA   ASN 104           HA       ASN 104  -2.168 -23.490  -9.034
  839    HB2  ASN 104           HB2      ASN 104   0.376 -23.253 -10.634
  840    HB3  ASN 104           HB3      ASN 104   0.163 -24.429  -9.341
  841   HD21  ASN 104          HD21      ASN 104  -0.713 -23.516 -12.558
  842   HD22  ASN 104          HD22      ASN 104  -1.530 -24.986 -12.975
  843    H    ILE 105           H        ILE 105  -1.190 -20.416  -8.823
  844    HA   ILE 105           HA       ILE 105   0.601 -20.895  -6.552
  845    HB   ILE 105           HB       ILE 105   1.433 -19.381  -8.326
  846   HG12  ILE 105          HG12      ILE 105   2.153 -17.544  -6.821
  847   HG13  ILE 105          HG13      ILE 105   0.987 -18.110  -5.631
  848   HG21  ILE 105          HG21      ILE 105  -0.738 -17.515  -7.404
  849   HG22  ILE 105          HG22      ILE 105  -0.712 -18.371  -8.945
  850   HG23  ILE 105          HG23      ILE 105   0.516 -17.155  -8.590
  851   HD11  ILE 105          HD11      ILE 105   2.165 -20.227  -5.472
  852   HD12  ILE 105          HD12      ILE 105   3.230 -18.869  -5.120
  853   HD13  ILE 105          HD13      ILE 105   3.324 -19.679  -6.683
  854    H    THR 106           H        THR 106   0.258 -19.920  -4.577
  855    HA   THR 106           HA       THR 106  -2.480 -19.721  -3.833
  856    HB   THR 106           HB       THR 106  -0.317 -20.559  -2.536
  857    HG1  THR 106           HG1      THR 106  -1.836 -20.951  -1.129
  858   HG21  THR 106          HG21      THR 106   0.319 -18.993  -0.752
  859   HG22  THR 106          HG22      THR 106  -0.656 -17.737  -1.512
  860   HG23  THR 106          HG23      THR 106   0.761 -18.378  -2.344
  861    H    ALA 107           H        ALA 107   0.147 -17.408  -4.311
  862    HA   ALA 107           HA       ALA 107  -1.478 -15.182  -3.415
  863    HB1  ALA 107           HB1      ALA 107   1.280 -15.245  -4.634
  864    HB2  ALA 107           HB2      ALA 107   0.903 -15.165  -2.911
  865    HB3  ALA 107           HB3      ALA 107   0.488 -13.816  -3.972
  866    H    LYS 108           H        LYS 108  -2.712 -13.966  -4.699
  867    HA   LYS 108           HA       LYS 108  -2.629 -14.431  -7.570
  868    HB2  LYS 108           HB2      LYS 108  -4.475 -12.670  -5.945
  869    HB3  LYS 108           HB3      LYS 108  -4.670 -13.083  -7.640
  870    HG2  LYS 108           HG2      LYS 108  -4.683 -15.130  -5.435
  871    HG3  LYS 108           HG3      LYS 108  -6.137 -14.330  -6.025
  872    HD2  LYS 108           HD2      LYS 108  -6.217 -16.168  -7.357
  873    HD3  LYS 108           HD3      LYS 108  -5.162 -15.180  -8.363
  874    HE2  LYS 108           HE2      LYS 108  -4.276 -17.422  -8.188
  875    HE3  LYS 108           HE3      LYS 108  -3.206 -16.297  -7.360
  876    HZ1  LYS 108           HZ1      LYS 108  -3.569 -18.343  -6.096
  877    HZ2  LYS 108           HZ2      LYS 108  -5.228 -18.023  -6.031
  878    HZ3  LYS 108           HZ3      LYS 108  -4.140 -16.991  -5.252
  879    H    ARG 109           H        ARG 109  -0.980 -13.412  -8.492
  880    HA   ARG 109           HA       ARG 109  -0.433 -10.623  -7.718
  881    HB2  ARG 109           HB2      ARG 109   1.497 -12.458  -9.141
  882    HB3  ARG 109           HB3      ARG 109   1.853 -10.966  -8.280
  883    HG2  ARG 109           HG2      ARG 109   1.390 -12.034  -6.161
  884    HG3  ARG 109           HG3      ARG 109   0.904 -13.517  -6.982
  885    HD2  ARG 109           HD2      ARG 109   3.233 -13.559  -7.983
  886    HD3  ARG 109           HD3      ARG 109   3.649 -12.285  -6.836
  887    HE   ARG 109           HE       ARG 109   3.006 -13.903  -5.059
  888   HH11  ARG 109          HH11      ARG 109   3.932 -15.086  -8.225
  889   HH12  ARG 109          HH12      ARG 109   4.461 -16.623  -7.638
  890   HH21  ARG 109          HH21      ARG 109   3.692 -15.969  -4.285
  891   HH22  ARG 109          HH22      ARG 109   4.333 -17.119  -5.405
  892    H    SER 110           H        SER 110   0.457  -9.293  -9.552
  893    HA   SER 110           HA       SER 110  -1.049  -9.870 -11.996
  894    HB2  SER 110           HB2      SER 110  -1.433  -7.668 -10.964
  895    HB3  SER 110           HB3      SER 110   0.286  -7.307 -11.084
  896    HG   SER 110           HG       SER 110  -1.669  -7.411 -13.082
  897    H    ARG 111           H        ARG 111   0.012  -9.528 -14.076
  898    HA   ARG 111           HA       ARG 111   2.403 -11.018 -14.173
  899    HB2  ARG 111           HB2      ARG 111   0.797  -9.552 -16.227
  900    HB3  ARG 111           HB3      ARG 111   2.373 -10.214 -16.646
  901    HG2  ARG 111           HG2      ARG 111   1.606 -12.441 -15.948
  902    HG3  ARG 111           HG3      ARG 111   0.020 -11.765 -15.574
  903    HD2  ARG 111           HD2      ARG 111  -0.402 -11.251 -17.834
  904    HD3  ARG 111           HD3      ARG 111   1.278 -11.523 -18.287
  905    HE   ARG 111           HE       ARG 111   0.659 -13.951 -17.494
  906   HH11  ARG 111          HH11      ARG 111  -1.369 -11.712 -19.264
  907   HH12  ARG 111          HH12      ARG 111  -2.110 -12.938 -20.239
  908   HH21  ARG 111          HH21      ARG 111  -0.307 -15.594 -18.813
  909   HH22  ARG 111          HH22      ARG 111  -1.533 -15.142 -19.956
  910    H    ALA 112           H        ALA 112   1.795  -7.548 -14.476
  911    HA   ALA 112           HA       ALA 112   4.308  -6.708 -15.321
  912    HB1  ALA 112           HB1      ALA 112   3.784  -4.560 -14.282
  913    HB2  ALA 112           HB2      ALA 112   2.475  -5.314 -13.372
  914    HB3  ALA 112           HB3      ALA 112   2.382  -5.212 -15.130
  915    H    ARG 113           H        ARG 113   3.198  -7.573 -12.111
  916    HA   ARG 113           HA       ARG 113   5.693  -6.800 -10.878
  917    HB2  ARG 113           HB2      ARG 113   3.654  -6.338  -9.693
  918    HB3  ARG 113           HB3      ARG 113   3.127  -8.003  -9.829
  919    HG2  ARG 113           HG2      ARG 113   4.048  -7.033  -7.583
  920    HG3  ARG 113           HG3      ARG 113   4.397  -8.691  -8.069
  921    HD2  ARG 113           HD2      ARG 113   6.324  -7.442  -7.154
  922    HD3  ARG 113           HD3      ARG 113   6.591  -8.102  -8.761
  923    HE   ARG 113           HE       ARG 113   5.750  -5.319  -8.622
  924   HH11  ARG 113          HH11      ARG 113   8.376  -7.607  -8.954
  925   HH12  ARG 113          HH12      ARG 113   9.497  -6.433  -9.576
  926   HH21  ARG 113          HH21      ARG 113   7.219  -3.772  -9.430
  927   HH22  ARG 113          HH22      ARG 113   8.836  -4.253  -9.849
  928    H    ILE 114           H        ILE 114   4.227  -9.680 -12.163
  929    HA   ILE 114           HA       ILE 114   6.030 -11.517 -10.908
  930    HB   ILE 114           HB       ILE 114   4.379 -11.838 -13.420
  931   HG12  ILE 114          HG12      ILE 114   3.934 -12.890 -10.621
  932   HG13  ILE 114          HG13      ILE 114   3.095 -11.506 -11.317
  933   HG21  ILE 114          HG21      ILE 114   5.864 -13.923 -11.820
  934   HG22  ILE 114          HG22      ILE 114   6.298 -13.356 -13.432
  935   HG23  ILE 114          HG23      ILE 114   4.793 -14.242 -13.183
  936   HD11  ILE 114          HD11      ILE 114   2.189 -13.008 -13.073
  937   HD12  ILE 114          HD12      ILE 114   1.674 -13.432 -11.439
  938   HD13  ILE 114          HD13      ILE 114   2.939 -14.368 -12.235
  939    H    VAL 115           H        VAL 115   5.889  -9.998 -14.129
  940    HA   VAL 115           HA       VAL 115   8.140 -11.328 -15.160
  941    HB   VAL 115           HB       VAL 115   8.172  -9.669 -16.947
  942   HG11  VAL 115          HG11      VAL 115   5.357 -10.440 -16.186
  943   HG12  VAL 115          HG12      VAL 115   6.516 -11.473 -17.018
  944   HG13  VAL 115          HG13      VAL 115   5.918 -10.012 -17.802
  945   HG21  VAL 115          HG21      VAL 115   6.064  -8.183 -15.381
  946   HG22  VAL 115          HG22      VAL 115   6.664  -7.771 -16.987
  947   HG23  VAL 115          HG23      VAL 115   7.736  -7.661 -15.591
  948    H    ASP 116           H        ASP 116   7.826  -8.263 -13.442
  949    HA   ASP 116           HA       ASP 116  10.511  -7.427 -13.772
  950    HB2  ASP 116           HB2      ASP 116   8.670  -5.913 -13.053
  951    HB3  ASP 116           HB3      ASP 116   8.602  -6.770 -11.521
  952    H    LYS 117           H        LYS 117   8.882  -9.519 -11.489
  953    HA   LYS 117           HA       LYS 117  10.967  -9.525  -9.557
  954    HB2  LYS 117           HB2      LYS 117   8.578 -10.091  -9.083
  955    HB3  LYS 117           HB3      LYS 117   8.808 -11.597  -9.959
  956    HG2  LYS 117           HG2      LYS 117   8.950 -11.926  -7.554
  957    HG3  LYS 117           HG3      LYS 117  10.479 -12.303  -8.345
  958    HD2  LYS 117           HD2      LYS 117  11.387 -10.147  -7.672
  959    HD3  LYS 117           HD3      LYS 117   9.842  -9.701  -6.944
  960    HE2  LYS 117           HE2      LYS 117  10.045 -11.455  -5.317
  961    HE3  LYS 117           HE3      LYS 117  11.491 -12.073  -6.105
  962    HZ1  LYS 117           HZ1      LYS 117  11.217  -9.482  -4.695
  963    HZ2  LYS 117           HZ2      LYS 117  12.591  -9.950  -5.560
  964    HZ3  LYS 117           HZ3      LYS 117  12.116 -10.827  -4.190
  965    H    LEU 118           H        LEU 118  10.239 -11.532 -12.377
  966    HA   LEU 118           HA       LEU 118  12.100 -13.587 -11.891
  967    HB2  LEU 118           HB2      LEU 118  11.357 -12.385 -14.553
  968    HB3  LEU 118           HB3      LEU 118  12.190 -13.904 -14.315
  969    HG   LEU 118           HG       LEU 118   9.310 -13.253 -13.806
  970   HD11  LEU 118          HD11      LEU 118  10.770 -15.417 -15.317
  971   HD12  LEU 118          HD12      LEU 118  10.019 -13.986 -16.023
  972   HD13  LEU 118          HD13      LEU 118   9.015 -15.210 -15.240
  973   HD21  LEU 118          HD21      LEU 118   9.032 -15.395 -12.721
  974   HD22  LEU 118          HD22      LEU 118  10.191 -14.433 -11.806
  975   HD23  LEU 118          HD23      LEU 118  10.757 -15.728 -12.860
  976    H    LEU 119           H        LEU 119  12.426 -10.480 -13.516
  977    HA   LEU 119           HA       LEU 119  15.099 -10.709 -14.327
  978    HB2  LEU 119           HB2      LEU 119  13.262  -8.418 -13.759
  979    HB3  LEU 119           HB3      LEU 119  14.962  -8.103 -14.060
  980    HG   LEU 119           HG       LEU 119  13.556  -7.831 -16.084
  981   HD11  LEU 119          HD11      LEU 119  14.991  -9.107 -17.589
  982   HD12  LEU 119          HD12      LEU 119  15.560 -10.076 -16.228
  983   HD13  LEU 119          HD13      LEU 119  15.922  -8.351 -16.295
  984   HD21  LEU 119          HD21      LEU 119  12.728  -9.859 -17.232
  985   HD22  LEU 119          HD22      LEU 119  11.881  -9.539 -15.720
  986   HD23  LEU 119          HD23      LEU 119  13.108 -10.805 -15.793
  987    H    ALA 120           H        ALA 120  13.678  -9.976 -11.270
  988    HA   ALA 120           HA       ALA 120  16.012  -8.790 -10.112
  989    HB1  ALA 120           HB1      ALA 120  13.566  -9.865  -8.730
  990    HB2  ALA 120           HB2      ALA 120  13.694  -8.253  -9.434
  991    HB3  ALA 120           HB3      ALA 120  14.738  -8.713  -8.084
  992    H    LEU 121           H        LEU 121  14.468 -11.971 -10.016
  993    HA   LEU 121           HA       LEU 121  16.417 -13.130  -8.277
  994    HB2  LEU 121           HB2      LEU 121  14.238 -14.177 -10.035
  995    HB3  LEU 121           HB3      LEU 121  15.435 -15.286  -9.402
  996    HG   LEU 121           HG       LEU 121  14.797 -14.680  -7.121
  997   HD11  LEU 121          HD11      LEU 121  12.851 -13.327  -6.676
  998   HD12  LEU 121          HD12      LEU 121  12.643 -13.013  -8.399
  999   HD13  LEU 121          HD13      LEU 121  14.055 -12.381  -7.550
 1000   HD21  LEU 121          HD21      LEU 121  12.590 -15.747  -7.157
 1001   HD22  LEU 121          HD22      LEU 121  13.739 -16.561  -8.220
 1002   HD23  LEU 121          HD23      LEU 121  12.513 -15.495  -8.903
 1003    H    GLY 122           H        GLY 122  16.226 -12.465 -11.640
 1004    HA2  GLY 122           HA2      GLY 122  17.800 -12.776 -13.312
 1005    HA3  GLY 122           HA3      GLY 122  18.821 -13.625 -12.153
 1006    H    LEU 123           H        LEU 123  15.467 -14.406 -12.777
 1007    HA   LEU 123           HA       LEU 123  16.153 -17.132 -13.405
 1008    HB2  LEU 123           HB2      LEU 123  13.527 -15.654 -13.319
 1009    HB3  LEU 123           HB3      LEU 123  13.665 -17.365 -13.687
 1010    HG   LEU 123           HG       LEU 123  14.447 -16.038 -11.091
 1011   HD11  LEU 123          HD11      LEU 123  12.168 -17.880 -11.790
 1012   HD12  LEU 123          HD12      LEU 123  12.052 -16.172 -11.360
 1013   HD13  LEU 123          HD13      LEU 123  12.591 -17.347 -10.164
 1014   HD21  LEU 123          HD21      LEU 123  14.543 -18.943 -11.904
 1015   HD22  LEU 123          HD22      LEU 123  14.805 -18.328 -10.272
 1016   HD23  LEU 123          HD23      LEU 123  15.926 -17.902 -11.563
 1017    H    VAL 124           H        VAL 124  15.408 -14.237 -15.012
 1018    HA   VAL 124           HA       VAL 124  15.898 -15.515 -17.608
 1019    HB   VAL 124           HB       VAL 124  14.259 -13.999 -18.672
 1020   HG11  VAL 124          HG11      VAL 124  13.685 -16.336 -18.105
 1021   HG12  VAL 124          HG12      VAL 124  12.286 -15.265 -18.099
 1022   HG13  VAL 124          HG13      VAL 124  13.013 -15.772 -16.575
 1023   HG21  VAL 124          HG21      VAL 124  13.450 -13.383 -15.833
 1024   HG22  VAL 124          HG22      VAL 124  12.569 -12.884 -17.275
 1025   HG23  VAL 124          HG23      VAL 124  14.190 -12.263 -16.975
 1026    H    ALA 125           H        ALA 125  16.445 -13.862 -19.255
 1027    HA   ALA 125           HA       ALA 125  18.182 -11.816 -18.044
 1028    HB1  ALA 125           HB1      ALA 125  18.127 -12.903 -20.860
 1029    HB2  ALA 125           HB2      ALA 125  19.267 -13.354 -19.593
 1030    HB3  ALA 125           HB3      ALA 125  19.272 -11.714 -20.240
 1031    H    GLU 126           H        GLU 126  15.279 -12.241 -19.752
 1032    HA   GLU 126           HA       GLU 126  14.753  -9.413 -19.869
 1033    HB2  GLU 126           HB2      GLU 126  14.391  -9.350 -22.285
 1034    HB3  GLU 126           HB3      GLU 126  16.065  -9.745 -21.915
 1035    HG2  GLU 126           HG2      GLU 126  15.588 -12.111 -22.312
 1036    HG3  GLU 126           HG3      GLU 126  13.920 -11.706 -22.694
 1037    H    ARG 127           H        ARG 127  12.537  -9.171 -21.176
 1038    HA   ARG 127           HA       ARG 127  10.698 -10.906 -19.809
 1039    HB2  ARG 127           HB2      ARG 127  10.458  -8.457 -21.483
 1040    HB3  ARG 127           HB3      ARG 127   9.042  -9.478 -21.302
 1041    HG2  ARG 127           HG2      ARG 127   9.006  -7.695 -19.681
 1042    HG3  ARG 127           HG3      ARG 127   9.181  -9.249 -18.876
 1043    HD2  ARG 127           HD2      ARG 127  10.630  -7.574 -17.868
 1044    HD3  ARG 127           HD3      ARG 127  11.580  -8.847 -18.631
 1045    HE   ARG 127           HE       ARG 127  11.505  -7.033 -20.583
 1046   HH11  ARG 127          HH11      ARG 127  12.097  -6.593 -17.157
 1047   HH12  ARG 127          HH12      ARG 127  13.219  -5.295 -17.388
 1048   HH21  ARG 127          HH21      ARG 127  12.991  -5.329 -20.889
 1049   HH22  ARG 127          HH22      ARG 127  13.719  -4.566 -19.510
 1050    H    ARG 128           H        ARG 128  12.030 -10.711 -22.973
 1051    HA   ARG 128           HA       ARG 128  10.128 -11.964 -24.548
 1052    HB2  ARG 128           HB2      ARG 128  11.856 -11.048 -25.733
 1053    HB3  ARG 128           HB3      ARG 128  13.078 -11.634 -24.623
 1054    HG2  ARG 128           HG2      ARG 128  12.797 -13.901 -25.569
 1055    HG3  ARG 128           HG3      ARG 128  11.655 -13.230 -26.741
 1056    HD2  ARG 128           HD2      ARG 128  13.337 -11.815 -27.676
 1057    HD3  ARG 128           HD3      ARG 128  14.470 -12.221 -26.392
 1058    HE   ARG 128           HE       ARG 128  13.536 -14.298 -28.254
 1059   HH11  ARG 128          HH11      ARG 128  16.115 -12.420 -26.807
 1060   HH12  ARG 128          HH12      ARG 128  17.375 -13.295 -27.609
 1061   HH21  ARG 128          HH21      ARG 128  15.202 -15.470 -29.301
 1062   HH22  ARG 128          HH22      ARG 128  16.858 -15.036 -29.022
 1063    H    GLU 129           H        GLU 129  12.439 -13.450 -22.330
 1064    HA   GLU 129           HA       GLU 129  12.190 -16.071 -23.381
 1065    HB2  GLU 129           HB2      GLU 129  13.044 -15.237 -20.610
 1066    HB3  GLU 129           HB3      GLU 129  13.323 -16.798 -21.364
 1067    HG2  GLU 129           HG2      GLU 129  14.612 -15.563 -23.148
 1068    HG3  GLU 129           HG3      GLU 129  14.523 -14.151 -22.096
 1069    H    LEU 130           H        LEU 130  10.277 -14.214 -21.201
 1070    HA   LEU 130           HA       LEU 130   8.859 -16.606 -20.303
 1071    HB2  LEU 130           HB2      LEU 130   7.654 -14.779 -18.854
 1072    HB3  LEU 130           HB3      LEU 130   9.215 -15.424 -18.390
 1073    HG   LEU 130           HG       LEU 130   9.125 -12.943 -20.053
 1074   HD11  LEU 130          HD11      LEU 130   7.531 -12.455 -18.330
 1075   HD12  LEU 130          HD12      LEU 130   9.041 -11.620 -17.964
 1076   HD13  LEU 130          HD13      LEU 130   8.610 -13.090 -17.090
 1077   HD21  LEU 130          HD21      LEU 130  10.935 -13.907 -17.833
 1078   HD22  LEU 130          HD22      LEU 130  11.168 -12.452 -18.799
 1079   HD23  LEU 130          HD23      LEU 130  11.273 -14.041 -19.561
 1080    H    TYR 131           H        TYR 131   8.749 -14.934 -22.904
 1081    HA   TYR 131           HA       TYR 131   5.814 -15.068 -23.065
 1082    HB2  TYR 131           HB2      TYR 131   7.666 -13.314 -24.708
 1083    HB3  TYR 131           HB3      TYR 131   5.925 -13.437 -24.922
 1084    HD1  TYR 131           HD1      TYR 131   7.873 -11.021 -24.191
 1085    HD2  TYR 131           HD2      TYR 131   5.145 -13.428 -21.990
 1086    HE1  TYR 131           HE1      TYR 131   7.549  -9.183 -22.588
 1087    HE2  TYR 131           HE2      TYR 131   4.816 -11.604 -20.385
 1088    HH   TYR 131           HH       TYR 131   5.966  -9.623 -19.598
 1089    H    LYS 132           H        LYS 132   5.614 -17.098 -23.719
 1090    HA   LYS 132           HA       LYS 132   7.620 -18.600 -24.853
 1091    HB2  LYS 132           HB2      LYS 132   4.656 -19.095 -24.759
 1092    HB3  LYS 132           HB3      LYS 132   5.824 -20.298 -25.280
 1093    HG2  LYS 132           HG2      LYS 132   5.866 -18.972 -22.578
 1094    HG3  LYS 132           HG3      LYS 132   5.096 -20.523 -22.910
 1095    HD2  LYS 132           HD2      LYS 132   8.028 -19.904 -23.318
 1096    HD3  LYS 132           HD3      LYS 132   7.349 -20.783 -21.948
 1097    HE2  LYS 132           HE2      LYS 132   6.498 -22.498 -23.493
 1098    HE3  LYS 132           HE3      LYS 132   7.222 -21.627 -24.845
 1099    HZ1  LYS 132           HZ1      LYS 132   8.586 -23.492 -24.039
 1100    HZ2  LYS 132           HZ2      LYS 132   8.747 -22.718 -22.543
 1101    HZ3  LYS 132           HZ3      LYS 132   9.388 -22.008 -23.938
 1102    H    LYS 133           H        LYS 133   8.537 -18.054 -26.687
 1103    HA   LYS 133           HA       LYS 133   6.987 -17.819 -29.121
 1104    HB2  LYS 133           HB2      LYS 133   9.980 -18.030 -28.706
 1105    HB3  LYS 133           HB3      LYS 133   9.187 -17.671 -30.232
 1106    HG2  LYS 133           HG2      LYS 133   9.120 -15.951 -27.763
 1107    HG3  LYS 133           HG3      LYS 133  10.092 -15.662 -29.207
 1108    HD2  LYS 133           HD2      LYS 133   8.040 -15.460 -30.534
 1109    HD3  LYS 133           HD3      LYS 133   7.076 -15.732 -29.082
 1110    HE2  LYS 133           HE2      LYS 133   8.117 -13.714 -28.081
 1111    HE3  LYS 133           HE3      LYS 133   8.929 -13.416 -29.619
 1112    HZ1  LYS 133           HZ1      LYS 133   6.917 -12.121 -29.462
 1113    HZ2  LYS 133           HZ2      LYS 133   5.997 -13.510 -29.179
 1114    HZ3  LYS 133           HZ3      LYS 133   6.746 -13.285 -30.678
 1115    H    ARG 134           H        ARG 134   6.760 -19.449 -30.633
 1116    HA   ARG 134           HA       ARG 134   7.129 -22.110 -29.759
 1117    HB2  ARG 134           HB2      ARG 134   6.310 -22.841 -31.915
 1118    HB3  ARG 134           HB3      ARG 134   5.320 -21.525 -31.316
 1119    HG2  ARG 134           HG2      ARG 134   7.488 -21.190 -33.383
 1120    HG3  ARG 134           HG3      ARG 134   5.793 -21.481 -33.767
 1121    HD2  ARG 134           HD2      ARG 134   5.322 -19.406 -32.330
 1122    HD3  ARG 134           HD3      ARG 134   7.050 -19.082 -32.480
 1123    HE   ARG 134           HE       ARG 134   6.382 -19.387 -35.032
 1124   HH11  ARG 134          HH11      ARG 134   4.820 -17.576 -32.467
 1125   HH12  ARG 134          HH12      ARG 134   4.146 -16.395 -33.539
 1126   HH21  ARG 134          HH21      ARG 134   5.508 -17.829 -36.440
 1127   HH22  ARG 134          HH22      ARG 134   4.545 -16.533 -35.803
 1128    H    GLN 135           H        GLN 135   9.335 -21.959 -29.186
 1129    HA   GLN 135           HA       GLN 135  11.054 -22.803 -31.393
 1130    HB2  GLN 135           HB2      GLN 135  12.979 -21.694 -30.232
 1131    HB3  GLN 135           HB3      GLN 135  11.803 -20.583 -30.915
 1132    HG2  GLN 135           HG2      GLN 135  10.822 -20.281 -28.678
 1133    HG3  GLN 135           HG3      GLN 135  12.054 -21.353 -28.013
 1134   HE21  GLN 135          HE21      GLN 135  12.879 -19.731 -26.675
 1135   HE22  GLN 135          HE22      GLN 135  13.830 -18.431 -27.302
 1136    H    LYS 136           H        LYS 136  11.394 -24.920 -31.041
 1137    HA   LYS 136           HA       LYS 136  11.760 -25.795 -28.278
 1138    HB2  LYS 136           HB2      LYS 136  11.184 -27.290 -30.804
 1139    HB3  LYS 136           HB3      LYS 136  11.881 -28.122 -29.422
 1140    HG2  LYS 136           HG2      LYS 136   9.923 -27.090 -28.097
 1141    HG3  LYS 136           HG3      LYS 136   9.198 -26.834 -29.685
 1142    HD2  LYS 136           HD2      LYS 136   9.372 -29.205 -30.174
 1143    HD3  LYS 136           HD3      LYS 136  10.173 -29.487 -28.632
 1144    HE2  LYS 136           HE2      LYS 136   7.849 -30.122 -28.474
 1145    HE3  LYS 136           HE3      LYS 136   8.148 -28.706 -27.468
 1146    HZ1  LYS 136           HZ1      LYS 136   6.095 -28.523 -28.742
 1147    HZ2  LYS 136           HZ2      LYS 136   6.962 -28.645 -30.187
 1148    HZ3  LYS 136           HZ3      LYS 136   7.196 -27.316 -29.169
 1149    H    LYS 137           H        LYS 137  13.684 -24.536 -28.288
 1150    HA   LYS 137           HA       LYS 137  15.960 -26.253 -28.695
 1151    HB2  LYS 137           HB2      LYS 137  17.332 -24.412 -29.675
 1152    HB3  LYS 137           HB3      LYS 137  16.084 -25.005 -30.752
 1153    HG2  LYS 137           HG2      LYS 137  16.033 -22.701 -31.039
 1154    HG3  LYS 137           HG3      LYS 137  14.689 -23.018 -29.946
 1155    HD2  LYS 137           HD2      LYS 137  15.913 -21.066 -29.203
 1156    HD3  LYS 137           HD3      LYS 137  16.120 -22.377 -28.042
 1157    HE2  LYS 137           HE2      LYS 137  18.231 -21.251 -28.400
 1158    HE3  LYS 137           HE3      LYS 137  18.312 -22.888 -29.038
 1159    HZ1  LYS 137           HZ1      LYS 137  17.862 -20.435 -30.646
 1160    HZ2  LYS 137           HZ2      LYS 137  17.977 -22.008 -31.259
 1161    HZ3  LYS 137           HZ3      LYS 137  19.320 -21.281 -30.535
 1162    H    LEU 138           H        LEU 138  17.728 -25.622 -27.274
 1163    HA   LEU 138           HA       LEU 138  17.000 -25.082 -24.712
 1164    HB2  LEU 138           HB2      LEU 138  19.617 -24.280 -25.984
 1165    HB3  LEU 138           HB3      LEU 138  19.340 -24.466 -24.264
 1166    HG   LEU 138           HG       LEU 138  19.176 -26.694 -26.300
 1167   HD11  LEU 138          HD11      LEU 138  21.244 -27.497 -25.286
 1168   HD12  LEU 138          HD12      LEU 138  21.294 -26.075 -24.245
 1169   HD13  LEU 138          HD13      LEU 138  21.460 -25.894 -25.990
 1170   HD21  LEU 138          HD21      LEU 138  19.085 -28.156 -24.327
 1171   HD22  LEU 138          HD22      LEU 138  17.692 -27.078 -24.416
 1172   HD23  LEU 138          HD23      LEU 138  19.004 -26.733 -23.288
 1173    H    ALA 139           H        ALA 139  15.780 -23.458 -24.071
 1174    HA   ALA 139           HA       ALA 139  15.843 -20.923 -25.405
 1175    HB1  ALA 139           HB1      ALA 139  14.197 -21.767 -23.029
 1176    HB2  ALA 139           HB2      ALA 139  13.729 -21.971 -24.716
 1177    HB3  ALA 139           HB3      ALA 139  13.929 -20.351 -24.046
 1178    H    SER 140           H        SER 140  18.000 -20.327 -24.833
 1179    HA   SER 140           HA       SER 140  17.966 -18.807 -22.321
 1180    HB2  SER 140           HB2      SER 140  20.412 -20.107 -23.554
 1181    HB3  SER 140           HB3      SER 140  20.354 -19.191 -22.047
 1182    HG   SER 140           HG       SER 140  18.514 -21.084 -21.900
 1183    H    SER 141           H        SER 141  17.770 -16.745 -22.880
 1184    HA   SER 141           HA       SER 141  18.794 -15.890 -25.490
 1185    HB2  SER 141           HB2      SER 141  16.993 -14.354 -23.603
 1186    HB3  SER 141           HB3      SER 141  17.273 -14.039 -25.317
 1187    HG   SER 141           HG       SER 141  15.955 -16.263 -24.150
  Start of MODEL   19
    1    H1   ASP   1           HT1      ASP   1 -22.135  11.296  -5.866
    2    H2   ASP   1           HT2      ASP   1 -20.789  11.018  -4.880
    3    H3   ASP   1           HT3      ASP   1 -21.521   9.726  -5.683
    4    HA   ASP   1           HA       ASP   1 -20.057  11.980  -6.897
    5    HB2  ASP   1           HB2      ASP   1 -19.186   9.266  -7.541
    6    HB3  ASP   1           HB3      ASP   1 -18.242  10.656  -7.017
    7    HA   PRO   2           HA       PRO   2 -21.553   9.472 -10.594
    8    HB2  PRO   2           HB2      PRO   2 -22.990   7.215 -10.382
    9    HB3  PRO   2           HB3      PRO   2 -21.232   7.233 -10.196
   10    HG2  PRO   2           HG2      PRO   2 -23.356   7.095  -8.111
   11    HG3  PRO   2           HG3      PRO   2 -21.788   6.276  -8.171
   12    HD2  PRO   2           HD2      PRO   2 -22.341   8.560  -6.708
   13    HD3  PRO   2           HD3      PRO   2 -20.721   8.029  -7.194
   14    H    SER   3           H        SER   3 -24.139   9.120  -8.146
   15    HA   SER   3           HA       SER   3 -26.016  10.187 -10.141
   16    HB2  SER   3           HB2      SER   3 -26.579   7.953  -9.269
   17    HB3  SER   3           HB3      SER   3 -26.600   8.596  -7.630
   18    HG   SER   3           HG       SER   3 -28.235   9.692  -9.656
   19    H    ARG   4           H        ARG   4 -25.412  10.301  -6.621
   20    HA   ARG   4           HA       ARG   4 -26.303  13.109  -6.677
   21    HB2  ARG   4           HB2      ARG   4 -26.731  11.111  -4.447
   22    HB3  ARG   4           HB3      ARG   4 -27.185  12.806  -4.399
   23    HG2  ARG   4           HG2      ARG   4 -28.750  12.397  -6.275
   24    HG3  ARG   4           HG3      ARG   4 -28.337  10.682  -6.194
   25    HD2  ARG   4           HD2      ARG   4 -29.103  10.617  -3.867
   26    HD3  ARG   4           HD3      ARG   4 -29.541  12.320  -3.967
   27    HE   ARG   4           HE       ARG   4 -30.822  10.762  -5.987
   28   HH11  ARG   4          HH11      ARG   4 -30.973  11.746  -2.631
   29   HH12  ARG   4          HH12      ARG   4 -32.669  11.416  -2.473
   30   HH21  ARG   4          HH21      ARG   4 -33.071  10.325  -5.787
   31   HH22  ARG   4          HH22      ARG   4 -33.859  10.597  -4.265
   32    H    ARG   5           H        ARG   5 -25.539  14.223  -4.552
   33    HA   ARG   5           HA       ARG   5 -22.722  14.127  -4.372
   34    HB2  ARG   5           HB2      ARG   5 -24.203  16.096  -3.824
   35    HB3  ARG   5           HB3      ARG   5 -24.659  15.270  -2.345
   36    HG2  ARG   5           HG2      ARG   5 -21.780  15.809  -2.932
   37    HG3  ARG   5           HG3      ARG   5 -22.814  17.086  -2.294
   38    HD2  ARG   5           HD2      ARG   5 -22.343  14.393  -1.019
   39    HD3  ARG   5           HD3      ARG   5 -21.604  15.913  -0.518
   40    HE   ARG   5           HE       ARG   5 -24.500  15.895  -0.534
   41   HH11  ARG   5          HH11      ARG   5 -21.588  15.413   1.342
   42   HH12  ARG   5          HH12      ARG   5 -22.387  15.610   2.870
   43   HH21  ARG   5          HH21      ARG   5 -25.555  16.144   1.496
   44   HH22  ARG   5          HH22      ARG   5 -24.626  16.026   2.958
   45    H    ALA   6           H        ALA   6 -21.412  12.922  -3.125
   46    HA   ALA   6           HA       ALA   6 -22.286  10.508  -2.076
   47    HB1  ALA   6           HB1      ALA   6 -19.998  10.854  -2.780
   48    HB2  ALA   6           HB2      ALA   6 -20.044  10.293  -1.107
   49    HB3  ALA   6           HB3      ALA   6 -19.742  11.994  -1.460
   50    HA   PRO   7           HA       PRO   7 -24.081  11.735   1.859
   51    HB2  PRO   7           HB2      PRO   7 -23.832   8.806   2.251
   52    HB3  PRO   7           HB3      PRO   7 -25.248   9.846   2.440
   53    HG2  PRO   7           HG2      PRO   7 -25.010   8.202   0.351
   54    HG3  PRO   7           HG3      PRO   7 -25.733   9.815   0.177
   55    HD2  PRO   7           HD2      PRO   7 -23.020   8.848  -0.609
   56    HD3  PRO   7           HD3      PRO   7 -24.089  10.010  -1.421
   57    H    THR   8           H        THR   8 -23.593  10.972   4.186
   58    HA   THR   8           HA       THR   8 -20.683  10.772   4.504
   59    HB   THR   8           HB       THR   8 -22.732  11.691   6.531
   60    HG1  THR   8           HG1      THR   8 -21.217  13.050   4.574
   61   HG21  THR   8          HG21      THR   8 -19.720  11.947   6.504
   62   HG22  THR   8          HG22      THR   8 -20.645  10.836   7.513
   63   HG23  THR   8          HG23      THR   8 -20.806  12.576   7.742
   64    H    TRP   9           H        TRP   9 -19.847   8.949   5.295
   65    HA   TRP   9           HA       TRP   9 -21.560   6.783   6.075
   66    HB2  TRP   9           HB2      TRP   9 -18.563   7.085   5.931
   67    HB3  TRP   9           HB3      TRP   9 -19.334   5.626   6.542
   68    HD1  TRP   9           HD1      TRP   9 -18.868   7.624   3.301
   69    HE1  TRP   9           HE1      TRP   9 -19.359   6.068   1.313
   70    HE3  TRP   9           HE3      TRP   9 -20.579   3.542   5.856
   71    HZ2  TRP   9           HZ2      TRP   9 -20.333   3.461   0.878
   72    HZ3  TRP   9           HZ3      TRP   9 -21.272   1.557   4.574
   73    HH2  TRP   9           HH2      TRP   9 -21.151   1.518   2.140
   74    H    SER  10           H        SER  10 -22.577   7.169   7.959
   75    HA   SER  10           HA       SER  10 -21.338   8.127  10.316
   76    HB2  SER  10           HB2      SER  10 -23.781   6.349  10.086
   77    HB3  SER  10           HB3      SER  10 -23.377   7.428  11.420
   78    HG   SER  10           HG       SER  10 -24.744   8.623  10.249
   79    HA   PRO  11           HA       PRO  11 -18.948   4.725  11.857
   80    HB2  PRO  11           HB2      PRO  11 -20.649   4.963  14.308
   81    HB3  PRO  11           HB3      PRO  11 -18.888   4.850  14.167
   82    HG2  PRO  11           HG2      PRO  11 -20.027   7.197  14.633
   83    HG3  PRO  11           HG3      PRO  11 -18.671   7.073  13.500
   84    HD2  PRO  11           HD2      PRO  11 -21.578   7.429  12.946
   85    HD3  PRO  11           HD3      PRO  11 -20.172   8.064  12.067
   86    H    GLU  12           H        GLU  12 -22.423   4.538  12.657
   87    HA   GLU  12           HA       GLU  12 -22.585   1.754  12.949
   88    HB2  GLU  12           HB2      GLU  12 -24.799   3.406  11.743
   89    HB3  GLU  12           HB3      GLU  12 -24.937   1.957  12.723
   90    HG2  GLU  12           HG2      GLU  12 -25.565   3.594  14.198
   91    HG3  GLU  12           HG3      GLU  12 -23.851   3.413  14.570
   92    H    GLU  13           H        GLU  13 -22.862   3.806  10.098
   93    HA   GLU  13           HA       GLU  13 -23.654   1.704   8.349
   94    HB2  GLU  13           HB2      GLU  13 -23.976   4.277   8.103
   95    HB3  GLU  13           HB3      GLU  13 -22.362   4.245   7.409
   96    HG2  GLU  13           HG2      GLU  13 -24.025   4.165   5.664
   97    HG3  GLU  13           HG3      GLU  13 -23.127   2.647   5.718
   98    H    GLU  14           H        GLU  14 -20.585   3.148   9.282
   99    HA   GLU  14           HA       GLU  14 -19.010   1.744   7.363
  100    HB2  GLU  14           HB2      GLU  14 -18.210   2.912  10.036
  101    HB3  GLU  14           HB3      GLU  14 -17.094   2.342   8.803
  102    HG2  GLU  14           HG2      GLU  14 -18.043   4.043   7.254
  103    HG3  GLU  14           HG3      GLU  14 -18.982   4.673   8.609
  104    H    ALA  15           H        ALA  15 -20.117   1.063  10.634
  105    HA   ALA  15           HA       ALA  15 -18.707  -1.380  10.963
  106    HB1  ALA  15           HB1      ALA  15 -21.322  -0.531  12.208
  107    HB2  ALA  15           HB2      ALA  15 -19.718  -0.160  12.843
  108    HB3  ALA  15           HB3      ALA  15 -20.274  -1.834  12.769
  109    H    HIS  16           H        HIS  16 -21.637  -0.475   9.385
  110    HA   HIS  16           HA       HIS  16 -22.546  -3.119   8.824
  111    HB2  HIS  16           HB2      HIS  16 -24.149  -1.293   8.971
  112    HB3  HIS  16           HB3      HIS  16 -23.332  -0.434   7.672
  113    HD1  HIS  16           HD1      HIS  16 -25.122  -0.408   5.936
  114    HD2  HIS  16           HD2      HIS  16 -24.470  -4.212   7.495
  115    HE1  HIS  16           HE1      HIS  16 -26.464  -1.985   4.497
  116    HE2  HIS  16           HE2      HIS  16 -26.136  -4.259   5.520
  117    H    LEU  17           H        LEU  17 -20.600  -0.680   7.248
  118    HA   LEU  17           HA       LEU  17 -20.327  -1.801   4.710
  119    HB2  LEU  17           HB2      LEU  17 -19.456   0.407   5.349
  120    HB3  LEU  17           HB3      LEU  17 -18.268  -0.357   6.386
  121    HG   LEU  17           HG       LEU  17 -17.369  -1.479   4.282
  122   HD11  LEU  17          HD11      LEU  17 -19.192  -1.152   2.788
  123   HD12  LEU  17          HD12      LEU  17 -17.830  -0.200   2.201
  124   HD13  LEU  17          HD13      LEU  17 -19.158   0.592   3.044
  125   HD21  LEU  17          HD21      LEU  17 -17.201   1.516   4.526
  126   HD22  LEU  17          HD22      LEU  17 -16.054   0.476   3.680
  127   HD23  LEU  17          HD23      LEU  17 -16.239   0.347   5.429
  128    H    ARG  18           H        ARG  18 -18.285  -2.240   7.588
  129    HA   ARG  18           HA       ARG  18 -16.827  -4.403   6.463
  130    HB2  ARG  18           HB2      ARG  18 -15.899  -4.701   8.711
  131    HB3  ARG  18           HB3      ARG  18 -15.860  -3.012   8.230
  132    HG2  ARG  18           HG2      ARG  18 -18.024  -2.756   9.536
  133    HG3  ARG  18           HG3      ARG  18 -17.665  -4.346  10.211
  134    HD2  ARG  18           HD2      ARG  18 -15.860  -1.935  10.350
  135    HD3  ARG  18           HD3      ARG  18 -16.888  -2.514  11.656
  136    HE   ARG  18           HE       ARG  18 -15.325  -4.661  11.001
  137   HH11  ARG  18          HH11      ARG  18 -14.698  -1.354  11.926
  138   HH12  ARG  18          HH12      ARG  18 -13.245  -1.727  12.794
  139   HH21  ARG  18          HH21      ARG  18 -13.376  -5.170  12.110
  140   HH22  ARG  18          HH22      ARG  18 -12.485  -3.901  12.890
  141    H    GLU  19           H        GLU  19 -19.779  -4.077   8.279
  142    HA   GLU  19           HA       GLU  19 -20.214  -6.609   9.241
  143    HB2  GLU  19           HB2      GLU  19 -21.784  -4.830   9.661
  144    HB3  GLU  19           HB3      GLU  19 -22.161  -4.713   7.948
  145    HG2  GLU  19           HG2      GLU  19 -23.954  -5.819   9.045
  146    HG3  GLU  19           HG3      GLU  19 -23.101  -6.983   8.039
  147    H    LEU  20           H        LEU  20 -20.930  -5.341   6.032
  148    HA   LEU  20           HA       LEU  20 -21.913  -7.800   4.976
  149    HB2  LEU  20           HB2      LEU  20 -22.018  -5.130   4.310
  150    HB3  LEU  20           HB3      LEU  20 -20.962  -5.786   3.076
  151    HG   LEU  20           HG       LEU  20 -23.666  -6.970   3.656
  152   HD11  LEU  20          HD11      LEU  20 -22.976  -4.829   1.650
  153   HD12  LEU  20          HD12      LEU  20 -23.935  -4.600   3.110
  154   HD13  LEU  20          HD13      LEU  20 -24.530  -5.640   1.820
  155   HD21  LEU  20          HD21      LEU  20 -21.855  -7.067   1.249
  156   HD22  LEU  20          HD22      LEU  20 -23.438  -7.832   1.385
  157   HD23  LEU  20          HD23      LEU  20 -22.108  -8.370   2.409
  158    H    TYR  21           H        TYR  21 -18.820  -6.187   5.098
  159    HA   TYR  21           HA       TYR  21 -17.514  -7.706   3.080
  160    HB2  TYR  21           HB2      TYR  21 -16.596  -5.563   3.774
  161    HB3  TYR  21           HB3      TYR  21 -16.420  -6.136   5.428
  162    HD1  TYR  21           HD1      TYR  21 -14.356  -6.914   6.114
  163    HD2  TYR  21           HD2      TYR  21 -15.277  -6.984   1.964
  164    HE1  TYR  21           HE1      TYR  21 -12.068  -7.670   5.625
  165    HE2  TYR  21           HE2      TYR  21 -12.995  -7.739   1.464
  166    HH   TYR  21           HH       TYR  21 -10.811  -7.753   2.420
  167    H    LEU  22           H        LEU  22 -17.532  -7.847   6.610
  168    HA   LEU  22           HA       LEU  22 -15.825 -10.080   6.842
  169    HB2  LEU  22           HB2      LEU  22 -17.931  -9.177   8.801
  170    HB3  LEU  22           HB3      LEU  22 -16.494 -10.110   9.156
  171    HG   LEU  22           HG       LEU  22 -16.524  -7.240   8.229
  172   HD11  LEU  22          HD11      LEU  22 -15.779  -6.706  10.482
  173   HD12  LEU  22          HD12      LEU  22 -15.931  -8.403  10.943
  174   HD13  LEU  22          HD13      LEU  22 -17.364  -7.477  10.496
  175   HD21  LEU  22          HD21      LEU  22 -14.215  -8.926   9.170
  176   HD22  LEU  22          HD22      LEU  22 -14.159  -7.230   8.685
  177   HD23  LEU  22          HD23      LEU  22 -14.535  -8.476   7.495
  178    H    ALA  23           H        ALA  23 -19.170  -9.780   6.122
  179    HA   ALA  23           HA       ALA  23 -19.963 -12.394   6.950
  180    HB1  ALA  23           HB1      ALA  23 -21.549 -10.527   6.761
  181    HB2  ALA  23           HB2      ALA  23 -22.045 -11.918   5.796
  182    HB3  ALA  23           HB3      ALA  23 -21.313 -10.518   5.012
  183    H    ASN  24           H        ASN  24 -18.799 -11.005   3.906
  184    HA   ASN  24           HA       ASN  24 -19.039 -13.689   2.708
  185    HB2  ASN  24           HB2      ASN  24 -19.202 -11.003   1.324
  186    HB3  ASN  24           HB3      ASN  24 -19.313 -12.571   0.534
  187   HD21  ASN  24          HD21      ASN  24 -20.920 -10.255   2.560
  188   HD22  ASN  24          HD22      ASN  24 -22.494 -10.968   2.475
  189    H    LYS  25           H        LYS  25 -16.737 -12.126   4.117
  190    HA   LYS  25           HA       LYS  25 -14.824 -11.595   2.061
  191    HB2  LYS  25           HB2      LYS  25 -13.222 -11.249   3.847
  192    HB3  LYS  25           HB3      LYS  25 -14.741 -10.473   4.265
  193    HG2  LYS  25           HG2      LYS  25 -15.298 -12.304   5.759
  194    HG3  LYS  25           HG3      LYS  25 -13.817 -13.146   5.301
  195    HD2  LYS  25           HD2      LYS  25 -13.922 -10.437   6.625
  196    HD3  LYS  25           HD3      LYS  25 -13.639 -11.956   7.469
  197    HE2  LYS  25           HE2      LYS  25 -11.895 -10.745   5.323
  198    HE3  LYS  25           HE3      LYS  25 -11.540 -10.801   7.046
  199    HZ1  LYS  25           HZ1      LYS  25 -11.635 -13.279   6.835
  200    HZ2  LYS  25           HZ2      LYS  25 -10.343 -12.542   6.035
  201    HZ3  LYS  25           HZ3      LYS  25 -11.679 -13.079   5.154
  202    H    ASP  26           H        ASP  26 -15.795 -14.419   3.719
  203    HA   ASP  26           HA       ASP  26 -13.285 -15.813   3.159
  204    HB2  ASP  26           HB2      ASP  26 -14.294 -17.668   4.482
  205    HB3  ASP  26           HB3      ASP  26 -14.150 -16.162   5.382
  206    H    VAL  27           H        VAL  27 -15.872 -15.101   1.410
  207    HA   VAL  27           HA       VAL  27 -16.310 -17.737   0.248
  208    HB   VAL  27           HB       VAL  27 -17.492 -15.086  -0.615
  209   HG11  VAL  27          HG11      VAL  27 -18.300 -17.932  -1.205
  210   HG12  VAL  27          HG12      VAL  27 -17.579 -16.794  -2.343
  211   HG13  VAL  27          HG13      VAL  27 -19.194 -16.496  -1.699
  212   HG21  VAL  27          HG21      VAL  27 -18.104 -15.575   1.699
  213   HG22  VAL  27          HG22      VAL  27 -18.649 -17.183   1.224
  214   HG23  VAL  27          HG23      VAL  27 -19.495 -15.754   0.629
  215    H    GLU  28           H        GLU  28 -14.771 -18.414  -1.091
  216    HA   GLU  28           HA       GLU  28 -13.172 -16.493  -2.575
  217    HB2  GLU  28           HB2      GLU  28 -12.926 -19.494  -2.315
  218    HB3  GLU  28           HB3      GLU  28 -11.790 -18.460  -3.172
  219    HG2  GLU  28           HG2      GLU  28 -11.303 -17.283  -1.075
  220    HG3  GLU  28           HG3      GLU  28 -12.412 -18.361  -0.228
  221    H    GLY  29           H        GLY  29 -13.195 -16.223  -4.735
  222    HA2  GLY  29           HA2      GLY  29 -13.771 -16.705  -6.969
  223    HA3  GLY  29           HA3      GLY  29 -14.828 -17.992  -6.397
  224    H    GLN  30           H        GLN  30 -14.978 -14.995  -4.787
  225    HA   GLN  30           HA       GLN  30 -17.395 -14.222  -6.253
  226    HB2  GLN  30           HB2      GLN  30 -18.285 -15.353  -4.388
  227    HB3  GLN  30           HB3      GLN  30 -17.061 -14.720  -3.303
  228    HG2  GLN  30           HG2      GLN  30 -18.799 -12.696  -4.531
  229    HG3  GLN  30           HG3      GLN  30 -19.606 -13.820  -3.439
  230   HE21  GLN  30          HE21      GLN  30 -19.985 -12.116  -1.972
  231   HE22  GLN  30          HE22      GLN  30 -18.722 -11.487  -0.983
  232    H    ASP  31           H        ASP  31 -17.754 -12.028  -6.410
  233    HA   ASP  31           HA       ASP  31 -15.597 -10.236  -5.765
  234    HB2  ASP  31           HB2      ASP  31 -18.388  -9.720  -6.818
  235    HB3  ASP  31           HB3      ASP  31 -17.184  -8.460  -6.578
  236    H    VAL  32           H        VAL  32 -15.380 -10.191  -3.525
  237    HA   VAL  32           HA       VAL  32 -17.527  -9.896  -1.729
  238    HB   VAL  32           HB       VAL  32 -15.087 -10.539  -1.202
  239   HG11  VAL  32          HG11      VAL  32 -13.655  -8.688  -0.434
  240   HG12  VAL  32          HG12      VAL  32 -14.834  -7.539  -1.074
  241   HG13  VAL  32          HG13      VAL  32 -13.976  -8.626  -2.167
  242   HG21  VAL  32          HG21      VAL  32 -15.267  -9.673   1.107
  243   HG22  VAL  32          HG22      VAL  32 -16.771 -10.378   0.521
  244   HG23  VAL  32          HG23      VAL  32 -16.587  -8.624   0.585
  245    H    VAL  33           H        VAL  33 -15.754  -7.689  -3.693
  246    HA   VAL  33           HA       VAL  33 -16.419  -5.248  -2.514
  247    HB   VAL  33           HB       VAL  33 -16.284  -5.466  -5.478
  248   HG11  VAL  33          HG11      VAL  33 -15.028  -3.601  -3.487
  249   HG12  VAL  33          HG12      VAL  33 -16.462  -3.291  -4.461
  250   HG13  VAL  33          HG13      VAL  33 -14.890  -3.470  -5.240
  251   HG21  VAL  33          HG21      VAL  33 -14.011  -6.148  -3.643
  252   HG22  VAL  33          HG22      VAL  33 -13.754  -5.553  -5.282
  253   HG23  VAL  33          HG23      VAL  33 -14.628  -7.062  -5.019
  254    H    GLU  34           H        GLU  34 -17.882  -6.835  -5.357
  255    HA   GLU  34           HA       GLU  34 -20.011  -5.034  -5.622
  256    HB2  GLU  34           HB2      GLU  34 -19.170  -6.701  -7.342
  257    HB3  GLU  34           HB3      GLU  34 -20.080  -7.926  -6.469
  258    HG2  GLU  34           HG2      GLU  34 -21.446  -7.247  -8.255
  259    HG3  GLU  34           HG3      GLU  34 -22.117  -6.490  -6.813
  260    H    ALA  35           H        ALA  35 -19.663  -7.994  -3.773
  261    HA   ALA  35           HA       ALA  35 -22.275  -8.432  -2.947
  262    HB1  ALA  35           HB1      ALA  35 -20.454  -9.942  -2.372
  263    HB2  ALA  35           HB2      ALA  35 -21.302  -9.426  -0.914
  264    HB3  ALA  35           HB3      ALA  35 -19.742  -8.714  -1.327
  265    H    ILE  36           H        ILE  36 -19.818  -6.287  -1.589
  266    HA   ILE  36           HA       ILE  36 -21.555  -5.207   0.401
  267    HB   ILE  36           HB       ILE  36 -18.977  -4.042  -0.648
  268   HG12  ILE  36          HG12      ILE  36 -19.376  -5.854   1.737
  269   HG13  ILE  36          HG13      ILE  36 -18.843  -6.429   0.159
  270   HG21  ILE  36          HG21      ILE  36 -20.319  -2.482   0.657
  271   HG22  ILE  36          HG22      ILE  36 -18.877  -2.961   1.553
  272   HG23  ILE  36          HG23      ILE  36 -20.444  -3.661   1.962
  273   HD11  ILE  36          HD11      ILE  36 -16.871  -5.019   0.306
  274   HD12  ILE  36          HD12      ILE  36 -16.981  -6.121   1.677
  275   HD13  ILE  36          HD13      ILE  36 -17.409  -4.422   1.877
  276    H    LEU  37           H        LEU  37 -20.112  -3.846  -2.565
  277    HA   LEU  37           HA       LEU  37 -21.164  -1.309  -2.537
  278    HB2  LEU  37           HB2      LEU  37 -21.181  -2.874  -5.090
  279    HB3  LEU  37           HB3      LEU  37 -20.867  -1.178  -4.868
  280    HG   LEU  37           HG       LEU  37 -18.973  -3.342  -3.968
  281   HD11  LEU  37          HD11      LEU  37 -19.203  -3.511  -6.360
  282   HD12  LEU  37          HD12      LEU  37 -17.675  -2.718  -5.990
  283   HD13  LEU  37          HD13      LEU  37 -19.054  -1.765  -6.535
  284   HD21  LEU  37          HD21      LEU  37 -18.745  -1.178  -2.861
  285   HD22  LEU  37          HD22      LEU  37 -18.595  -0.397  -4.434
  286   HD23  LEU  37          HD23      LEU  37 -17.364  -1.539  -3.896
  287    H    ALA  38           H        ALA  38 -22.734  -4.242  -3.680
  288    HA   ALA  38           HA       ALA  38 -24.955  -2.744  -4.773
  289    HB1  ALA  38           HB1      ALA  38 -25.632  -4.847  -5.735
  290    HB2  ALA  38           HB2      ALA  38 -24.404  -5.693  -4.790
  291    HB3  ALA  38           HB3      ALA  38 -23.922  -4.544  -6.039
  292    H    HIS  39           H        HIS  39 -24.310  -4.634  -1.916
  293    HA   HIS  39           HA       HIS  39 -27.126  -5.225  -1.533
  294    HB2  HIS  39           HB2      HIS  39 -24.631  -6.037  -0.128
  295    HB3  HIS  39           HB3      HIS  39 -26.159  -6.127   0.744
  296    HD1  HIS  39           HD1      HIS  39 -27.784  -7.970   0.092
  297    HD2  HIS  39           HD2      HIS  39 -24.390  -7.828  -2.297
  298    HE1  HIS  39           HE1      HIS  39 -27.826 -10.085  -1.262
  299    HE2  HIS  39           HE2      HIS  39 -25.671 -10.057  -2.566
  300    H    LEU  40           H        LEU  40 -24.832  -2.861  -0.362
  301    HA   LEU  40           HA       LEU  40 -26.856  -2.004   1.559
  302    HB2  LEU  40           HB2      LEU  40 -24.988  -0.251   2.136
  303    HB3  LEU  40           HB3      LEU  40 -24.976  -1.868   2.793
  304    HG   LEU  40           HG       LEU  40 -23.336  -2.473   0.952
  305   HD11  LEU  40          HD11      LEU  40 -23.211   0.523   0.669
  306   HD12  LEU  40          HD12      LEU  40 -23.723  -0.632  -0.566
  307   HD13  LEU  40          HD13      LEU  40 -22.048  -0.617  -0.009
  308   HD21  LEU  40          HD21      LEU  40 -21.441  -1.469   2.160
  309   HD22  LEU  40          HD22      LEU  40 -22.650  -2.152   3.249
  310   HD23  LEU  40          HD23      LEU  40 -22.565  -0.408   3.008
  311    H    ASN  41           H        ASN  41 -28.358  -1.276   0.061
  312    HA   ASN  41           HA       ASN  41 -27.657   0.948  -1.653
  313    HB2  ASN  41           HB2      ASN  41 -30.317  -0.370  -1.084
  314    HB3  ASN  41           HB3      ASN  41 -30.088   0.944  -2.233
  315   HD21  ASN  41          HD21      ASN  41 -29.642  -2.418  -1.602
  316   HD22  ASN  41          HD22      ASN  41 -29.100  -2.857  -3.183
  317    H    THR  42           H        THR  42 -27.143   1.366   1.022
  318    HA   THR  42           HA       THR  42 -29.107   3.355   1.883
  319    HB   THR  42           HB       THR  42 -28.443   1.873   3.650
  320    HG1  THR  42           HG1      THR  42 -27.143   3.430   5.015
  321   HG21  THR  42          HG21      THR  42 -25.576   2.541   2.973
  322   HG22  THR  42          HG22      THR  42 -26.386   1.007   2.663
  323   HG23  THR  42          HG23      THR  42 -26.110   1.535   4.322
  324    H    VAL  43           H        VAL  43 -26.329   3.031   0.076
  325    HA   VAL  43           HA       VAL  43 -25.746   5.888   0.236
  326    HB   VAL  43           HB       VAL  43 -23.257   5.223   0.002
  327   HG11  VAL  43          HG11      VAL  43 -24.189   6.428   1.917
  328   HG12  VAL  43          HG12      VAL  43 -22.940   5.287   2.412
  329   HG13  VAL  43          HG13      VAL  43 -24.643   4.895   2.656
  330   HG21  VAL  43          HG21      VAL  43 -24.348   2.742   1.320
  331   HG22  VAL  43          HG22      VAL  43 -22.639   3.157   1.174
  332   HG23  VAL  43          HG23      VAL  43 -23.596   2.832  -0.272
  333    HA   PRO  44           HA       PRO  44 -25.664   4.878  -4.207
  334    HB2  PRO  44           HB2      PRO  44 -26.512   7.305  -5.043
  335    HB3  PRO  44           HB3      PRO  44 -27.629   6.052  -4.487
  336    HG2  PRO  44           HG2      PRO  44 -26.621   8.464  -3.047
  337    HG3  PRO  44           HG3      PRO  44 -28.238   7.740  -3.033
  338    HD2  PRO  44           HD2      PRO  44 -26.356   7.383  -1.052
  339    HD3  PRO  44           HD3      PRO  44 -27.683   6.257  -1.385
  340    H    ARG  45           H        ARG  45 -23.411   4.748  -4.309
  341    HA   ARG  45           HA       ARG  45 -22.049   7.167  -5.088
  342    HB2  ARG  45           HB2      ARG  45 -20.160   6.683  -3.432
  343    HB3  ARG  45           HB3      ARG  45 -21.601   7.477  -2.818
  344    HG2  ARG  45           HG2      ARG  45 -22.298   5.015  -2.221
  345    HG3  ARG  45           HG3      ARG  45 -20.556   4.740  -2.309
  346    HD2  ARG  45           HD2      ARG  45 -22.032   6.667  -0.534
  347    HD3  ARG  45           HD3      ARG  45 -21.064   5.275  -0.051
  348    HE   ARG  45           HE       ARG  45 -19.196   6.701  -1.209
  349   HH11  ARG  45          HH11      ARG  45 -21.800   7.807   0.828
  350   HH12  ARG  45          HH12      ARG  45 -20.940   9.194   1.424
  351   HH21  ARG  45          HH21      ARG  45 -18.013   8.522  -0.385
  352   HH22  ARG  45          HH22      ARG  45 -18.794   9.592   0.738
  353    H    THR  46           H        THR  46 -19.703   6.710  -5.604
  354    HA   THR  46           HA       THR  46 -19.675   4.654  -7.543
  355    HB   THR  46           HB       THR  46 -18.393   6.740  -7.813
  356    HG1  THR  46           HG1      THR  46 -16.622   5.760  -8.756
  357   HG21  THR  46          HG21      THR  46 -17.619   7.034  -5.516
  358   HG22  THR  46          HG22      THR  46 -16.258   7.037  -6.637
  359   HG23  THR  46          HG23      THR  46 -16.598   5.606  -5.665
  360    H    ARG  47           H        ARG  47 -17.923   3.006  -7.691
  361    HA   ARG  47           HA       ARG  47 -18.351   1.260  -5.464
  362    HB2  ARG  47           HB2      ARG  47 -16.429   0.560  -7.647
  363    HB3  ARG  47           HB3      ARG  47 -17.599  -0.459  -6.827
  364    HG2  ARG  47           HG2      ARG  47 -18.097   1.535  -9.023
  365    HG3  ARG  47           HG3      ARG  47 -18.335  -0.206  -9.058
  366    HD2  ARG  47           HD2      ARG  47 -19.868   1.466  -7.112
  367    HD3  ARG  47           HD3      ARG  47 -20.377   1.396  -8.794
  368    HE   ARG  47           HE       ARG  47 -20.086  -1.222  -8.000
  369   HH11  ARG  47          HH11      ARG  47 -21.962   1.541  -6.950
  370   HH12  ARG  47          HH12      ARG  47 -23.326   0.592  -6.455
  371   HH21  ARG  47          HH21      ARG  47 -21.903  -2.489  -7.330
  372   HH22  ARG  47          HH22      ARG  47 -23.289  -1.673  -6.662
  373    H    LYS  48           H        LYS  48 -15.793   3.251  -6.633
  374    HA   LYS  48           HA       LYS  48 -13.565   2.305  -5.286
  375    HB2  LYS  48           HB2      LYS  48 -13.377   4.082  -6.885
  376    HB3  LYS  48           HB3      LYS  48 -14.442   5.116  -5.947
  377    HG2  LYS  48           HG2      LYS  48 -12.670   4.988  -4.116
  378    HG3  LYS  48           HG3      LYS  48 -11.607   4.338  -5.368
  379    HD2  LYS  48           HD2      LYS  48 -11.211   6.673  -5.292
  380    HD3  LYS  48           HD3      LYS  48 -12.177   6.377  -6.739
  381    HE2  LYS  48           HE2      LYS  48 -14.195   7.049  -5.514
  382    HE3  LYS  48           HE3      LYS  48 -13.217   7.355  -4.079
  383    HZ1  LYS  48           HZ1      LYS  48 -13.683   9.393  -5.267
  384    HZ2  LYS  48           HZ2      LYS  48 -12.991   8.771  -6.675
  385    HZ3  LYS  48           HZ3      LYS  48 -12.025   9.061  -5.322
  386    H    GLN  49           H        GLN  49 -16.251   4.220  -4.107
  387    HA   GLN  49           HA       GLN  49 -15.124   5.219  -1.756
  388    HB2  GLN  49           HB2      GLN  49 -17.959   4.611  -2.547
  389    HB3  GLN  49           HB3      GLN  49 -17.554   5.325  -0.993
  390    HG2  GLN  49           HG2      GLN  49 -16.732   6.531  -3.615
  391    HG3  GLN  49           HG3      GLN  49 -18.232   6.926  -2.790
  392   HE21  GLN  49          HE21      GLN  49 -16.064   8.697  -3.417
  393   HE22  GLN  49          HE22      GLN  49 -15.466   9.307  -1.914
  394    H    ILE  50           H        ILE  50 -17.156   2.337  -2.223
  395    HA   ILE  50           HA       ILE  50 -17.168   1.496   0.438
  396    HB   ILE  50           HB       ILE  50 -17.500   0.014  -2.150
  397   HG12  ILE  50          HG12      ILE  50 -19.827  -0.310  -0.873
  398   HG13  ILE  50          HG13      ILE  50 -19.297   1.157  -0.061
  399   HG21  ILE  50          HG21      ILE  50 -17.727  -1.187   0.602
  400   HG22  ILE  50          HG22      ILE  50 -16.499  -1.567  -0.604
  401   HG23  ILE  50          HG23      ILE  50 -18.187  -1.975  -0.907
  402   HD11  ILE  50          HD11      ILE  50 -19.057   2.227  -2.308
  403   HD12  ILE  50          HD12      ILE  50 -20.706   1.766  -1.889
  404   HD13  ILE  50          HD13      ILE  50 -19.776   0.768  -3.012
  405    H    ILE  51           H        ILE  51 -15.025   0.529  -2.230
  406    HA   ILE  51           HA       ILE  51 -13.373  -1.253  -0.872
  407    HB   ILE  51           HB       ILE  51 -12.574   0.702  -3.031
  408   HG12  ILE  51          HG12      ILE  51 -13.487  -2.163  -3.302
  409   HG13  ILE  51          HG13      ILE  51 -14.524  -0.766  -3.580
  410   HG21  ILE  51          HG21      ILE  51 -11.294  -1.896  -2.206
  411   HG22  ILE  51          HG22      ILE  51 -10.664  -0.287  -1.861
  412   HG23  ILE  51          HG23      ILE  51 -10.774  -0.853  -3.527
  413   HD11  ILE  51          HD11      ILE  51 -13.057  -0.044  -5.391
  414   HD12  ILE  51          HD12      ILE  51 -13.688  -1.669  -5.663
  415   HD13  ILE  51          HD13      ILE  51 -12.027  -1.449  -5.111
  416    H    HIS  52           H        HIS  52 -13.087   2.233  -1.294
  417    HA   HIS  52           HA       HIS  52 -10.650   2.657  -0.062
  418    HB2  HIS  52           HB2      HIS  52 -12.895   4.274  -0.892
  419    HB3  HIS  52           HB3      HIS  52 -12.209   4.888   0.600
  420    HD1  HIS  52           HD1      HIS  52 -10.455   6.546   0.224
  421    HD2  HIS  52           HD2      HIS  52 -10.609   3.750  -2.868
  422    HE1  HIS  52           HE1      HIS  52  -8.647   7.218  -1.382
  423    HE2  HIS  52           HE2      HIS  52  -8.710   5.488  -3.215
  424    H    HIS  53           H        HIS  53 -13.876   2.613   1.425
  425    HA   HIS  53           HA       HIS  53 -12.817   3.517   3.927
  426    HB2  HIS  53           HB2      HIS  53 -15.560   2.401   3.321
  427    HB3  HIS  53           HB3      HIS  53 -15.096   3.323   4.756
  428    HD1  HIS  53           HD1      HIS  53 -13.346   5.418   3.208
  429    HD2  HIS  53           HD2      HIS  53 -17.234   4.329   2.214
  430    HE1  HIS  53           HE1      HIS  53 -14.156   7.230   1.705
  431    HE2  HIS  53           HE2      HIS  53 -16.477   6.518   1.016
  432    H    LEU  54           H        LEU  54 -13.332   0.421   2.501
  433    HA   LEU  54           HA       LEU  54 -13.164  -1.096   4.894
  434    HB2  LEU  54           HB2      LEU  54 -12.531  -1.764   2.024
  435    HB3  LEU  54           HB3      LEU  54 -12.414  -2.935   3.324
  436    HG   LEU  54           HG       LEU  54 -14.965  -1.472   2.655
  437   HD11  LEU  54          HD11      LEU  54 -14.216  -2.794   0.733
  438   HD12  LEU  54          HD12      LEU  54 -15.656  -3.481   1.480
  439   HD13  LEU  54          HD13      LEU  54 -14.078  -4.212   1.773
  440   HD21  LEU  54          HD21      LEU  54 -14.413  -3.974   4.265
  441   HD22  LEU  54          HD22      LEU  54 -16.000  -3.270   3.956
  442   HD23  LEU  54          HD23      LEU  54 -14.820  -2.393   4.930
  443    H    VAL  55           H        VAL  55 -10.710  -0.140   2.476
  444    HA   VAL  55           HA       VAL  55  -8.603  -1.291   4.045
  445    HB   VAL  55           HB       VAL  55  -7.050  -0.349   2.415
  446   HG11  VAL  55          HG11      VAL  55  -8.121  -2.458   1.909
  447   HG12  VAL  55          HG12      VAL  55  -7.888  -1.528   0.429
  448   HG13  VAL  55          HG13      VAL  55  -9.484  -1.616   1.171
  449   HG21  VAL  55          HG21      VAL  55  -7.855   0.898   0.475
  450   HG22  VAL  55          HG22      VAL  55  -8.153   1.782   1.973
  451   HG23  VAL  55          HG23      VAL  55  -9.475   0.937   1.168
  452    H    GLN  56           H        GLN  56  -9.954   1.946   3.666
  453    HA   GLN  56           HA       GLN  56  -8.044   3.395   5.077
  454    HB2  GLN  56           HB2      GLN  56 -10.686   3.742   4.066
  455    HB3  GLN  56           HB3      GLN  56 -10.667   4.310   5.726
  456    HG2  GLN  56           HG2      GLN  56 -10.258   6.122   4.320
  457    HG3  GLN  56           HG3      GLN  56  -8.742   5.767   5.131
  458   HE21  GLN  56          HE21      GLN  56 -10.147   4.117   2.377
  459   HE22  GLN  56          HE22      GLN  56  -8.958   4.612   1.232
  460    H    MET  57           H        MET  57 -10.516   1.178   6.135
  461    HA   MET  57           HA       MET  57 -10.389   2.077   8.882
  462    HB2  MET  57           HB2      MET  57 -12.439   1.111   7.547
  463    HB3  MET  57           HB3      MET  57 -11.779  -0.432   8.068
  464    HG2  MET  57           HG2      MET  57 -11.931   0.290  10.399
  465    HG3  MET  57           HG3      MET  57 -12.599   1.833   9.874
  466    HE1  MET  57           HE1      MET  57 -14.365   0.409   7.321
  467    HE2  MET  57           HE2      MET  57 -14.823   1.852   8.227
  468    HE3  MET  57           HE3      MET  57 -15.939   0.490   8.114
  469    H    GLY  58           H        GLY  58  -8.418   0.267   7.034
  470    HA2  GLY  58           HA2      GLY  58  -6.630  -1.070   7.558
  471    HA3  GLY  58           HA3      GLY  58  -6.964  -0.741   9.253
  472    H    LEU  59           H        LEU  59  -9.569  -2.032   7.452
  473    HA   LEU  59           HA       LEU  59  -9.173  -4.604   8.804
  474    HB2  LEU  59           HB2      LEU  59 -11.552  -5.028   8.357
  475    HB3  LEU  59           HB3      LEU  59 -11.285  -3.583   9.309
  476    HG   LEU  59           HG       LEU  59 -11.497  -2.341   7.034
  477   HD11  LEU  59          HD11      LEU  59 -12.969  -3.428   5.449
  478   HD12  LEU  59          HD12      LEU  59 -12.956  -4.903   6.417
  479   HD13  LEU  59          HD13      LEU  59 -11.475  -4.345   5.634
  480   HD21  LEU  59          HD21      LEU  59 -13.048  -2.122   8.882
  481   HD22  LEU  59          HD22      LEU  59 -13.856  -3.612   8.398
  482   HD23  LEU  59          HD23      LEU  59 -13.912  -2.196   7.346
  483    H    ALA  60           H        ALA  60  -9.124  -3.096   5.772
  484    HA   ALA  60           HA       ALA  60  -8.783  -5.728   4.475
  485    HB1  ALA  60           HB1      ALA  60 -10.659  -4.540   3.510
  486    HB2  ALA  60           HB2      ALA  60  -9.334  -4.609   2.346
  487    HB3  ALA  60           HB3      ALA  60  -9.650  -3.120   3.235
  488    H    ASP  61           H        ASP  61  -7.232  -5.554   2.534
  489    HA   ASP  61           HA       ASP  61  -4.744  -4.601   3.633
  490    HB2  ASP  61           HB2      ASP  61  -4.860  -6.792   2.546
  491    HB3  ASP  61           HB3      ASP  61  -5.341  -6.023   1.036
  492    H    SER  62           H        SER  62  -6.137  -4.266   0.371
  493    HA   SER  62           HA       SER  62  -5.354  -1.482   0.229
  494    HB2  SER  62           HB2      SER  62  -4.136  -3.507  -1.654
  495    HB3  SER  62           HB3      SER  62  -3.859  -1.769  -1.670
  496    HG   SER  62           HG       SER  62  -2.951  -3.713   0.161
  497    H    VAL  63           H        VAL  63  -5.937  -0.546  -1.893
  498    HA   VAL  63           HA       VAL  63  -8.521  -1.359  -2.740
  499    HB   VAL  63           HB       VAL  63  -6.565   0.679  -3.809
  500   HG11  VAL  63          HG11      VAL  63  -8.378   1.545  -5.211
  501   HG12  VAL  63          HG12      VAL  63  -9.391   0.178  -4.743
  502   HG13  VAL  63          HG13      VAL  63  -7.920  -0.093  -5.678
  503   HG21  VAL  63          HG21      VAL  63  -7.528   1.191  -1.649
  504   HG22  VAL  63          HG22      VAL  63  -9.152   0.915  -2.277
  505   HG23  VAL  63          HG23      VAL  63  -8.195   2.272  -2.873
  506    H    LYS  64           H        LYS  64  -5.320  -2.086  -3.745
  507    HA   LYS  64           HA       LYS  64  -5.712  -2.849  -6.410
  508    HB2  LYS  64           HB2      LYS  64  -3.745  -4.034  -4.438
  509    HB3  LYS  64           HB3      LYS  64  -3.616  -4.065  -6.190
  510    HG2  LYS  64           HG2      LYS  64  -3.394  -1.632  -6.219
  511    HG3  LYS  64           HG3      LYS  64  -3.550  -1.598  -4.471
  512    HD2  LYS  64           HD2      LYS  64  -1.208  -1.401  -5.273
  513    HD3  LYS  64           HD3      LYS  64  -1.474  -2.782  -4.202
  514    HE2  LYS  64           HE2      LYS  64  -1.575  -4.266  -6.141
  515    HE3  LYS  64           HE3      LYS  64  -1.362  -2.886  -7.217
  516    HZ1  LYS  64           HZ1      LYS  64   0.605  -3.830  -5.201
  517    HZ2  LYS  64           HZ2      LYS  64   0.813  -2.507  -6.235
  518    HZ3  LYS  64           HZ3      LYS  64   0.711  -4.065  -6.873
  519    H    ASP  65           H        ASP  65  -6.233  -4.553  -3.404
  520    HA   ASP  65           HA       ASP  65  -6.517  -7.153  -4.467
  521    HB2  ASP  65           HB2      ASP  65  -6.097  -6.844  -2.110
  522    HB3  ASP  65           HB3      ASP  65  -7.567  -5.895  -1.927
  523    H    PHE  66           H        PHE  66  -8.701  -4.448  -4.176
  524    HA   PHE  66           HA       PHE  66 -11.031  -6.113  -4.718
  525    HB2  PHE  66           HB2      PHE  66 -10.813  -3.125  -4.307
  526    HB3  PHE  66           HB3      PHE  66 -12.311  -4.033  -4.439
  527    HD1  PHE  66           HD1      PHE  66  -9.222  -3.831  -2.387
  528    HD2  PHE  66           HD2      PHE  66 -13.370  -4.729  -2.521
  529    HE1  PHE  66           HE1      PHE  66  -9.242  -4.074   0.054
  530    HE2  PHE  66           HE2      PHE  66 -13.397  -4.993  -0.084
  531    HZ   PHE  66           HZ       PHE  66 -11.331  -4.652   1.214
  532    H    GLN  67           H        GLN  67  -9.297  -3.365  -6.195
  533    HA   GLN  67           HA       GLN  67 -10.404  -4.023  -8.790
  534    HB2  GLN  67           HB2      GLN  67 -11.177  -1.545  -7.273
  535    HB3  GLN  67           HB3      GLN  67 -11.209  -1.596  -9.039
  536    HG2  GLN  67           HG2      GLN  67 -12.702  -3.637  -8.794
  537    HG3  GLN  67           HG3      GLN  67 -12.844  -3.190  -7.095
  538   HE21  GLN  67          HE21      GLN  67 -14.893  -3.322  -9.132
  539   HE22  GLN  67          HE22      GLN  67 -15.590  -1.746  -9.230
  540    H    ARG  68           H        ARG  68  -9.444  -0.870  -7.785
  541    HA   ARG  68           HA       ARG  68  -7.693  -0.575  -9.991
  542    HB2  ARG  68           HB2      ARG  68  -9.082   1.230  -8.959
  543    HB3  ARG  68           HB3      ARG  68  -7.998   1.218  -7.580
  544    HG2  ARG  68           HG2      ARG  68  -6.166   1.967  -8.944
  545    HG3  ARG  68           HG3      ARG  68  -7.158   1.842 -10.401
  546    HD2  ARG  68           HD2      ARG  68  -8.703   3.512  -9.461
  547    HD3  ARG  68           HD3      ARG  68  -7.653   3.668  -8.056
  548    HE   ARG  68           HE       ARG  68  -5.947   4.264 -10.001
  549   HH11  ARG  68          HH11      ARG  68  -9.272   5.279  -9.567
  550   HH12  ARG  68          HH12      ARG  68  -9.013   6.849 -10.258
  551   HH21  ARG  68          HH21      ARG  68  -5.614   6.337 -10.921
  552   HH22  ARG  68          HH22      ARG  68  -6.948   7.444 -11.034
  553    H    LYS  69           H        LYS  69  -5.823  -1.634 -10.047
  554    HA   LYS  69           HA       LYS  69  -4.348  -2.091  -7.605
  555    HB2  LYS  69           HB2      LYS  69  -2.844  -3.441  -9.002
  556    HB3  LYS  69           HB3      LYS  69  -4.520  -3.958  -9.089
  557    HG2  LYS  69           HG2      LYS  69  -4.765  -2.837 -11.244
  558    HG3  LYS  69           HG3      LYS  69  -3.090  -2.286 -11.153
  559    HD2  LYS  69           HD2      LYS  69  -2.336  -4.612 -11.139
  560    HD3  LYS  69           HD3      LYS  69  -4.010  -5.157 -11.229
  561    HE2  LYS  69           HE2      LYS  69  -4.254  -4.025 -13.387
  562    HE3  LYS  69           HE3      LYS  69  -2.577  -3.494 -13.296
  563    HZ1  LYS  69           HZ1      LYS  69  -2.849  -5.461 -14.682
  564    HZ2  LYS  69           HZ2      LYS  69  -3.468  -6.323 -13.366
  565    HZ3  LYS  69           HZ3      LYS  69  -1.867  -5.783 -13.347
  566    H    GLY  70           H        GLY  70  -4.614   0.523  -9.291
  567    HA2  GLY  70           HA2      GLY  70  -1.871   1.191  -9.839
  568    HA3  GLY  70           HA3      GLY  70  -3.243   2.291  -9.869
  569    H    THR  71           H        THR  71  -2.287   0.256  -7.163
  570    HA   THR  71           HA       THR  71  -1.809   2.676  -5.594
  571    HB   THR  71           HB       THR  71  -2.040   0.019  -4.306
  572    HG1  THR  71           HG1      THR  71  -4.002   1.269  -5.798
  573   HG21  THR  71          HG21      THR  71  -3.102   1.330  -2.549
  574   HG22  THR  71          HG22      THR  71  -2.980   2.775  -3.552
  575   HG23  THR  71          HG23      THR  71  -1.518   1.982  -2.966
  576    H    HIS  72           H        HIS  72   0.069   2.892  -4.358
  577    HA   HIS  72           HA       HIS  72   2.367   1.645  -5.512
  578    HB2  HIS  72           HB2      HIS  72   3.659   3.167  -4.279
  579    HB3  HIS  72           HB3      HIS  72   2.165   4.043  -4.569
  580    HD1  HIS  72           HD1      HIS  72   4.189   4.649  -2.223
  581    HD2  HIS  72           HD2      HIS  72   0.690   2.438  -1.872
  582    HE1  HIS  72           HE1      HIS  72   3.592   4.706   0.222
  583    HE2  HIS  72           HE2      HIS  72   1.296   3.659   0.329
  584    H    ILE  73           H        ILE  73   0.256   0.271  -3.570
  585    HA   ILE  73           HA       ILE  73   1.766  -0.588  -1.353
  586    HB   ILE  73           HB       ILE  73  -0.811  -1.517  -2.546
  587   HG12  ILE  73          HG12      ILE  73  -0.655   0.477  -1.026
  588   HG13  ILE  73          HG13      ILE  73  -1.701  -0.809  -0.415
  589   HG21  ILE  73          HG21      ILE  73   0.786  -2.960  -0.463
  590   HG22  ILE  73          HG22      ILE  73   0.136  -3.599  -1.970
  591   HG23  ILE  73          HG23      ILE  73  -0.955  -3.165  -0.654
  592   HD11  ILE  73          HD11      ILE  73  -0.377   0.067   1.377
  593   HD12  ILE  73          HD12      ILE  73   1.109  -0.197   0.468
  594   HD13  ILE  73          HD13      ILE  73   0.157  -1.574   1.020
  595    H    VAL  74           H        VAL  74   3.118  -2.078  -1.074
  596    HA   VAL  74           HA       VAL  74   4.191  -3.592  -3.245
  597    HB   VAL  74           HB       VAL  74   5.814  -4.363  -1.553
  598   HG11  VAL  74          HG11      VAL  74   5.222  -1.418  -1.734
  599   HG12  VAL  74          HG12      VAL  74   6.328  -2.369  -2.734
  600   HG13  VAL  74          HG13      VAL  74   6.712  -2.070  -1.038
  601   HG21  VAL  74          HG21      VAL  74   4.290  -4.401   0.378
  602   HG22  VAL  74          HG22      VAL  74   4.239  -2.638   0.356
  603   HG23  VAL  74          HG23      VAL  74   5.756  -3.474   0.705
  604    H    LEU  75           H        LEU  75   4.334  -5.895  -3.286
  605    HA   LEU  75           HA       LEU  75   2.027  -7.302  -2.809
  606    HB2  LEU  75           HB2      LEU  75   3.398  -9.359  -3.032
  607    HB3  LEU  75           HB3      LEU  75   3.684  -8.177  -4.292
  608    HG   LEU  75           HG       LEU  75   5.535  -7.853  -2.073
  609   HD11  LEU  75          HD11      LEU  75   6.811  -9.890  -2.463
  610   HD12  LEU  75          HD12      LEU  75   5.566 -10.470  -3.569
  611   HD13  LEU  75          HD13      LEU  75   5.196 -10.264  -1.857
  612   HD21  LEU  75          HD21      LEU  75   5.822  -6.824  -4.265
  613   HD22  LEU  75          HD22      LEU  75   5.891  -8.416  -5.018
  614   HD23  LEU  75          HD23      LEU  75   7.163  -7.910  -3.906
  615    H    TRP  76           H        TRP  76   1.198  -6.933  -0.777
  616    HA   TRP  76           HA       TRP  76   2.714  -7.628   1.566
  617    HB2  TRP  76           HB2      TRP  76   0.053  -6.437   1.007
  618    HB3  TRP  76           HB3      TRP  76   0.253  -7.262   2.554
  619    HD1  TRP  76           HD1      TRP  76   0.400  -3.948   1.237
  620    HE1  TRP  76           HE1      TRP  76   1.884  -2.390   2.646
  621    HE3  TRP  76           HE3      TRP  76   2.974  -7.467   3.891
  622    HZ2  TRP  76           HZ2      TRP  76   3.881  -2.618   4.601
  623    HZ3  TRP  76           HZ3      TRP  76   4.668  -6.708   5.502
  624    HH2  TRP  76           HH2      TRP  76   5.117  -4.337   5.844
  625    H    THR  77           H        THR  77   3.062  -9.658   1.960
  626    HA   THR  77           HA       THR  77   0.903 -11.613   1.564
  627    HB   THR  77           HB       THR  77   2.651 -13.312   1.370
  628    HG1  THR  77           HG1      THR  77   4.897 -12.306   1.152
  629   HG21  THR  77          HG21      THR  77   1.976 -12.146  -0.684
  630   HG22  THR  77          HG22      THR  77   3.680 -12.596  -0.743
  631   HG23  THR  77          HG23      THR  77   3.219 -10.927  -0.403
  632    H    GLY  78           H        GLY  78   0.901 -13.403   3.196
  633    HA2  GLY  78           HA2      GLY  78   0.797 -12.491   5.820
  634    HA3  GLY  78           HA3      GLY  78   0.946 -14.182   5.362
  635    H    ASP  79           H        ASP  79   3.475 -13.941   4.065
  636    HA   ASP  79           HA       ASP  79   5.187 -14.148   6.329
  637    HB2  ASP  79           HB2      ASP  79   5.838 -14.125   3.376
  638    HB3  ASP  79           HB3      ASP  79   6.984 -14.518   4.655
  639    H    GLN  80           H        GLN  80   4.744 -11.725   3.774
  640    HA   GLN  80           HA       GLN  80   6.935 -10.113   4.583
  641    HB2  GLN  80           HB2      GLN  80   5.802  -9.983   2.326
  642    HB3  GLN  80           HB3      GLN  80   4.467  -9.165   3.123
  643    HG2  GLN  80           HG2      GLN  80   5.841  -7.331   3.737
  644    HG3  GLN  80           HG3      GLN  80   7.298  -8.179   3.231
  645   HE21  GLN  80          HE21      GLN  80   4.473  -6.458   2.175
  646   HE22  GLN  80          HE22      GLN  80   4.981  -6.228   0.541
  647    H    GLU  81           H        GLU  81   3.524 -10.188   5.463
  648    HA   GLU  81           HA       GLU  81   3.498  -7.802   6.970
  649    HB2  GLU  81           HB2      GLU  81   1.809 -10.294   7.286
  650    HB3  GLU  81           HB3      GLU  81   1.466  -8.738   8.030
  651    HG2  GLU  81           HG2      GLU  81   1.201  -7.725   5.833
  652    HG3  GLU  81           HG3      GLU  81   1.587  -9.263   5.067
  653    H    LEU  82           H        LEU  82   4.365 -11.121   7.744
  654    HA   LEU  82           HA       LEU  82   4.792 -10.705  10.513
  655    HB2  LEU  82           HB2      LEU  82   4.572 -12.947   9.647
  656    HB3  LEU  82           HB3      LEU  82   5.974 -12.726   8.615
  657    HG   LEU  82           HG       LEU  82   7.353 -12.431  10.692
  658   HD11  LEU  82          HD11      LEU  82   5.600 -11.822  12.232
  659   HD12  LEU  82          HD12      LEU  82   6.417 -13.279  12.794
  660   HD13  LEU  82          HD13      LEU  82   4.833 -13.396  12.029
  661   HD21  LEU  82          HD21      LEU  82   5.928 -15.056  10.323
  662   HD22  LEU  82          HD22      LEU  82   7.445 -14.822  11.195
  663   HD23  LEU  82          HD23      LEU  82   7.365 -14.505   9.460
  664    H    GLU  83           H        GLU  83   6.912 -10.544   7.680
  665    HA   GLU  83           HA       GLU  83   9.279  -9.963   9.073
  666    HB2  GLU  83           HB2      GLU  83   8.410  -9.300   6.262
  667    HB3  GLU  83           HB3      GLU  83  10.022  -8.957   6.874
  668    HG2  GLU  83           HG2      GLU  83   8.743 -11.675   6.687
  669    HG3  GLU  83           HG3      GLU  83   9.980 -11.029   5.609
  670    H    LEU  84           H        LEU  84   6.587  -7.947   8.110
  671    HA   LEU  84           HA       LEU  84   7.825  -5.473   8.832
  672    HB2  LEU  84           HB2      LEU  84   5.859  -5.477   7.406
  673    HB3  LEU  84           HB3      LEU  84   4.914  -6.260   8.658
  674    HG   LEU  84           HG       LEU  84   5.192  -4.245  10.086
  675   HD11  LEU  84          HD11      LEU  84   6.073  -2.207   9.174
  676   HD12  LEU  84          HD12      LEU  84   6.381  -2.982   7.622
  677   HD13  LEU  84          HD13      LEU  84   7.299  -3.466   9.047
  678   HD21  LEU  84          HD21      LEU  84   3.196  -4.533   8.687
  679   HD22  LEU  84          HD22      LEU  84   4.003  -3.683   7.370
  680   HD23  LEU  84          HD23      LEU  84   3.633  -2.834   8.869
  681    H    GLN  85           H        GLN  85   5.555  -7.656  10.424
  682    HA   GLN  85           HA       GLN  85   5.190  -6.478  12.861
  683    HB2  GLN  85           HB2      GLN  85   4.288  -8.686  11.861
  684    HB3  GLN  85           HB3      GLN  85   5.700  -9.435  12.583
  685    HG2  GLN  85           HG2      GLN  85   3.543  -7.952  14.057
  686    HG3  GLN  85           HG3      GLN  85   3.707  -9.697  13.958
  687   HE21  GLN  85          HE21      GLN  85   5.505 -10.677  15.026
  688   HE22  GLN  85          HE22      GLN  85   6.271  -9.879  16.355
  689    H    ARG  86           H        ARG  86   7.686  -8.927  12.169
  690    HA   ARG  86           HA       ARG  86   8.888  -8.859  14.673
  691    HB2  ARG  86           HB2      ARG  86  10.127  -9.552  12.011
  692    HB3  ARG  86           HB3      ARG  86  10.816  -9.947  13.581
  693    HG2  ARG  86           HG2      ARG  86   8.649 -11.199  14.042
  694    HG3  ARG  86           HG3      ARG  86   8.312 -11.017  12.320
  695    HD2  ARG  86           HD2      ARG  86  10.344 -12.198  11.751
  696    HD3  ARG  86           HD3      ARG  86  10.796 -12.301  13.452
  697    HE   ARG  86           HE       ARG  86   8.258 -13.511  12.728
  698   HH11  ARG  86          HH11      ARG  86  11.680 -13.997  13.293
  699   HH12  ARG  86          HH12      ARG  86  11.511 -15.696  13.605
  700   HH21  ARG  86          HH21      ARG  86   8.043 -15.759  13.125
  701   HH22  ARG  86          HH22      ARG  86   9.457 -16.694  13.498
  702    H    LEU  87           H        LEU  87   9.937  -7.157  11.709
  703    HA   LEU  87           HA       LEU  87  12.163  -5.951  12.975
  704    HB2  LEU  87           HB2      LEU  87  10.775  -5.575  10.383
  705    HB3  LEU  87           HB3      LEU  87  11.822  -4.285  10.942
  706    HG   LEU  87           HG       LEU  87  13.620  -6.088  11.210
  707   HD11  LEU  87          HD11      LEU  87  13.385  -8.036   9.771
  708   HD12  LEU  87          HD12      LEU  87  11.725  -7.570   9.401
  709   HD13  LEU  87          HD13      LEU  87  12.165  -8.031  11.046
  710   HD21  LEU  87          HD21      LEU  87  14.211  -5.928   8.833
  711   HD22  LEU  87          HD22      LEU  87  13.689  -4.385   9.509
  712   HD23  LEU  87          HD23      LEU  87  12.593  -5.317   8.492
  713    H    PHE  88           H        PHE  88   8.828  -4.959  12.586
  714    HA   PHE  88           HA       PHE  88   9.047  -2.264  13.201
  715    HB2  PHE  88           HB2      PHE  88   6.924  -2.911  12.512
  716    HB3  PHE  88           HB3      PHE  88   6.889  -4.304  13.585
  717    HD1  PHE  88           HD1      PHE  88   5.584  -4.209  15.452
  718    HD2  PHE  88           HD2      PHE  88   7.008  -0.579  13.751
  719    HE1  PHE  88           HE1      PHE  88   4.276  -2.935  17.092
  720    HE2  PHE  88           HE2      PHE  88   5.705   0.705  15.395
  721    HZ   PHE  88           HZ       PHE  88   4.344  -0.477  17.074
  722    H    GLU  89           H        GLU  89   8.591  -5.004  15.441
  723    HA   GLU  89           HA       GLU  89   8.765  -3.342  17.752
  724    HB2  GLU  89           HB2      GLU  89   9.115  -6.317  17.466
  725    HB3  GLU  89           HB3      GLU  89   8.945  -5.459  18.985
  726    HG2  GLU  89           HG2      GLU  89   6.734  -4.604  17.980
  727    HG3  GLU  89           HG3      GLU  89   6.935  -5.934  16.840
  728    H    GLU  90           H        GLU  90  11.004  -5.280  15.897
  729    HA   GLU  90           HA       GLU  90  13.112  -5.373  17.732
  730    HB2  GLU  90           HB2      GLU  90  12.743  -5.775  14.837
  731    HB3  GLU  90           HB3      GLU  90  14.388  -5.482  15.374
  732    HG2  GLU  90           HG2      GLU  90  14.263  -7.375  16.878
  733    HG3  GLU  90           HG3      GLU  90  12.580  -7.638  16.431
  734    H    PHE  91           H        PHE  91  12.068  -2.857  15.558
  735    HA   PHE  91           HA       PHE  91  14.372  -1.241  16.432
  736    HB2  PHE  91           HB2      PHE  91  12.874  -1.059  13.810
  737    HB3  PHE  91           HB3      PHE  91  14.200  -0.013  14.306
  738    HD1  PHE  91           HD1      PHE  91  13.345  -2.876  12.485
  739    HD2  PHE  91           HD2      PHE  91  16.401  -1.279  14.969
  740    HE1  PHE  91           HE1      PHE  91  14.953  -4.460  11.514
  741    HE2  PHE  91           HE2      PHE  91  18.020  -2.859  14.002
  742    HZ   PHE  91           HZ       PHE  91  17.296  -4.455  12.273
  743    H    ARG  92           H        ARG  92  11.380  -1.624  17.311
  744    HA   ARG  92           HA       ARG  92  10.107   0.856  16.819
  745    HB2  ARG  92           HB2      ARG  92   8.808  -1.097  17.488
  746    HB3  ARG  92           HB3      ARG  92   9.632  -1.144  19.041
  747    HG2  ARG  92           HG2      ARG  92   8.650   0.964  19.673
  748    HG3  ARG  92           HG3      ARG  92   7.912   1.132  18.083
  749    HD2  ARG  92           HD2      ARG  92   6.492  -0.776  18.493
  750    HD3  ARG  92           HD3      ARG  92   7.301  -1.095  20.030
  751    HE   ARG  92           HE       ARG  92   6.437   1.407  20.404
  752   HH11  ARG  92          HH11      ARG  92   4.772  -1.444  19.238
  753   HH12  ARG  92          HH12      ARG  92   3.200  -0.867  19.698
  754   HH21  ARG  92          HH21      ARG  92   4.377   2.175  21.029
  755   HH22  ARG  92          HH22      ARG  92   2.970   1.208  20.699
  756    H    ASP  93           H        ASP  93  12.419  -0.184  19.200
  757    HA   ASP  93           HA       ASP  93  11.941   2.177  20.837
  758    HB2  ASP  93           HB2      ASP  93  12.317  -0.119  21.832
  759    HB3  ASP  93           HB3      ASP  93  13.992   0.014  21.310
  760    H    SER  94           H        SER  94  13.266   2.054  18.059
  761    HA   SER  94           HA       SER  94  15.729   3.477  18.789
  762    HB2  SER  94           HB2      SER  94  16.482   3.162  16.515
  763    HB3  SER  94           HB3      SER  94  15.924   1.608  17.125
  764    HG   SER  94           HG       SER  94  13.908   2.058  16.019
  765    H    ASP  95           H        ASP  95  16.096   5.254  16.815
  766    HA   ASP  95           HA       ASP  95  14.294   7.295  17.612
  767    HB2  ASP  95           HB2      ASP  95  16.694   7.654  16.978
  768    HB3  ASP  95           HB3      ASP  95  16.241   7.365  15.300
  769    H    ASP  96           H        ASP  96  14.781   5.656  14.507
  770    HA   ASP  96           HA       ASP  96  11.974   6.224  13.908
  771    HB2  ASP  96           HB2      ASP  96  13.394   7.854  12.665
  772    HB3  ASP  96           HB3      ASP  96  14.189   6.501  11.864
  773    H    VAL  97           H        VAL  97  11.087   4.310  13.930
  774    HA   VAL  97           HA       VAL  97  12.520   1.910  13.623
  775    HB   VAL  97           HB       VAL  97  10.622   1.885  15.040
  776   HG11  VAL  97          HG11      VAL  97   9.027   2.765  12.654
  777   HG12  VAL  97          HG12      VAL  97   9.272   3.630  14.173
  778   HG13  VAL  97          HG13      VAL  97   8.307   2.154  14.141
  779   HG21  VAL  97          HG21      VAL  97  11.003  -0.221  13.944
  780   HG22  VAL  97          HG22      VAL  97  10.031   0.281  12.563
  781   HG23  VAL  97          HG23      VAL  97   9.266   0.031  14.135
  782    H    LEU  98           H        LEU  98  10.537   3.744  11.315
  783    HA   LEU  98           HA       LEU  98  10.308   1.569   9.484
  784    HB2  LEU  98           HB2      LEU  98  10.001   4.507   8.907
  785    HB3  LEU  98           HB3      LEU  98   9.508   3.201   7.855
  786    HG   LEU  98           HG       LEU  98   8.223   4.190  10.346
  787   HD11  LEU  98          HD11      LEU  98   7.408   4.984   8.232
  788   HD12  LEU  98          HD12      LEU  98   6.214   3.937   8.998
  789   HD13  LEU  98          HD13      LEU  98   7.200   3.324   7.673
  790   HD21  LEU  98          HD21      LEU  98   6.829   2.163  10.415
  791   HD22  LEU  98          HD22      LEU  98   8.508   1.885  10.891
  792   HD23  LEU  98          HD23      LEU  98   7.956   1.409   9.289
  793    H    GLY  99           H        GLY  99  12.539   4.284   9.796
  794    HA2  GLY  99           HA2      GLY  99  13.971   3.912   7.413
  795    HA3  GLY  99           HA3      GLY  99  14.633   4.581   8.903
  796    H    HIS 100           H        HIS 100  14.386   2.421  10.597
  797    HA   HIS 100           HA       HIS 100  16.649   0.876   9.850
  798    HB2  HIS 100           HB2      HIS 100  14.710   0.695  12.152
  799    HB3  HIS 100           HB3      HIS 100  16.028  -0.453  11.946
  800    HD1  HIS 100           HD1      HIS 100  17.866   0.138  13.485
  801    HD2  HIS 100           HD2      HIS 100  16.025   3.522  11.916
  802    HE1  HIS 100           HE1      HIS 100  19.124   2.098  14.431
  803    HE2  HIS 100           HE2      HIS 100  17.900   4.125  13.589
  804    H    ILE 101           H        ILE 101  13.189   0.423   9.691
  805    HA   ILE 101           HA       ILE 101  13.123  -2.299   9.054
  806    HB   ILE 101           HB       ILE 101  11.287  -0.032   8.236
  807   HG12  ILE 101          HG12      ILE 101  11.046  -2.333  10.203
  808   HG13  ILE 101          HG13      ILE 101  11.240  -0.627  10.597
  809   HG21  ILE 101          HG21      ILE 101  11.177  -1.714   6.480
  810   HG22  ILE 101          HG22      ILE 101   9.706  -1.761   7.452
  811   HG23  ILE 101          HG23      ILE 101  10.952  -2.989   7.677
  812   HD11  ILE 101          HD11      ILE 101   8.864  -1.881   9.245
  813   HD12  ILE 101          HD12      ILE 101   9.056  -0.165   9.598
  814   HD13  ILE 101          HD13      ILE 101   8.951  -1.327  10.917
  815    H    MET 102           H        MET 102  13.158   0.502   6.835
  816    HA   MET 102           HA       MET 102  13.316  -0.974   4.469
  817    HB2  MET 102           HB2      MET 102  14.410   1.784   5.032
  818    HB3  MET 102           HB3      MET 102  14.203   1.084   3.432
  819    HG2  MET 102           HG2      MET 102  11.801   0.973   3.773
  820    HG3  MET 102           HG3      MET 102  11.993   1.645   5.394
  821    HE1  MET 102           HE1      MET 102  10.111   2.745   3.020
  822    HE2  MET 102           HE2      MET 102  10.325   4.489   3.201
  823    HE3  MET 102           HE3      MET 102  10.130   3.470   4.629
  824    H    LYS 103           H        LYS 103  15.851   0.146   6.624
  825    HA   LYS 103           HA       LYS 103  18.019  -0.424   4.880
  826    HB2  LYS 103           HB2      LYS 103  17.728   0.262   7.763
  827    HB3  LYS 103           HB3      LYS 103  19.238  -0.474   7.255
  828    HG2  LYS 103           HG2      LYS 103  19.345   1.976   7.306
  829    HG3  LYS 103           HG3      LYS 103  19.641   1.324   5.696
  830    HD2  LYS 103           HD2      LYS 103  17.520   1.990   4.924
  831    HD3  LYS 103           HD3      LYS 103  16.925   2.268   6.561
  832    HE2  LYS 103           HE2      LYS 103  17.393   4.366   5.375
  833    HE3  LYS 103           HE3      LYS 103  18.395   4.170   6.810
  834    HZ1  LYS 103           HZ1      LYS 103  20.217   3.458   5.395
  835    HZ2  LYS 103           HZ2      LYS 103  19.675   4.994   4.944
  836    HZ3  LYS 103           HZ3      LYS 103  19.251   3.646   4.018
  837    H    ASN 104           H        ASN 104  16.253  -2.332   7.245
  838    HA   ASN 104           HA       ASN 104  18.279  -4.436   7.061
  839    HB2  ASN 104           HB2      ASN 104  16.199  -3.740   9.059
  840    HB3  ASN 104           HB3      ASN 104  16.655  -5.434   8.911
  841   HD21  ASN 104          HD21      ASN 104  18.632  -6.101   9.619
  842   HD22  ASN 104          HD22      ASN 104  19.740  -5.080  10.465
  843    H    ILE 105           H        ILE 105  15.003  -3.812   6.017
  844    HA   ILE 105           HA       ILE 105  14.582  -6.661   5.558
  845    HB   ILE 105           HB       ILE 105  12.717  -5.299   6.445
  846   HG12  ILE 105          HG12      ILE 105  10.973  -6.218   4.918
  847   HG13  ILE 105          HG13      ILE 105  12.254  -6.639   3.787
  848   HG21  ILE 105          HG21      ILE 105  13.053  -3.236   5.221
  849   HG22  ILE 105          HG22      ILE 105  11.431  -3.858   4.910
  850   HG23  ILE 105          HG23      ILE 105  12.700  -4.058   3.701
  851   HD11  ILE 105          HD11      ILE 105  13.220  -8.155   5.411
  852   HD12  ILE 105          HD12      ILE 105  11.527  -8.552   5.124
  853   HD13  ILE 105          HD13      ILE 105  11.997  -7.694   6.592
  854    H    THR 106           H        THR 106  14.093  -7.545   3.586
  855    HA   THR 106           HA       THR 106  15.783  -6.685   1.499
  856    HB   THR 106           HB       THR 106  15.228  -9.043   2.116
  857    HG1  THR 106           HG1      THR 106  16.032  -9.339   0.183
  858   HG21  THR 106          HG21      THR 106  12.817  -8.869   2.355
  859   HG22  THR 106          HG22      THR 106  13.218 -10.066   1.124
  860   HG23  THR 106          HG23      THR 106  12.654  -8.466   0.645
  861    H    ALA 107           H        ALA 107  12.288  -6.529   2.012
  862    HA   ALA 107           HA       ALA 107  11.807  -5.466  -0.638
  863    HB1  ALA 107           HB1      ALA 107   9.958  -5.812   1.724
  864    HB2  ALA 107           HB2      ALA 107  10.109  -6.903   0.345
  865    HB3  ALA 107           HB3      ALA 107   9.462  -5.275   0.120
  866    H    LYS 108           H        LYS 108  11.830  -3.357  -1.142
  867    HA   LYS 108           HA       LYS 108  12.241  -1.417   0.964
  868    HB2  LYS 108           HB2      LYS 108  11.793  -0.866  -1.971
  869    HB3  LYS 108           HB3      LYS 108  12.545   0.196  -0.791
  870    HG2  LYS 108           HG2      LYS 108  13.697  -2.420  -1.758
  871    HG3  LYS 108           HG3      LYS 108  14.158  -0.827  -2.344
  872    HD2  LYS 108           HD2      LYS 108  15.827  -1.224  -0.812
  873    HD3  LYS 108           HD3      LYS 108  14.658  -0.372   0.195
  874    HE2  LYS 108           HE2      LYS 108  13.910  -2.395   1.187
  875    HE3  LYS 108           HE3      LYS 108  14.761  -3.377  -0.002
  876    HZ1  LYS 108           HZ1      LYS 108  16.037  -1.660   2.066
  877    HZ2  LYS 108           HZ2      LYS 108  16.856  -2.618   0.933
  878    HZ3  LYS 108           HZ3      LYS 108  15.901  -3.347   2.125
  879    H    ARG 109           H        ARG 109  10.486  -1.039   2.166
  880    HA   ARG 109           HA       ARG 109   7.909  -0.792   0.780
  881    HB2  ARG 109           HB2      ARG 109   8.367  -1.220   3.730
  882    HB3  ARG 109           HB3      ARG 109   6.839  -1.321   2.869
  883    HG2  ARG 109           HG2      ARG 109   7.671  -3.281   1.651
  884    HG3  ARG 109           HG3      ARG 109   9.180  -3.186   2.565
  885    HD2  ARG 109           HD2      ARG 109   7.702  -3.286   4.644
  886    HD3  ARG 109           HD3      ARG 109   6.419  -3.805   3.558
  887    HE   ARG 109           HE       ARG 109   8.080  -5.632   2.904
  888   HH11  ARG 109          HH11      ARG 109   7.900  -4.230   6.105
  889   HH12  ARG 109          HH12      ARG 109   8.470  -5.654   6.908
  890   HH21  ARG 109          HH21      ARG 109   8.839  -7.522   3.960
  891   HH22  ARG 109          HH22      ARG 109   8.996  -7.532   5.685
  892    H    SER 110           H        SER 110   7.254   1.174   0.485
  893    HA   SER 110           HA       SER 110   8.343   3.467   1.664
  894    HB2  SER 110           HB2      SER 110   7.218   3.430  -0.549
  895    HB3  SER 110           HB3      SER 110   5.676   3.183   0.262
  896    HG   SER 110           HG       SER 110   7.316   5.459   0.180
  897    H    ARG 111           H        ARG 111   7.046   5.095   2.910
  898    HA   ARG 111           HA       ARG 111   6.610   3.736   5.375
  899    HB2  ARG 111           HB2      ARG 111   6.226   6.678   4.908
  900    HB3  ARG 111           HB3      ARG 111   6.719   5.857   6.390
  901    HG2  ARG 111           HG2      ARG 111   8.746   5.065   5.027
  902    HG3  ARG 111           HG3      ARG 111   8.289   6.331   3.886
  903    HD2  ARG 111           HD2      ARG 111   9.932   7.239   5.346
  904    HD3  ARG 111           HD3      ARG 111   8.383   7.944   5.805
  905    HE   ARG 111           HE       ARG 111   8.901   5.627   7.351
  906   HH11  ARG 111          HH11      ARG 111  10.008   8.935   6.971
  907   HH12  ARG 111          HH12      ARG 111  10.440   9.119   8.643
  908   HH21  ARG 111          HH21      ARG 111   9.422   5.895   9.559
  909   HH22  ARG 111          HH22      ARG 111  10.140   7.374  10.113
  910    H    ALA 112           H        ALA 112   4.482   5.461   3.129
  911    HA   ALA 112           HA       ALA 112   2.196   5.452   4.772
  912    HB1  ALA 112           HB1      ALA 112   0.900   5.737   2.735
  913    HB2  ALA 112           HB2      ALA 112   2.294   5.263   1.765
  914    HB3  ALA 112           HB3      ALA 112   2.339   6.758   2.700
  915    H    ARG 113           H        ARG 113   3.728   2.964   2.882
  916    HA   ARG 113           HA       ARG 113   1.514   1.146   2.851
  917    HB2  ARG 113           HB2      ARG 113   4.442   0.408   2.711
  918    HB3  ARG 113           HB3      ARG 113   3.077  -0.510   2.097
  919    HG2  ARG 113           HG2      ARG 113   2.691   1.165   0.388
  920    HG3  ARG 113           HG3      ARG 113   4.016   2.140   1.029
  921    HD2  ARG 113           HD2      ARG 113   5.534   0.192   0.611
  922    HD3  ARG 113           HD3      ARG 113   4.191  -0.597  -0.205
  923    HE   ARG 113           HE       ARG 113   4.208   1.512  -1.665
  924   HH11  ARG 113          HH11      ARG 113   7.060  -0.098  -0.449
  925   HH12  ARG 113          HH12      ARG 113   8.105   0.558  -1.663
  926   HH21  ARG 113          HH21      ARG 113   5.575   2.300  -3.319
  927   HH22  ARG 113          HH22      ARG 113   7.258   1.890  -3.296
  928    H    ILE 114           H        ILE 114   4.314   1.710   4.862
  929    HA   ILE 114           HA       ILE 114   4.014  -0.567   6.501
  930    HB   ILE 114           HB       ILE 114   5.467   2.011   7.103
  931   HG12  ILE 114          HG12      ILE 114   6.567  -0.570   6.055
  932   HG13  ILE 114          HG13      ILE 114   6.162   0.776   5.005
  933   HG21  ILE 114          HG21      ILE 114   5.285  -0.643   8.433
  934   HG22  ILE 114          HG22      ILE 114   5.340   0.971   9.145
  935   HG23  ILE 114          HG23      ILE 114   6.807   0.237   8.496
  936   HD11  ILE 114          HD11      ILE 114   8.203   0.819   7.218
  937   HD12  ILE 114          HD12      ILE 114   7.821   2.155   6.133
  938   HD13  ILE 114          HD13      ILE 114   8.551   0.682   5.495
  939    H    VAL 115           H        VAL 115   3.411   2.886   7.102
  940    HA   VAL 115           HA       VAL 115   2.635   2.497   9.764
  941    HB   VAL 115           HB       VAL 115   1.955   4.806   9.803
  942   HG11  VAL 115          HG11      VAL 115   4.373   4.239   9.732
  943   HG12  VAL 115          HG12      VAL 115   3.997   5.855   9.130
  944   HG13  VAL 115          HG13      VAL 115   4.348   4.552   7.996
  945   HG21  VAL 115          HG21      VAL 115   1.864   6.184   7.794
  946   HG22  VAL 115          HG22      VAL 115   0.693   4.868   7.708
  947   HG23  VAL 115          HG23      VAL 115   2.202   4.767   6.798
  948    H    ASP 116           H        ASP 116   0.803   2.575   6.827
  949    HA   ASP 116           HA       ASP 116  -1.722   2.622   8.136
  950    HB2  ASP 116           HB2      ASP 116  -0.691   2.516   5.436
  951    HB3  ASP 116           HB3      ASP 116  -2.071   1.459   5.658
  952    H    LYS 117           H        LYS 117   0.543   0.116   7.141
  953    HA   LYS 117           HA       LYS 117  -1.433  -1.952   7.444
  954    HB2  LYS 117           HB2      LYS 117   0.717  -1.909   5.916
  955    HB3  LYS 117           HB3      LYS 117   1.488  -2.573   7.351
  956    HG2  LYS 117           HG2      LYS 117   0.809  -4.367   5.894
  957    HG3  LYS 117           HG3      LYS 117  -0.170  -4.401   7.361
  958    HD2  LYS 117           HD2      LYS 117  -1.924  -3.103   6.073
  959    HD3  LYS 117           HD3      LYS 117  -0.973  -3.420   4.623
  960    HE2  LYS 117           HE2      LYS 117  -1.994  -5.575   6.463
  961    HE3  LYS 117           HE3      LYS 117  -2.875  -5.006   5.047
  962    HZ1  LYS 117           HZ1      LYS 117  -1.458  -6.017   3.633
  963    HZ2  LYS 117           HZ2      LYS 117  -1.230  -7.053   4.969
  964    HZ3  LYS 117           HZ3      LYS 117  -0.111  -5.824   4.645
  965    H    LEU 118           H        LEU 118   0.983  -0.443   9.451
  966    HA   LEU 118           HA       LEU 118   1.076  -2.315  11.543
  967    HB2  LEU 118           HB2      LEU 118   1.253   0.685  11.593
  968    HB3  LEU 118           HB3      LEU 118   1.448  -0.301  13.022
  969    HG   LEU 118           HG       LEU 118   3.279   0.003  10.684
  970   HD11  LEU 118          HD11      LEU 118   4.884   0.336  12.502
  971   HD12  LEU 118          HD12      LEU 118   3.607   0.016  13.682
  972   HD13  LEU 118          HD13      LEU 118   3.511   1.434  12.639
  973   HD21  LEU 118          HD21      LEU 118   2.965  -2.420  10.948
  974   HD22  LEU 118          HD22      LEU 118   3.337  -2.273  12.665
  975   HD23  LEU 118          HD23      LEU 118   4.573  -1.911  11.463
  976    H    LEU 119           H        LEU 119  -1.056   0.460  11.045
  977    HA   LEU 119           HA       LEU 119  -2.649   0.158  13.326
  978    HB2  LEU 119           HB2      LEU 119  -3.072   1.407  10.639
  979    HB3  LEU 119           HB3      LEU 119  -4.417   1.285  11.754
  980    HG   LEU 119           HG       LEU 119  -3.395   3.497  11.873
  981   HD11  LEU 119          HD11      LEU 119  -3.045   3.609  14.286
  982   HD12  LEU 119          HD12      LEU 119  -2.895   1.854  14.347
  983   HD13  LEU 119          HD13      LEU 119  -4.425   2.592  13.873
  984   HD21  LEU 119          HD21      LEU 119  -0.883   2.071  12.759
  985   HD22  LEU 119          HD22      LEU 119  -1.140   3.817  12.780
  986   HD23  LEU 119          HD23      LEU 119  -1.103   2.950  11.243
  987    H    ALA 120           H        ALA 120  -2.686  -1.432  10.247
  988    HA   ALA 120           HA       ALA 120  -5.291  -2.570  10.479
  989    HB1  ALA 120           HB1      ALA 120  -2.993  -3.437   8.731
  990    HB2  ALA 120           HB2      ALA 120  -4.138  -2.154   8.337
  991    HB3  ALA 120           HB3      ALA 120  -4.701  -3.821   8.503
  992    H    LEU 121           H        LEU 121  -1.994  -3.842  10.946
  993    HA   LEU 121           HA       LEU 121  -2.744  -6.407  11.856
  994    HB2  LEU 121           HB2      LEU 121  -0.295  -4.715  12.057
  995    HB3  LEU 121           HB3      LEU 121  -0.420  -6.125  13.085
  996    HG   LEU 121           HG       LEU 121  -0.595  -7.564  11.131
  997   HD11  LEU 121          HD11      LEU 121  -1.708  -6.076   9.580
  998   HD12  LEU 121          HD12      LEU 121  -0.201  -6.673   8.883
  999   HD13  LEU 121          HD13      LEU 121  -0.286  -5.034   9.532
 1000   HD21  LEU 121          HD21      LEU 121   1.587  -7.092  12.058
 1001   HD22  LEU 121          HD22      LEU 121   1.720  -5.636  11.070
 1002   HD23  LEU 121          HD23      LEU 121   1.700  -7.228  10.301
 1003    H    GLY 122           H        GLY 122  -2.740  -3.314  13.369
 1004    HA2  GLY 122           HA2      GLY 122  -3.491  -2.703  15.473
 1005    HA3  GLY 122           HA3      GLY 122  -3.718  -4.407  15.853
 1006    H    LEU 123           H        LEU 123  -0.733  -3.089  14.609
 1007    HA   LEU 123           HA       LEU 123   0.705  -4.073  16.911
 1008    HB2  LEU 123           HB2      LEU 123   1.552  -2.718  14.360
 1009    HB3  LEU 123           HB3      LEU 123   2.690  -3.113  15.638
 1010    HG   LEU 123           HG       LEU 123   1.022  -5.084  14.072
 1011   HD11  LEU 123          HD11      LEU 123   3.205  -5.845  13.232
 1012   HD12  LEU 123          HD12      LEU 123   3.976  -4.501  14.073
 1013   HD13  LEU 123          HD13      LEU 123   2.842  -4.187  12.762
 1014   HD21  LEU 123          HD21      LEU 123   3.033  -5.523  16.272
 1015   HD22  LEU 123          HD22      LEU 123   2.340  -6.792  15.265
 1016   HD23  LEU 123          HD23      LEU 123   1.303  -5.860  16.343
 1017    H    VAL 124           H        VAL 124  -0.567  -1.162  15.715
 1018    HA   VAL 124           HA       VAL 124   0.240   0.201  18.175
 1019    HB   VAL 124           HB       VAL 124   0.568   2.317  16.903
 1020   HG11  VAL 124          HG11      VAL 124   2.486   0.996  17.659
 1021   HG12  VAL 124          HG12      VAL 124   2.825   1.807  16.130
 1022   HG13  VAL 124          HG13      VAL 124   2.454   0.084  16.150
 1023   HG21  VAL 124          HG21      VAL 124   0.376   0.451  14.553
 1024   HG22  VAL 124          HG22      VAL 124   1.088   2.059  14.456
 1025   HG23  VAL 124          HG23      VAL 124  -0.609   1.872  14.890
 1026    H    ALA 125           H        ALA 125  -1.011   2.304  18.326
 1027    HA   ALA 125           HA       ALA 125  -3.793   1.826  17.447
 1028    HB1  ALA 125           HB1      ALA 125  -4.490   3.102  19.420
 1029    HB2  ALA 125           HB2      ALA 125  -2.801   3.303  19.886
 1030    HB3  ALA 125           HB3      ALA 125  -3.528   1.696  19.875
 1031    H    GLU 126           H        GLU 126  -1.068   3.836  17.365
 1032    HA   GLU 126           HA       GLU 126  -2.442   5.720  15.621
 1033    HB2  GLU 126           HB2      GLU 126  -1.565   7.665  16.807
 1034    HB3  GLU 126           HB3      GLU 126  -2.590   6.715  17.875
 1035    HG2  GLU 126           HG2      GLU 126  -0.557   5.676  18.828
 1036    HG3  GLU 126           HG3      GLU 126   0.417   6.750  17.832
 1037    H    ARG 127           H        ARG 127  -0.765   7.202  14.584
 1038    HA   ARG 127           HA       ARG 127   1.452   5.594  13.733
 1039    HB2  ARG 127           HB2      ARG 127   0.520   8.347  12.981
 1040    HB3  ARG 127           HB3      ARG 127   2.016   7.667  12.362
 1041    HG2  ARG 127           HG2      ARG 127   0.708   5.760  11.452
 1042    HG3  ARG 127           HG3      ARG 127  -0.769   6.603  11.942
 1043    HD2  ARG 127           HD2      ARG 127  -0.043   8.529  10.560
 1044    HD3  ARG 127           HD3      ARG 127   1.330   7.568  10.026
 1045    HE   ARG 127           HE       ARG 127  -0.756   6.003   9.369
 1046   HH11  ARG 127          HH11      ARG 127  -0.111   9.398   8.818
 1047   HH12  ARG 127          HH12      ARG 127  -0.903   9.429   7.273
 1048   HH21  ARG 127          HH21      ARG 127  -1.813   6.044   7.311
 1049   HH22  ARG 127          HH22      ARG 127  -1.872   7.546   6.438
 1050    H    ARG 128           H        ARG 128   0.961   7.989  16.127
 1051    HA   ARG 128           HA       ARG 128   3.434   9.240  16.290
 1052    HB2  ARG 128           HB2      ARG 128   1.445   9.859  17.615
 1053    HB3  ARG 128           HB3      ARG 128   1.661   8.411  18.588
 1054    HG2  ARG 128           HG2      ARG 128   4.041   9.408  18.996
 1055    HG3  ARG 128           HG3      ARG 128   3.252  10.924  18.550
 1056    HD2  ARG 128           HD2      ARG 128   2.715   9.113  20.874
 1057    HD3  ARG 128           HD3      ARG 128   3.020  10.846  20.863
 1058    HE   ARG 128           HE       ARG 128   0.569  10.016  19.557
 1059   HH11  ARG 128          HH11      ARG 128   2.058  11.078  22.549
 1060   HH12  ARG 128          HH12      ARG 128   0.551  11.544  23.277
 1061   HH21  ARG 128          HH21      ARG 128  -1.396  10.619  20.507
 1062   HH22  ARG 128          HH22      ARG 128  -1.417  11.286  22.109
 1063    H    GLU 129           H        GLU 129   2.426   6.107  17.540
 1064    HA   GLU 129           HA       GLU 129   4.570   5.639  19.286
 1065    HB2  GLU 129           HB2      GLU 129   2.910   3.627  17.755
 1066    HB3  GLU 129           HB3      GLU 129   3.877   3.298  19.186
 1067    HG2  GLU 129           HG2      GLU 129   2.463   4.609  20.558
 1068    HG3  GLU 129           HG3      GLU 129   1.615   5.263  19.155
 1069    H    LEU 130           H        LEU 130   4.322   5.336  15.833
 1070    HA   LEU 130           HA       LEU 130   6.729   3.702  15.696
 1071    HB2  LEU 130           HB2      LEU 130   6.129   4.115  13.107
 1072    HB3  LEU 130           HB3      LEU 130   5.473   2.800  14.060
 1073    HG   LEU 130           HG       LEU 130   3.998   5.405  13.885
 1074   HD11  LEU 130          HD11      LEU 130   3.955   3.177  11.868
 1075   HD12  LEU 130          HD12      LEU 130   4.440   4.850  11.599
 1076   HD13  LEU 130          HD13      LEU 130   2.760   4.468  11.972
 1077   HD21  LEU 130          HD21      LEU 130   3.126   3.864  15.491
 1078   HD22  LEU 130          HD22      LEU 130   3.204   2.533  14.334
 1079   HD23  LEU 130          HD23      LEU 130   2.053   3.845  14.089
 1080    H    TYR 131           H        TYR 131   6.131   6.837  16.076
 1081    HA   TYR 131           HA       TYR 131   8.728   7.504  14.863
 1082    HB2  TYR 131           HB2      TYR 131   6.410   9.432  15.211
 1083    HB3  TYR 131           HB3      TYR 131   7.984   9.806  14.522
 1084    HD1  TYR 131           HD1      TYR 131   4.665   8.732  13.849
 1085    HD2  TYR 131           HD2      TYR 131   8.641   8.572  12.353
 1086    HE1  TYR 131           HE1      TYR 131   3.793   8.171  11.627
 1087    HE2  TYR 131           HE2      TYR 131   7.784   8.009  10.116
 1088    HH   TYR 131           HH       TYR 131   4.481   8.302   9.295
 1089    H    LYS 132           H        LYS 132   9.908   7.179  16.711
 1090    HA   LYS 132           HA       LYS 132   8.838   7.267  19.264
 1091    HB2  LYS 132           HB2      LYS 132  10.906   6.049  18.591
 1092    HB3  LYS 132           HB3      LYS 132  11.759   7.587  18.592
 1093    HG2  LYS 132           HG2      LYS 132  11.397   7.863  20.940
 1094    HG3  LYS 132           HG3      LYS 132  10.339   6.453  20.988
 1095    HD2  LYS 132           HD2      LYS 132  12.259   5.044  20.313
 1096    HD3  LYS 132           HD3      LYS 132  13.297   6.469  20.397
 1097    HE2  LYS 132           HE2      LYS 132  13.462   5.133  22.436
 1098    HE3  LYS 132           HE3      LYS 132  12.774   6.722  22.766
 1099    HZ1  LYS 132           HZ1      LYS 132  11.578   4.974  23.923
 1100    HZ2  LYS 132           HZ2      LYS 132  11.229   4.201  22.460
 1101    HZ3  LYS 132           HZ3      LYS 132  10.573   5.726  22.790
 1102    H    LYS 133           H        LYS 133   7.854   9.034  19.921
 1103    HA   LYS 133           HA       LYS 133   9.074  11.647  19.804
 1104    HB2  LYS 133           HB2      LYS 133   6.569  11.106  19.616
 1105    HB3  LYS 133           HB3      LYS 133   6.611  10.825  21.348
 1106    HG2  LYS 133           HG2      LYS 133   5.794  13.038  20.907
 1107    HG3  LYS 133           HG3      LYS 133   7.377  13.145  21.678
 1108    HD2  LYS 133           HD2      LYS 133   8.436  13.611  19.566
 1109    HD3  LYS 133           HD3      LYS 133   6.927  13.323  18.701
 1110    HE2  LYS 133           HE2      LYS 133   7.338  15.507  20.736
 1111    HE3  LYS 133           HE3      LYS 133   7.486  15.730  18.997
 1112    HZ1  LYS 133           HZ1      LYS 133   5.037  14.916  20.462
 1113    HZ2  LYS 133           HZ2      LYS 133   5.165  15.020  18.780
 1114    HZ3  LYS 133           HZ3      LYS 133   5.318  16.412  19.727
 1115    H    ARG 134           H        ARG 134   9.566  12.877  21.785
 1116    HA   ARG 134           HA       ARG 134  10.837  11.084  23.695
 1117    HB2  ARG 134           HB2      ARG 134  11.082  14.082  23.336
 1118    HB3  ARG 134           HB3      ARG 134  11.915  13.171  24.585
 1119    HG2  ARG 134           HG2      ARG 134  13.470  13.529  22.829
 1120    HG3  ARG 134           HG3      ARG 134  12.997  11.832  22.751
 1121    HD2  ARG 134           HD2      ARG 134  11.309  12.507  21.008
 1122    HD3  ARG 134           HD3      ARG 134  12.078  14.090  20.982
 1123    HE   ARG 134           HE       ARG 134  14.041  12.128  20.582
 1124   HH11  ARG 134          HH11      ARG 134  11.309  13.580  18.944
 1125   HH12  ARG 134          HH12      ARG 134  11.862  13.153  17.357
 1126   HH21  ARG 134          HH21      ARG 134  14.776  11.569  18.473
 1127   HH22  ARG 134          HH22      ARG 134  13.829  12.016  17.094
 1128    H    GLN 135           H        GLN 135   8.975  10.338  24.611
 1129    HA   GLN 135           HA       GLN 135   7.173  12.216  25.908
 1130    HB2  GLN 135           HB2      GLN 135   7.016   9.234  25.434
 1131    HB3  GLN 135           HB3      GLN 135   5.789  10.153  26.299
 1132    HG2  GLN 135           HG2      GLN 135   5.252  11.415  24.351
 1133    HG3  GLN 135           HG3      GLN 135   6.635  10.765  23.478
 1134   HE21  GLN 135          HE21      GLN 135   6.258   8.049  24.325
 1135   HE22  GLN 135          HE22      GLN 135   4.881   7.449  23.463
 1136    H    LYS 136           H        LYS 136   8.110  12.921  27.758
 1137    HA   LYS 136           HA       LYS 136   9.310  10.982  29.575
 1138    HB2  LYS 136           HB2      LYS 136   9.008  13.966  29.966
 1139    HB3  LYS 136           HB3      LYS 136  10.072  12.884  30.852
 1140    HG2  LYS 136           HG2      LYS 136  10.313  13.795  27.999
 1141    HG3  LYS 136           HG3      LYS 136  11.428  14.089  29.332
 1142    HD2  LYS 136           HD2      LYS 136  10.848  11.414  28.056
 1143    HD3  LYS 136           HD3      LYS 136  12.296  12.389  27.805
 1144    HE2  LYS 136           HE2      LYS 136  12.852  12.161  30.180
 1145    HE3  LYS 136           HE3      LYS 136  11.401  11.189  30.425
 1146    HZ1  LYS 136           HZ1      LYS 136  13.704  10.475  28.694
 1147    HZ2  LYS 136           HZ2      LYS 136  12.299   9.556  28.863
 1148    HZ3  LYS 136           HZ3      LYS 136  13.326   9.778  30.187
 1149    H    LYS 137           H        LYS 137   6.873  10.270  29.336
 1150    HA   LYS 137           HA       LYS 137   5.558  10.941  31.838
 1151    HB2  LYS 137           HB2      LYS 137   4.574  12.528  30.240
 1152    HB3  LYS 137           HB3      LYS 137   4.219  11.215  29.129
 1153    HG2  LYS 137           HG2      LYS 137   2.206  11.854  30.246
 1154    HG3  LYS 137           HG3      LYS 137   2.689  10.259  30.828
 1155    HD2  LYS 137           HD2      LYS 137   3.712  11.335  32.804
 1156    HD3  LYS 137           HD3      LYS 137   3.115  12.894  32.232
 1157    HE2  LYS 137           HE2      LYS 137   0.831  12.125  32.414
 1158    HE3  LYS 137           HE3      LYS 137   1.379  10.515  32.875
 1159    HZ1  LYS 137           HZ1      LYS 137   0.703  11.789  34.802
 1160    HZ2  LYS 137           HZ2      LYS 137   1.815  13.005  34.430
 1161    HZ3  LYS 137           HZ3      LYS 137   2.360  11.467  34.868
 1162    H    LEU 138           H        LEU 138   4.253   9.181  32.572
 1163    HA   LEU 138           HA       LEU 138   4.801   6.665  31.326
 1164    HB2  LEU 138           HB2      LEU 138   4.561   6.833  33.752
 1165    HB3  LEU 138           HB3      LEU 138   2.898   7.353  33.568
 1166    HG   LEU 138           HG       LEU 138   2.373   5.139  32.541
 1167   HD11  LEU 138          HD11      LEU 138   3.972   3.313  32.821
 1168   HD12  LEU 138          HD12      LEU 138   5.176   4.457  33.414
 1169   HD13  LEU 138          HD13      LEU 138   4.599   4.568  31.752
 1170   HD21  LEU 138          HD21      LEU 138   1.921   5.582  34.897
 1171   HD22  LEU 138          HD22      LEU 138   3.551   5.053  35.318
 1172   HD23  LEU 138          HD23      LEU 138   2.396   3.904  34.645
 1173    H    ALA 139           H        ALA 139   3.975   7.206  29.240
 1174    HA   ALA 139           HA       ALA 139   1.106   6.585  29.026
 1175    HB1  ALA 139           HB1      ALA 139   1.025   7.893  26.962
 1176    HB2  ALA 139           HB2      ALA 139   2.720   8.331  27.162
 1177    HB3  ALA 139           HB3      ALA 139   1.520   8.901  28.322
 1178    H    SER 140           H        SER 140   0.552   5.143  27.341
 1179    HA   SER 140           HA       SER 140   2.808   3.493  26.474
 1180    HB2  SER 140           HB2      SER 140  -0.145   2.843  26.414
 1181    HB3  SER 140           HB3      SER 140   1.189   1.722  26.133
 1182    HG   SER 140           HG       SER 140   1.402   3.072  28.498
 1183    H    SER 141           H        SER 141   3.443   4.902  24.782
 1184    HA   SER 141           HA       SER 141   2.075   4.312  22.314
 1185    HB2  SER 141           HB2      SER 141   2.714   7.139  23.211
 1186    HB3  SER 141           HB3      SER 141   2.329   6.703  21.546
 1187    HG   SER 141           HG       SER 141   0.303   6.766  22.059
  Start of MODEL   20
    1    H1   ASP   1           HT1      ASP   1 -19.385  12.577  -9.631
    2    H2   ASP   1           HT2      ASP   1 -19.147  13.119  -8.049
    3    H3   ASP   1           HT3      ASP   1 -20.535  13.575  -8.902
    4    HA   ASP   1           HA       ASP   1 -19.859  10.803  -8.133
    5    HB2  ASP   1           HB2      ASP   1 -21.774  12.792  -6.906
    6    HB3  ASP   1           HB3      ASP   1 -21.823  11.065  -6.570
    7    HA   PRO   2           HA       PRO   2 -22.705   9.600 -11.213
    8    HB2  PRO   2           HB2      PRO   2 -23.813   7.368 -10.099
    9    HB3  PRO   2           HB3      PRO   2 -22.192   7.420 -10.795
   10    HG2  PRO   2           HG2      PRO   2 -23.032   7.579  -7.934
   11    HG3  PRO   2           HG3      PRO   2 -21.659   6.720  -8.654
   12    HD2  PRO   2           HD2      PRO   2 -21.389   9.094  -7.378
   13    HD3  PRO   2           HD3      PRO   2 -20.354   8.615  -8.738
   14    H    SER   3           H        SER   3 -24.430   8.790  -8.189
   15    HA   SER   3           HA       SER   3 -26.865   9.813  -9.423
   16    HB2  SER   3           HB2      SER   3 -27.901   8.616  -7.397
   17    HB3  SER   3           HB3      SER   3 -27.122   7.607  -8.617
   18    HG   SER   3           HG       SER   3 -26.271   6.893  -6.747
   19    H    ARG   4           H        ARG   4 -25.277   9.942  -6.247
   20    HA   ARG   4           HA       ARG   4 -26.311  12.670  -5.886
   21    HB2  ARG   4           HB2      ARG   4 -26.354  10.453  -3.830
   22    HB3  ARG   4           HB3      ARG   4 -26.734  12.131  -3.495
   23    HG2  ARG   4           HG2      ARG   4 -28.272  10.526  -5.509
   24    HG3  ARG   4           HG3      ARG   4 -28.670  10.508  -3.792
   25    HD2  ARG   4           HD2      ARG   4 -30.078  12.129  -4.737
   26    HD3  ARG   4           HD3      ARG   4 -28.794  13.037  -3.944
   27    HE   ARG   4           HE       ARG   4 -28.176  12.570  -6.679
   28   HH11  ARG   4          HH11      ARG   4 -30.144  14.549  -4.563
   29   HH12  ARG   4          HH12      ARG   4 -30.281  15.857  -5.695
   30   HH21  ARG   4          HH21      ARG   4 -28.352  14.280  -8.176
   31   HH22  ARG   4          HH22      ARG   4 -29.254  15.701  -7.768
   32    H    ARG   5           H        ARG   5 -25.033  13.966  -4.467
   33    HA   ARG   5           HA       ARG   5 -22.268  13.344  -4.295
   34    HB2  ARG   5           HB2      ARG   5 -23.013  15.657  -4.341
   35    HB3  ARG   5           HB3      ARG   5 -23.956  15.422  -2.880
   36    HG2  ARG   5           HG2      ARG   5 -21.006  14.985  -2.807
   37    HG3  ARG   5           HG3      ARG   5 -21.647  16.629  -2.795
   38    HD2  ARG   5           HD2      ARG   5 -23.020  16.045  -0.831
   39    HD3  ARG   5           HD3      ARG   5 -22.312  14.432  -0.834
   40    HE   ARG   5           HE       ARG   5 -20.155  16.071  -0.698
   41   HH11  ARG   5          HH11      ARG   5 -23.093  15.755   1.165
   42   HH12  ARG   5          HH12      ARG   5 -22.381  16.334   2.633
   43   HH21  ARG   5          HH21      ARG   5 -19.200  16.816   1.244
   44   HH22  ARG   5          HH22      ARG   5 -20.163  16.934   2.681
   45    H    ALA   6           H        ALA   6 -21.256  12.085  -2.844
   46    HA   ALA   6           HA       ALA   6 -22.818  10.567  -1.039
   47    HB1  ALA   6           HB1      ALA   6 -20.722   9.547  -0.320
   48    HB2  ALA   6           HB2      ALA   6 -19.828  10.729  -1.282
   49    HB3  ALA   6           HB3      ALA   6 -20.891   9.569  -2.079
   50    HA   PRO   7           HA       PRO   7 -22.421  13.050   2.630
   51    HB2  PRO   7           HB2      PRO   7 -23.416  11.130   4.276
   52    HB3  PRO   7           HB3      PRO   7 -24.436  12.213   3.331
   53    HG2  PRO   7           HG2      PRO   7 -23.733   9.364   2.886
   54    HG3  PRO   7           HG3      PRO   7 -25.221  10.234   2.482
   55    HD2  PRO   7           HD2      PRO   7 -23.260   9.561   0.677
   56    HD3  PRO   7           HD3      PRO   7 -24.425  10.879   0.453
   57    H    THR   8           H        THR   8 -21.375  12.751   4.767
   58    HA   THR   8           HA       THR   8 -19.048  11.060   4.626
   59    HB   THR   8           HB       THR   8 -18.799  11.975   7.064
   60    HG1  THR   8           HG1      THR   8 -20.005  13.809   7.468
   61   HG21  THR   8          HG21      THR   8 -17.415  12.641   5.151
   62   HG22  THR   8          HG22      THR   8 -17.780  14.018   6.192
   63   HG23  THR   8          HG23      THR   8 -18.646  13.808   4.669
   64    H    TRP   9           H        TRP   9 -19.102   9.006   5.154
   65    HA   TRP   9           HA       TRP   9 -21.322   7.627   6.026
   66    HB2  TRP   9           HB2      TRP   9 -18.398   6.918   6.144
   67    HB3  TRP   9           HB3      TRP   9 -19.662   5.794   6.618
   68    HD1  TRP   9           HD1      TRP   9 -18.992   7.963   3.451
   69    HE1  TRP   9           HE1      TRP   9 -19.406   6.468   1.398
   70    HE3  TRP   9           HE3      TRP   9 -20.406   3.675   5.845
   71    HZ2  TRP   9           HZ2      TRP   9 -20.236   3.808   0.873
   72    HZ3  TRP   9           HZ3      TRP   9 -21.003   1.710   4.495
   73    HH2  TRP   9           HH2      TRP   9 -20.921   1.782   2.059
   74    H    SER  10           H        SER  10 -22.309   7.469   7.893
   75    HA   SER  10           HA       SER  10 -21.141   8.273  10.374
   76    HB2  SER  10           HB2      SER  10 -23.655   6.655   9.878
   77    HB3  SER  10           HB3      SER  10 -23.244   7.538  11.346
   78    HG   SER  10           HG       SER  10 -23.088   9.374   9.634
   79    HA   PRO  11           HA       PRO  11 -18.922   4.675  11.595
   80    HB2  PRO  11           HB2      PRO  11 -20.519   4.731  14.114
   81    HB3  PRO  11           HB3      PRO  11 -18.767   4.662  13.893
   82    HG2  PRO  11           HG2      PRO  11 -19.957   6.930  14.614
   83    HG3  PRO  11           HG3      PRO  11 -18.600   6.936  13.475
   84    HD2  PRO  11           HD2      PRO  11 -21.509   7.311  12.954
   85    HD3  PRO  11           HD3      PRO  11 -20.111   8.041  12.142
   86    H    GLU  12           H        GLU  12 -22.375   4.597  12.421
   87    HA   GLU  12           HA       GLU  12 -22.709   1.835  12.628
   88    HB2  GLU  12           HB2      GLU  12 -24.348   4.108  12.700
   89    HB3  GLU  12           HB3      GLU  12 -25.008   3.105  11.416
   90    HG2  GLU  12           HG2      GLU  12 -24.521   2.241  14.257
   91    HG3  GLU  12           HG3      GLU  12 -26.081   2.652  13.550
   92    H    GLU  13           H        GLU  13 -22.775   3.932   9.774
   93    HA   GLU  13           HA       GLU  13 -23.768   1.907   8.026
   94    HB2  GLU  13           HB2      GLU  13 -23.920   4.440   7.684
   95    HB3  GLU  13           HB3      GLU  13 -22.245   4.359   7.153
   96    HG2  GLU  13           HG2      GLU  13 -23.747   4.338   5.248
   97    HG3  GLU  13           HG3      GLU  13 -22.884   2.806   5.372
   98    H    GLU  14           H        GLU  14 -20.543   3.117   8.858
   99    HA   GLU  14           HA       GLU  14 -19.238   1.416   6.959
  100    HB2  GLU  14           HB2      GLU  14 -18.131   2.891   9.352
  101    HB3  GLU  14           HB3      GLU  14 -17.153   2.008   8.184
  102    HG2  GLU  14           HG2      GLU  14 -18.223   3.500   6.419
  103    HG3  GLU  14           HG3      GLU  14 -18.766   4.495   7.768
  104    H    ALA  15           H        ALA  15 -20.283   1.112  10.268
  105    HA   ALA  15           HA       ALA  15 -18.972  -1.339  10.834
  106    HB1  ALA  15           HB1      ALA  15 -19.956   0.040  12.594
  107    HB2  ALA  15           HB2      ALA  15 -20.632  -1.590  12.618
  108    HB3  ALA  15           HB3      ALA  15 -21.564  -0.257  11.934
  109    H    HIS  16           H        HIS  16 -21.664  -0.461   8.928
  110    HA   HIS  16           HA       HIS  16 -22.638  -3.169   8.610
  111    HB2  HIS  16           HB2      HIS  16 -24.233  -1.255   8.723
  112    HB3  HIS  16           HB3      HIS  16 -23.538  -0.626   7.235
  113    HD1  HIS  16           HD1      HIS  16 -25.797  -0.847   5.992
  114    HD2  HIS  16           HD2      HIS  16 -24.298  -4.434   7.440
  115    HE1  HIS  16           HE1      HIS  16 -27.151  -2.663   4.883
  116    HE2  HIS  16           HE2      HIS  16 -26.379  -4.793   5.965
  117    H    LEU  17           H        LEU  17 -20.715  -0.763   6.996
  118    HA   LEU  17           HA       LEU  17 -20.446  -2.021   4.489
  119    HB2  LEU  17           HB2      LEU  17 -19.757   0.322   5.076
  120    HB3  LEU  17           HB3      LEU  17 -18.390  -0.351   5.940
  121    HG   LEU  17           HG       LEU  17 -17.561  -1.324   3.823
  122   HD11  LEU  17          HD11      LEU  17 -18.561  -0.472   1.716
  123   HD12  LEU  17          HD12      LEU  17 -19.915   0.141   2.662
  124   HD13  LEU  17          HD13      LEU  17 -19.593  -1.591   2.600
  125   HD21  LEU  17          HD21      LEU  17 -16.724   0.819   4.562
  126   HD22  LEU  17          HD22      LEU  17 -18.080   1.639   3.783
  127   HD23  LEU  17          HD23      LEU  17 -16.879   0.796   2.805
  128    H    ARG  18           H        ARG  18 -18.510  -2.186   7.465
  129    HA   ARG  18           HA       ARG  18 -16.808  -4.250   6.497
  130    HB2  ARG  18           HB2      ARG  18 -15.923  -4.369   8.696
  131    HB3  ARG  18           HB3      ARG  18 -16.288  -2.672   8.427
  132    HG2  ARG  18           HG2      ARG  18 -18.372  -2.942   9.699
  133    HG3  ARG  18           HG3      ARG  18 -17.955  -4.627  10.001
  134    HD2  ARG  18           HD2      ARG  18 -15.831  -3.792  11.069
  135    HD3  ARG  18           HD3      ARG  18 -16.509  -2.168  10.958
  136    HE   ARG  18           HE       ARG  18 -18.229  -4.084  12.263
  137   HH11  ARG  18          HH11      ARG  18 -15.689  -1.706  12.697
  138   HH12  ARG  18          HH12      ARG  18 -15.975  -1.529  14.400
  139   HH21  ARG  18          HH21      ARG  18 -18.602  -3.852  14.504
  140   HH22  ARG  18          HH22      ARG  18 -17.636  -2.746  15.426
  141    H    GLU  19           H        GLU  19 -19.885  -4.051   8.069
  142    HA   GLU  19           HA       GLU  19 -20.193  -6.566   9.132
  143    HB2  GLU  19           HB2      GLU  19 -21.795  -4.703   9.373
  144    HB3  GLU  19           HB3      GLU  19 -22.296  -4.946   7.706
  145    HG2  GLU  19           HG2      GLU  19 -23.910  -5.942   9.133
  146    HG3  GLU  19           HG3      GLU  19 -23.017  -7.228   8.324
  147    H    LEU  20           H        LEU  20 -20.951  -5.434   5.880
  148    HA   LEU  20           HA       LEU  20 -21.745  -8.001   4.922
  149    HB2  LEU  20           HB2      LEU  20 -21.926  -5.317   4.087
  150    HB3  LEU  20           HB3      LEU  20 -21.042  -6.157   2.830
  151    HG   LEU  20           HG       LEU  20 -23.621  -7.293   3.848
  152   HD11  LEU  20          HD11      LEU  20 -24.061  -4.940   3.282
  153   HD12  LEU  20          HD12      LEU  20 -24.828  -6.059   2.157
  154   HD13  LEU  20          HD13      LEU  20 -23.357  -5.209   1.687
  155   HD21  LEU  20          HD21      LEU  20 -22.203  -8.654   2.401
  156   HD22  LEU  20          HD22      LEU  20 -22.203  -7.367   1.194
  157   HD23  LEU  20          HD23      LEU  20 -23.704  -8.205   1.589
  158    H    TYR  21           H        TYR  21 -18.750  -6.256   5.100
  159    HA   TYR  21           HA       TYR  21 -17.342  -7.774   3.133
  160    HB2  TYR  21           HB2      TYR  21 -16.499  -5.585   3.789
  161    HB3  TYR  21           HB3      TYR  21 -16.343  -6.114   5.459
  162    HD1  TYR  21           HD1      TYR  21 -14.302  -6.945   6.217
  163    HD2  TYR  21           HD2      TYR  21 -15.070  -6.888   2.034
  164    HE1  TYR  21           HE1      TYR  21 -11.992  -7.667   5.784
  165    HE2  TYR  21           HE2      TYR  21 -12.764  -7.603   1.592
  166    HH   TYR  21           HH       TYR  21 -10.634  -7.659   2.599
  167    H    LEU  22           H        LEU  22 -17.432  -7.811   6.658
  168    HA   LEU  22           HA       LEU  22 -15.710 -10.000   7.011
  169    HB2  LEU  22           HB2      LEU  22 -17.944  -9.176   8.856
  170    HB3  LEU  22           HB3      LEU  22 -16.461 -10.005   9.284
  171    HG   LEU  22           HG       LEU  22 -16.592  -7.179   8.239
  172   HD11  LEU  22          HD11      LEU  22 -17.644  -7.337  10.416
  173   HD12  LEU  22          HD12      LEU  22 -16.106  -6.479  10.505
  174   HD13  LEU  22          HD13      LEU  22 -16.215  -8.150  11.058
  175   HD21  LEU  22          HD21      LEU  22 -14.296  -6.999   8.871
  176   HD22  LEU  22          HD22      LEU  22 -14.477  -8.392   7.803
  177   HD23  LEU  22          HD23      LEU  22 -14.302  -8.631   9.540
  178    H    ALA  23           H        ALA  23 -18.979  -9.832   6.024
  179    HA   ALA  23           HA       ALA  23 -19.694 -12.508   6.776
  180    HB1  ALA  23           HB1      ALA  23 -21.353 -10.700   6.561
  181    HB2  ALA  23           HB2      ALA  23 -21.742 -12.101   5.563
  182    HB3  ALA  23           HB3      ALA  23 -21.051 -10.657   4.824
  183    H    ASN  24           H        ASN  24 -18.470 -10.959   3.815
  184    HA   ASN  24           HA       ASN  24 -18.621 -13.589   2.490
  185    HB2  ASN  24           HB2      ASN  24 -18.723 -10.820   1.284
  186    HB3  ASN  24           HB3      ASN  24 -18.627 -12.304   0.346
  187   HD21  ASN  24          HD21      ASN  24 -20.632 -10.246   2.264
  188   HD22  ASN  24          HD22      ASN  24 -22.128 -11.053   1.934
  189    H    LYS  25           H        LYS  25 -16.396 -12.097   4.103
  190    HA   LYS  25           HA       LYS  25 -14.372 -11.437   2.221
  191    HB2  LYS  25           HB2      LYS  25 -12.855 -11.400   4.182
  192    HB3  LYS  25           HB3      LYS  25 -14.310 -10.444   4.413
  193    HG2  LYS  25           HG2      LYS  25 -15.285 -12.227   5.760
  194    HG3  LYS  25           HG3      LYS  25 -13.841 -13.211   5.508
  195    HD2  LYS  25           HD2      LYS  25 -13.867 -10.505   6.848
  196    HD3  LYS  25           HD3      LYS  25 -13.888 -12.049   7.703
  197    HE2  LYS  25           HE2      LYS  25 -11.742 -12.627   6.634
  198    HE3  LYS  25           HE3      LYS  25 -11.724 -11.043   5.860
  199    HZ1  LYS  25           HZ1      LYS  25 -11.679 -11.558   8.782
  200    HZ2  LYS  25           HZ2      LYS  25 -11.713 -10.028   8.064
  201    HZ3  LYS  25           HZ3      LYS  25 -10.376 -11.036   7.841
  202    H    ASP  26           H        ASP  26 -15.337 -14.421   3.665
  203    HA   ASP  26           HA       ASP  26 -12.817 -15.687   2.830
  204    HB2  ASP  26           HB2      ASP  26 -13.686 -15.831   5.253
  205    HB3  ASP  26           HB3      ASP  26 -14.891 -16.943   4.615
  206    H    VAL  27           H        VAL  27 -15.507 -15.026   1.380
  207    HA   VAL  27           HA       VAL  27 -16.211 -17.704   0.446
  208    HB   VAL  27           HB       VAL  27 -17.442 -15.039  -0.282
  209   HG11  VAL  27          HG11      VAL  27 -18.388 -17.851  -0.824
  210   HG12  VAL  27          HG12      VAL  27 -17.745 -16.723  -2.017
  211   HG13  VAL  27          HG13      VAL  27 -19.271 -16.373  -1.208
  212   HG21  VAL  27          HG21      VAL  27 -17.797 -15.553   2.068
  213   HG22  VAL  27          HG22      VAL  27 -18.393 -17.159   1.645
  214   HG23  VAL  27          HG23      VAL  27 -19.304 -15.725   1.168
  215    H    GLU  28           H        GLU  28 -14.882 -18.481  -1.030
  216    HA   GLU  28           HA       GLU  28 -13.560 -16.721  -2.909
  217    HB2  GLU  28           HB2      GLU  28 -13.394 -19.712  -2.513
  218    HB3  GLU  28           HB3      GLU  28 -12.428 -18.798  -3.665
  219    HG2  GLU  28           HG2      GLU  28 -11.401 -17.555  -1.861
  220    HG3  GLU  28           HG3      GLU  28 -12.412 -18.394  -0.683
  221    H    GLY  29           H        GLY  29 -13.760 -16.869  -5.145
  222    HA2  GLY  29           HA2      GLY  29 -14.791 -17.529  -7.156
  223    HA3  GLY  29           HA3      GLY  29 -15.976 -18.434  -6.224
  224    H    GLN  30           H        GLN  30 -15.774 -15.630  -4.657
  225    HA   GLN  30           HA       GLN  30 -17.714 -14.241  -6.367
  226    HB2  GLN  30           HB2      GLN  30 -18.947 -15.391  -4.588
  227    HB3  GLN  30           HB3      GLN  30 -17.918 -14.644  -3.374
  228    HG2  GLN  30           HG2      GLN  30 -18.735 -12.417  -4.344
  229    HG3  GLN  30           HG3      GLN  30 -19.999 -13.367  -5.092
  230   HE21  GLN  30          HE21      GLN  30 -18.736 -12.107  -2.215
  231   HE22  GLN  30          HE22      GLN  30 -20.076 -12.464  -1.199
  232    H    ASP  31           H        ASP  31 -17.610 -12.019  -6.317
  233    HA   ASP  31           HA       ASP  31 -15.302 -10.753  -5.182
  234    HB2  ASP  31           HB2      ASP  31 -17.807  -9.675  -6.470
  235    HB3  ASP  31           HB3      ASP  31 -16.509  -8.638  -5.889
  236    H    VAL  32           H        VAL  32 -15.248 -10.671  -2.956
  237    HA   VAL  32           HA       VAL  32 -17.442 -10.187  -1.281
  238    HB   VAL  32           HB       VAL  32 -15.100 -10.795  -0.511
  239   HG11  VAL  32          HG11      VAL  32 -13.801  -9.189  -1.741
  240   HG12  VAL  32          HG12      VAL  32 -13.577  -8.898  -0.014
  241   HG13  VAL  32          HG13      VAL  32 -14.644  -7.850  -0.958
  242   HG21  VAL  32          HG21      VAL  32 -16.791 -10.199   1.096
  243   HG22  VAL  32          HG22      VAL  32 -16.490  -8.483   0.831
  244   HG23  VAL  32          HG23      VAL  32 -15.253  -9.488   1.584
  245    H    VAL  33           H        VAL  33 -15.395  -8.137  -3.169
  246    HA   VAL  33           HA       VAL  33 -16.035  -5.588  -2.378
  247    HB   VAL  33           HB       VAL  33 -15.788  -6.335  -5.273
  248   HG11  VAL  33          HG11      VAL  33 -16.134  -4.022  -4.919
  249   HG12  VAL  33          HG12      VAL  33 -14.438  -4.243  -5.339
  250   HG13  VAL  33          HG13      VAL  33 -14.902  -3.964  -3.663
  251   HG21  VAL  33          HG21      VAL  33 -14.106  -7.671  -4.314
  252   HG22  VAL  33          HG22      VAL  33 -13.612  -6.391  -3.209
  253   HG23  VAL  33          HG23      VAL  33 -13.293  -6.234  -4.936
  254    H    GLU  34           H        GLU  34 -17.533  -7.428  -5.037
  255    HA   GLU  34           HA       GLU  34 -19.524  -5.477  -5.474
  256    HB2  GLU  34           HB2      GLU  34 -18.750  -7.047  -7.236
  257    HB3  GLU  34           HB3      GLU  34 -19.571  -8.351  -6.385
  258    HG2  GLU  34           HG2      GLU  34 -21.699  -7.335  -6.724
  259    HG3  GLU  34           HG3      GLU  34 -20.951  -5.868  -7.361
  260    H    ALA  35           H        ALA  35 -19.413  -8.433  -3.575
  261    HA   ALA  35           HA       ALA  35 -22.140  -8.724  -3.022
  262    HB1  ALA  35           HB1      ALA  35 -21.464  -9.846  -0.961
  263    HB2  ALA  35           HB2      ALA  35 -19.834  -9.193  -1.130
  264    HB3  ALA  35           HB3      ALA  35 -20.448 -10.352  -2.311
  265    H    ILE  36           H        ILE  36 -19.704  -6.691  -1.547
  266    HA   ILE  36           HA       ILE  36 -21.381  -5.577   0.468
  267    HB   ILE  36           HB       ILE  36 -18.773  -4.615  -0.702
  268   HG12  ILE  36          HG12      ILE  36 -19.235  -6.040   1.909
  269   HG13  ILE  36          HG13      ILE  36 -18.847  -6.892   0.417
  270   HG21  ILE  36          HG21      ILE  36 -20.117  -3.815   1.868
  271   HG22  ILE  36          HG22      ILE  36 -20.032  -2.830   0.406
  272   HG23  ILE  36          HG23      ILE  36 -18.555  -3.245   1.279
  273   HD11  ILE  36          HD11      ILE  36 -17.154  -4.825   1.786
  274   HD12  ILE  36          HD12      ILE  36 -16.767  -5.612   0.256
  275   HD13  ILE  36          HD13      ILE  36 -16.871  -6.562   1.734
  276    H    LEU  37           H        LEU  37 -19.916  -4.161  -2.455
  277    HA   LEU  37           HA       LEU  37 -21.222  -1.688  -2.132
  278    HB2  LEU  37           HB2      LEU  37 -20.439  -1.230  -4.469
  279    HB3  LEU  37           HB3      LEU  37 -19.206  -1.666  -3.313
  280    HG   LEU  37           HG       LEU  37 -19.351  -4.031  -4.276
  281   HD11  LEU  37          HD11      LEU  37 -21.382  -3.908  -5.533
  282   HD12  LEU  37          HD12      LEU  37 -20.059  -4.028  -6.695
  283   HD13  LEU  37          HD13      LEU  37 -20.832  -2.474  -6.396
  284   HD21  LEU  37          HD21      LEU  37 -18.318  -1.781  -5.989
  285   HD22  LEU  37          HD22      LEU  37 -17.811  -3.467  -6.065
  286   HD23  LEU  37          HD23      LEU  37 -17.483  -2.512  -4.620
  287    H    ALA  38           H        ALA  38 -22.367  -4.598  -3.485
  288    HA   ALA  38           HA       ALA  38 -24.377  -3.379  -5.155
  289    HB1  ALA  38           HB1      ALA  38 -25.198  -5.669  -5.433
  290    HB2  ALA  38           HB2      ALA  38 -24.047  -6.213  -4.205
  291    HB3  ALA  38           HB3      ALA  38 -23.462  -5.547  -5.731
  292    H    HIS  39           H        HIS  39 -24.355  -5.115  -2.037
  293    HA   HIS  39           HA       HIS  39 -27.209  -4.913  -1.785
  294    HB2  HIS  39           HB2      HIS  39 -25.059  -5.849   0.112
  295    HB3  HIS  39           HB3      HIS  39 -26.757  -5.785   0.564
  296    HD1  HIS  39           HD1      HIS  39 -28.142  -7.775  -0.014
  297    HD2  HIS  39           HD2      HIS  39 -24.553  -7.691  -2.108
  298    HE1  HIS  39           HE1      HIS  39 -28.010  -9.980  -1.215
  299    HE2  HIS  39           HE2      HIS  39 -25.775  -9.960  -2.368
  300    H    LEU  40           H        LEU  40 -24.460  -3.067  -0.713
  301    HA   LEU  40           HA       LEU  40 -26.070  -1.545   1.154
  302    HB2  LEU  40           HB2      LEU  40 -23.184  -1.472   0.359
  303    HB3  LEU  40           HB3      LEU  40 -23.894  -0.179   1.303
  304    HG   LEU  40           HG       LEU  40 -24.432  -2.831   2.408
  305   HD11  LEU  40          HD11      LEU  40 -21.600  -1.829   2.224
  306   HD12  LEU  40          HD12      LEU  40 -22.241  -3.296   1.481
  307   HD13  LEU  40          HD13      LEU  40 -22.154  -3.159   3.240
  308   HD21  LEU  40          HD21      LEU  40 -23.187  -0.313   3.501
  309   HD22  LEU  40          HD22      LEU  40 -23.709  -1.705   4.449
  310   HD23  LEU  40          HD23      LEU  40 -24.896  -0.742   3.572
  311    H    ASN  41           H        ASN  41 -27.564  -0.812  -0.566
  312    HA   ASN  41           HA       ASN  41 -26.447   1.581  -1.869
  313    HB2  ASN  41           HB2      ASN  41 -28.799  -0.163  -2.573
  314    HB3  ASN  41           HB3      ASN  41 -28.696   1.497  -3.161
  315   HD21  ASN  41          HD21      ASN  41 -28.636  -1.000  -4.659
  316   HD22  ASN  41          HD22      ASN  41 -27.144  -1.002  -5.530
  317    H    THR  42           H        THR  42 -26.993   1.340   0.852
  318    HA   THR  42           HA       THR  42 -29.309   2.949   1.436
  319    HB   THR  42           HB       THR  42 -28.791   1.524   3.204
  320    HG1  THR  42           HG1      THR  42 -27.353   3.301   4.586
  321   HG21  THR  42          HG21      THR  42 -26.522   1.253   4.180
  322   HG22  THR  42          HG22      THR  42 -25.883   2.274   2.892
  323   HG23  THR  42          HG23      THR  42 -26.631   0.724   2.503
  324    H    VAL  43           H        VAL  43 -25.918   3.324   0.861
  325    HA   VAL  43           HA       VAL  43 -26.186   6.251   0.995
  326    HB   VAL  43           HB       VAL  43 -23.484   5.628   0.581
  327   HG11  VAL  43          HG11      VAL  43 -24.334   7.484   1.905
  328   HG12  VAL  43          HG12      VAL  43 -23.155   6.540   2.817
  329   HG13  VAL  43          HG13      VAL  43 -24.879   6.356   3.146
  330   HG21  VAL  43          HG21      VAL  43 -22.907   4.128   2.412
  331   HG22  VAL  43          HG22      VAL  43 -23.922   3.313   1.222
  332   HG23  VAL  43          HG23      VAL  43 -24.617   3.866   2.746
  333    HA   PRO  44           HA       PRO  44 -25.878   5.691  -3.469
  334    HB2  PRO  44           HB2      PRO  44 -26.517   8.464  -3.827
  335    HB3  PRO  44           HB3      PRO  44 -27.564   7.070  -4.089
  336    HG2  PRO  44           HG2      PRO  44 -27.908   8.965  -2.098
  337    HG3  PRO  44           HG3      PRO  44 -28.606   7.337  -2.089
  338    HD2  PRO  44           HD2      PRO  44 -26.210   8.386  -0.651
  339    HD3  PRO  44           HD3      PRO  44 -27.401   7.171  -0.137
  340    H    ARG  45           H        ARG  45 -23.782   5.484  -3.915
  341    HA   ARG  45           HA       ARG  45 -22.164   7.852  -4.359
  342    HB2  ARG  45           HB2      ARG  45 -20.508   5.948  -2.972
  343    HB3  ARG  45           HB3      ARG  45 -20.760   7.646  -2.618
  344    HG2  ARG  45           HG2      ARG  45 -21.986   7.175  -0.839
  345    HG3  ARG  45           HG3      ARG  45 -22.997   6.048  -1.745
  346    HD2  ARG  45           HD2      ARG  45 -20.321   5.009  -1.201
  347    HD3  ARG  45           HD3      ARG  45 -21.224   5.404   0.253
  348    HE   ARG  45           HE       ARG  45 -22.512   3.582  -0.112
  349   HH11  ARG  45          HH11      ARG  45 -20.925   4.308  -3.155
  350   HH12  ARG  45          HH12      ARG  45 -21.706   3.016  -4.004
  351   HH21  ARG  45          HH21      ARG  45 -23.498   1.847  -1.258
  352   HH22  ARG  45          HH22      ARG  45 -23.128   1.625  -2.936
  353    H    THR  46           H        THR  46 -19.886   7.015  -5.160
  354    HA   THR  46           HA       THR  46 -20.354   5.025  -7.191
  355    HB   THR  46           HB       THR  46 -18.876   6.962  -7.637
  356    HG1  THR  46           HG1      THR  46 -17.332   5.757  -8.721
  357   HG21  THR  46          HG21      THR  46 -17.839   7.242  -5.470
  358   HG22  THR  46          HG22      THR  46 -16.588   6.962  -6.678
  359   HG23  THR  46          HG23      THR  46 -17.077   5.660  -5.594
  360    H    ARG  47           H        ARG  47 -18.840   3.128  -7.398
  361    HA   ARG  47           HA       ARG  47 -19.016   1.552  -5.041
  362    HB2  ARG  47           HB2      ARG  47 -17.890   1.126  -7.780
  363    HB3  ARG  47           HB3      ARG  47 -17.501  -0.025  -6.511
  364    HG2  ARG  47           HG2      ARG  47 -19.409  -0.755  -7.854
  365    HG3  ARG  47           HG3      ARG  47 -19.855  -0.493  -6.172
  366    HD2  ARG  47           HD2      ARG  47 -21.571   0.371  -7.647
  367    HD3  ARG  47           HD3      ARG  47 -20.797   1.688  -6.767
  368    HE   ARG  47           HE       ARG  47 -19.512   1.331  -9.247
  369   HH11  ARG  47          HH11      ARG  47 -22.554   2.438  -7.920
  370   HH12  ARG  47          HH12      ARG  47 -22.869   3.538  -9.221
  371   HH21  ARG  47          HH21      ARG  47 -19.915   2.800 -10.955
  372   HH22  ARG  47          HH22      ARG  47 -21.365   3.754 -10.939
  373    H    LYS  48           H        LYS  48 -16.491   3.407  -6.521
  374    HA   LYS  48           HA       LYS  48 -14.194   2.573  -5.294
  375    HB2  LYS  48           HB2      LYS  48 -13.903   4.238  -6.851
  376    HB3  LYS  48           HB3      LYS  48 -15.240   5.194  -6.250
  377    HG2  LYS  48           HG2      LYS  48 -12.784   4.949  -4.580
  378    HG3  LYS  48           HG3      LYS  48 -12.768   5.998  -5.997
  379    HD2  LYS  48           HD2      LYS  48 -14.885   7.050  -5.070
  380    HD3  LYS  48           HD3      LYS  48 -14.549   6.175  -3.577
  381    HE2  LYS  48           HE2      LYS  48 -13.690   8.417  -3.403
  382    HE3  LYS  48           HE3      LYS  48 -12.343   7.282  -3.470
  383    HZ1  LYS  48           HZ1      LYS  48 -13.362   8.852  -5.778
  384    HZ2  LYS  48           HZ2      LYS  48 -12.022   7.822  -5.787
  385    HZ3  LYS  48           HZ3      LYS  48 -11.990   9.240  -4.869
  386    H    GLN  49           H        GLN  49 -16.838   4.333  -3.847
  387    HA   GLN  49           HA       GLN  49 -15.624   5.225  -1.496
  388    HB2  GLN  49           HB2      GLN  49 -18.440   4.464  -2.208
  389    HB3  GLN  49           HB3      GLN  49 -18.024   4.966  -0.573
  390    HG2  GLN  49           HG2      GLN  49 -17.280   6.653  -2.922
  391    HG3  GLN  49           HG3      GLN  49 -18.899   6.718  -2.233
  392   HE21  GLN  49          HE21      GLN  49 -16.735   8.714  -2.325
  393   HE22  GLN  49          HE22      GLN  49 -16.468   9.180  -0.684
  394    H    ILE  50           H        ILE  50 -17.414   2.218  -2.103
  395    HA   ILE  50           HA       ILE  50 -17.292   1.131   0.447
  396    HB   ILE  50           HB       ILE  50 -17.426  -0.183  -2.259
  397   HG12  ILE  50          HG12      ILE  50 -19.700  -0.877  -1.197
  398   HG13  ILE  50          HG13      ILE  50 -19.376   0.418  -0.054
  399   HG21  ILE  50          HG21      ILE  50 -16.253  -1.750  -0.839
  400   HG22  ILE  50          HG22      ILE  50 -17.897  -2.321  -1.131
  401   HG23  ILE  50          HG23      ILE  50 -17.481  -1.573   0.413
  402   HD11  ILE  50          HD11      ILE  50 -20.808   1.182  -1.848
  403   HD12  ILE  50          HD12      ILE  50 -19.601   0.702  -3.040
  404   HD13  ILE  50          HD13      ILE  50 -19.251   2.010  -1.909
  405    H    ILE  51           H        ILE  51 -15.060   0.649  -2.268
  406    HA   ILE  51           HA       ILE  51 -13.395  -1.193  -0.907
  407    HB   ILE  51           HB       ILE  51 -12.789   0.581  -3.273
  408   HG12  ILE  51          HG12      ILE  51 -12.794  -1.743  -4.404
  409   HG13  ILE  51          HG13      ILE  51 -13.641  -2.283  -2.965
  410   HG21  ILE  51          HG21      ILE  51 -11.106  -1.662  -2.163
  411   HG22  ILE  51          HG22      ILE  51 -10.717   0.056  -2.099
  412   HG23  ILE  51          HG23      ILE  51 -10.796  -0.769  -3.655
  413   HD11  ILE  51          HD11      ILE  51 -15.469  -0.817  -3.419
  414   HD12  ILE  51          HD12      ILE  51 -15.110  -1.737  -4.878
  415   HD13  ILE  51          HD13      ILE  51 -14.592  -0.058  -4.747
  416    H    HIS  52           H        HIS  52 -13.247   2.298  -1.340
  417    HA   HIS  52           HA       HIS  52 -10.708   2.680  -0.221
  418    HB2  HIS  52           HB2      HIS  52 -13.001   4.401  -0.902
  419    HB3  HIS  52           HB3      HIS  52 -11.920   5.034   0.335
  420    HD1  HIS  52           HD1      HIS  52 -10.193   6.493  -0.641
  421    HD2  HIS  52           HD2      HIS  52 -11.215   3.388  -3.218
  422    HE1  HIS  52           HE1      HIS  52  -8.736   6.786  -2.664
  423    HE2  HIS  52           HE2      HIS  52  -9.509   5.018  -4.286
  424    H    HIS  53           H        HIS  53 -13.932   2.786   1.329
  425    HA   HIS  53           HA       HIS  53 -12.914   3.615   3.844
  426    HB2  HIS  53           HB2      HIS  53 -15.466   2.158   3.174
  427    HB3  HIS  53           HB3      HIS  53 -15.088   2.808   4.765
  428    HD1  HIS  53           HD1      HIS  53 -14.179   5.557   4.289
  429    HD2  HIS  53           HD2      HIS  53 -17.222   3.839   2.020
  430    HE1  HIS  53           HE1      HIS  53 -15.440   7.480   3.291
  431    HE2  HIS  53           HE2      HIS  53 -17.102   6.419   1.736
  432    H    LEU  54           H        LEU  54 -13.381   0.461   2.420
  433    HA   LEU  54           HA       LEU  54 -13.175  -1.059   4.791
  434    HB2  LEU  54           HB2      LEU  54 -12.702  -1.758   1.905
  435    HB3  LEU  54           HB3      LEU  54 -12.579  -2.937   3.196
  436    HG   LEU  54           HG       LEU  54 -15.087  -1.351   2.625
  437   HD11  LEU  54          HD11      LEU  54 -14.461  -2.787   0.715
  438   HD12  LEU  54          HD12      LEU  54 -15.938  -3.318   1.514
  439   HD13  LEU  54          HD13      LEU  54 -14.425  -4.176   1.801
  440   HD21  LEU  54          HD21      LEU  54 -14.868  -2.238   4.919
  441   HD22  LEU  54          HD22      LEU  54 -14.626  -3.855   4.257
  442   HD23  LEU  54          HD23      LEU  54 -16.165  -3.027   4.022
  443    H    VAL  55           H        VAL  55 -10.766  -0.115   2.371
  444    HA   VAL  55           HA       VAL  55  -8.650  -1.466   3.779
  445    HB   VAL  55           HB       VAL  55  -7.165  -0.617   2.099
  446   HG11  VAL  55          HG11      VAL  55  -8.575  -2.469   1.439
  447   HG12  VAL  55          HG12      VAL  55  -8.289  -1.408   0.059
  448   HG13  VAL  55          HG13      VAL  55  -9.833  -1.353   0.910
  449   HG21  VAL  55          HG21      VAL  55  -7.867   0.984   0.383
  450   HG22  VAL  55          HG22      VAL  55  -7.946   1.697   1.995
  451   HG23  VAL  55          HG23      VAL  55  -9.424   1.168   1.191
  452    H    GLN  56           H        GLN  56 -10.101   1.645   3.799
  453    HA   GLN  56           HA       GLN  56  -7.930   3.005   5.081
  454    HB2  GLN  56           HB2      GLN  56 -10.697   3.653   4.254
  455    HB3  GLN  56           HB3      GLN  56 -10.027   4.609   5.559
  456    HG2  GLN  56           HG2      GLN  56  -8.128   5.217   4.135
  457    HG3  GLN  56           HG3      GLN  56  -8.812   4.251   2.827
  458   HE21  GLN  56          HE21      GLN  56 -10.653   4.972   1.780
  459   HE22  GLN  56          HE22      GLN  56 -11.177   6.618   1.865
  460    H    MET  57           H        MET  57 -10.652   1.121   6.107
  461    HA   MET  57           HA       MET  57 -10.419   1.986   8.854
  462    HB2  MET  57           HB2      MET  57 -12.129  -0.049   7.461
  463    HB3  MET  57           HB3      MET  57 -12.039   0.005   9.217
  464    HG2  MET  57           HG2      MET  57 -12.759   2.369   9.133
  465    HG3  MET  57           HG3      MET  57 -12.950   2.215   7.390
  466    HE1  MET  57           HE1      MET  57 -15.003   1.156   6.218
  467    HE2  MET  57           HE2      MET  57 -15.979  -0.108   6.964
  468    HE3  MET  57           HE3      MET  57 -14.254  -0.362   6.708
  469    H    GLY  58           H        GLY  58  -8.599   0.078   6.937
  470    HA2  GLY  58           HA2      GLY  58  -6.758  -1.192   7.480
  471    HA3  GLY  58           HA3      GLY  58  -7.148  -0.954   9.176
  472    H    LEU  59           H        LEU  59  -9.863  -2.112   7.682
  473    HA   LEU  59           HA       LEU  59  -9.414  -4.749   8.796
  474    HB2  LEU  59           HB2      LEU  59 -11.802  -5.131   8.268
  475    HB3  LEU  59           HB3      LEU  59 -11.514  -3.762   9.321
  476    HG   LEU  59           HG       LEU  59 -11.653  -2.372   7.119
  477   HD11  LEU  59          HD11      LEU  59 -13.184  -4.845   6.342
  478   HD12  LEU  59          HD12      LEU  59 -11.679  -4.289   5.611
  479   HD13  LEU  59          HD13      LEU  59 -13.143  -3.320   5.459
  480   HD21  LEU  59          HD21      LEU  59 -13.209  -2.150   8.936
  481   HD22  LEU  59          HD22      LEU  59 -14.037  -3.630   8.455
  482   HD23  LEU  59          HD23      LEU  59 -14.097  -2.208   7.414
  483    H    ALA  60           H        ALA  60  -9.356  -3.180   5.788
  484    HA   ALA  60           HA       ALA  60  -8.936  -5.773   4.446
  485    HB1  ALA  60           HB1      ALA  60 -10.812  -4.561   3.478
  486    HB2  ALA  60           HB2      ALA  60  -9.467  -4.630   2.339
  487    HB3  ALA  60           HB3      ALA  60  -9.789  -3.146   3.232
  488    H    ASP  61           H        ASP  61  -7.335  -5.488   2.521
  489    HA   ASP  61           HA       ASP  61  -4.926  -4.437   3.719
  490    HB2  ASP  61           HB2      ASP  61  -4.968  -6.629   2.526
  491    HB3  ASP  61           HB3      ASP  61  -5.258  -5.760   1.020
  492    H    SER  62           H        SER  62  -6.254  -4.094   0.421
  493    HA   SER  62           HA       SER  62  -5.674  -1.269   0.357
  494    HB2  SER  62           HB2      SER  62  -4.113  -3.151  -1.426
  495    HB3  SER  62           HB3      SER  62  -4.036  -1.393  -1.461
  496    HG   SER  62           HG       SER  62  -3.036  -3.194   0.471
  497    H    VAL  63           H        VAL  63  -6.201  -0.335  -1.776
  498    HA   VAL  63           HA       VAL  63  -8.606  -1.270  -2.885
  499    HB   VAL  63           HB       VAL  63  -6.561   0.672  -3.992
  500   HG11  VAL  63          HG11      VAL  63  -7.940  -0.224  -5.798
  501   HG12  VAL  63          HG12      VAL  63  -8.306   1.472  -5.488
  502   HG13  VAL  63          HG13      VAL  63  -9.398   0.216  -4.905
  503   HG21  VAL  63          HG21      VAL  63  -7.561   1.347  -1.870
  504   HG22  VAL  63          HG22      VAL  63  -9.170   1.142  -2.563
  505   HG23  VAL  63          HG23      VAL  63  -8.093   2.388  -3.192
  506    H    LYS  64           H        LYS  64  -5.306  -1.930  -3.538
  507    HA   LYS  64           HA       LYS  64  -5.347  -2.801  -6.172
  508    HB2  LYS  64           HB2      LYS  64  -3.648  -3.747  -3.865
  509    HB3  LYS  64           HB3      LYS  64  -3.299  -4.045  -5.558
  510    HG2  LYS  64           HG2      LYS  64  -3.231  -1.564  -5.893
  511    HG3  LYS  64           HG3      LYS  64  -3.355  -1.396  -4.142
  512    HD2  LYS  64           HD2      LYS  64  -1.164  -2.843  -5.630
  513    HD3  LYS  64           HD3      LYS  64  -1.034  -1.243  -4.894
  514    HE2  LYS  64           HE2      LYS  64  -1.308  -2.154  -2.703
  515    HE3  LYS  64           HE3      LYS  64  -1.705  -3.746  -3.352
  516    HZ1  LYS  64           HZ1      LYS  64   0.918  -2.399  -3.696
  517    HZ2  LYS  64           HZ2      LYS  64   0.521  -3.967  -4.176
  518    HZ3  LYS  64           HZ3      LYS  64   0.590  -3.581  -2.532
  519    H    ASP  65           H        ASP  65  -6.357  -4.431  -3.250
  520    HA   ASP  65           HA       ASP  65  -6.410  -7.037  -4.498
  521    HB2  ASP  65           HB2      ASP  65  -5.881  -6.708  -2.079
  522    HB3  ASP  65           HB3      ASP  65  -7.540  -6.185  -1.822
  523    H    PHE  66           H        PHE  66  -8.568  -4.400  -4.003
  524    HA   PHE  66           HA       PHE  66 -10.958  -6.007  -4.452
  525    HB2  PHE  66           HB2      PHE  66 -10.549  -3.086  -3.837
  526    HB3  PHE  66           HB3      PHE  66 -12.122  -3.776  -4.202
  527    HD1  PHE  66           HD1      PHE  66 -13.460  -4.401  -2.455
  528    HD2  PHE  66           HD2      PHE  66  -9.236  -4.326  -1.906
  529    HE1  PHE  66           HE1      PHE  66 -13.761  -4.932  -0.078
  530    HE2  PHE  66           HE2      PHE  66  -9.534  -4.856   0.472
  531    HZ   PHE  66           HZ       PHE  66 -11.802  -5.149   1.399
  532    H    GLN  67           H        GLN  67  -9.118  -3.426  -6.038
  533    HA   GLN  67           HA       GLN  67 -11.001  -3.581  -8.289
  534    HB2  GLN  67           HB2      GLN  67  -9.504  -1.203  -7.205
  535    HB3  GLN  67           HB3      GLN  67 -10.386  -1.188  -8.726
  536    HG2  GLN  67           HG2      GLN  67 -11.622  -1.790  -6.050
  537    HG3  GLN  67           HG3      GLN  67 -11.622  -0.202  -6.819
  538   HE21  GLN  67          HE21      GLN  67 -12.847  -3.460  -6.963
  539   HE22  GLN  67          HE22      GLN  67 -14.134  -3.134  -8.072
  540    H    ARG  68           H        ARG  68  -7.878  -2.047  -7.929
  541    HA   ARG  68           HA       ARG  68  -6.882  -3.536 -10.252
  542    HB2  ARG  68           HB2      ARG  68  -7.961  -1.298 -10.852
  543    HB3  ARG  68           HB3      ARG  68  -6.638  -0.540  -9.982
  544    HG2  ARG  68           HG2      ARG  68  -5.051  -1.637 -11.527
  545    HG3  ARG  68           HG3      ARG  68  -6.427  -2.270 -12.436
  546    HD2  ARG  68           HD2      ARG  68  -5.678   0.617 -12.010
  547    HD3  ARG  68           HD3      ARG  68  -5.675  -0.280 -13.529
  548    HE   ARG  68           HE       ARG  68  -8.243  -0.475 -12.807
  549   HH11  ARG  68          HH11      ARG  68  -6.092   2.285 -12.896
  550   HH12  ARG  68          HH12      ARG  68  -7.359   3.429 -13.198
  551   HH21  ARG  68          HH21      ARG  68  -9.924   1.040 -13.193
  552   HH22  ARG  68          HH22      ARG  68  -9.532   2.721 -13.384
  553    H    LYS  69           H        LYS  69  -4.575  -3.606 -10.383
  554    HA   LYS  69           HA       LYS  69  -3.277  -3.578  -7.845
  555    HB2  LYS  69           HB2      LYS  69  -1.315  -4.365  -9.016
  556    HB3  LYS  69           HB3      LYS  69  -2.728  -5.208  -9.629
  557    HG2  LYS  69           HG2      LYS  69  -2.738  -3.867 -11.619
  558    HG3  LYS  69           HG3      LYS  69  -1.448  -2.844 -10.984
  559    HD2  LYS  69           HD2      LYS  69   0.051  -4.805 -10.954
  560    HD3  LYS  69           HD3      LYS  69  -1.238  -5.778 -11.665
  561    HE2  LYS  69           HE2      LYS  69  -1.240  -4.376 -13.644
  562    HE3  LYS  69           HE3      LYS  69  -0.024  -3.322 -12.923
  563    HZ1  LYS  69           HZ1      LYS  69   0.984  -4.854 -14.474
  564    HZ2  LYS  69           HZ2      LYS  69   0.349  -6.179 -13.636
  565    HZ3  LYS  69           HZ3      LYS  69   1.515  -5.197 -12.905
  566    H    GLY  70           H        GLY  70  -3.977  -1.109  -9.913
  567    HA2  GLY  70           HA2      GLY  70  -1.646   0.455  -9.944
  568    HA3  GLY  70           HA3      GLY  70  -3.287   1.067 -10.088
  569    H    THR  71           H        THR  71  -0.691   1.719  -8.492
  570    HA   THR  71           HA       THR  71  -1.671   1.639  -5.783
  571    HB   THR  71           HB       THR  71   0.524   3.167  -5.573
  572    HG1  THR  71           HG1      THR  71   1.871   1.740  -7.282
  573   HG21  THR  71          HG21      THR  71   1.751   1.083  -5.119
  574   HG22  THR  71          HG22      THR  71   0.467   0.163  -5.903
  575   HG23  THR  71          HG23      THR  71   0.132   1.066  -4.422
  576    H    HIS  72           H        HIS  72  -2.751   3.169  -4.793
  577    HA   HIS  72           HA       HIS  72  -3.390   5.678  -5.803
  578    HB2  HIS  72           HB2      HIS  72  -4.076   6.269  -3.586
  579    HB3  HIS  72           HB3      HIS  72  -4.430   4.560  -3.759
  580    HD1  HIS  72           HD1      HIS  72  -2.395   2.979  -2.690
  581    HD2  HIS  72           HD2      HIS  72  -2.718   6.900  -1.355
  582    HE1  HIS  72           HE1      HIS  72  -0.994   3.110  -0.614
  583    HE2  HIS  72           HE2      HIS  72  -1.521   5.372   0.359
  584    H    ILE  73           H        ILE  73  -1.968   7.186  -6.424
  585    HA   ILE  73           HA       ILE  73   0.369   7.550  -4.710
  586    HB   ILE  73           HB       ILE  73   0.320   7.078  -7.624
  587   HG12  ILE  73          HG12      ILE  73   1.152   5.520  -5.765
  588   HG13  ILE  73          HG13      ILE  73   2.205   5.743  -7.164
  589   HG21  ILE  73          HG21      ILE  73   1.167   9.255  -7.803
  590   HG22  ILE  73          HG22      ILE  73   2.606   8.234  -7.760
  591   HG23  ILE  73          HG23      ILE  73   2.095   9.107  -6.315
  592   HD11  ILE  73          HD11      ILE  73   3.379   5.769  -4.977
  593   HD12  ILE  73          HD12      ILE  73   2.499   7.246  -4.571
  594   HD13  ILE  73          HD13      ILE  73   3.617   7.228  -5.935
  595    H    VAL  74           H        VAL  74   0.003   9.283  -3.727
  596    HA   VAL  74           HA       VAL  74  -0.992  11.711  -4.604
  597    HB   VAL  74           HB       VAL  74  -0.561  11.927  -2.394
  598   HG11  VAL  74          HG11      VAL  74   0.166   9.702  -1.979
  599   HG12  VAL  74          HG12      VAL  74   1.368  10.761  -1.236
  600   HG13  VAL  74          HG13      VAL  74   1.713   9.990  -2.783
  601   HG21  VAL  74          HG21      VAL  74   2.220  12.552  -3.355
  602   HG22  VAL  74          HG22      VAL  74   1.519  13.060  -1.821
  603   HG23  VAL  74          HG23      VAL  74   0.857  13.674  -3.336
  604    H    LEU  75           H        LEU  75  -0.158  13.351  -5.766
  605    HA   LEU  75           HA       LEU  75   1.279  12.590  -7.975
  606    HB2  LEU  75           HB2      LEU  75  -0.236  14.495  -7.884
  607    HB3  LEU  75           HB3      LEU  75   0.916  15.363  -6.881
  608    HG   LEU  75           HG       LEU  75   2.559  15.184  -8.761
  609   HD11  LEU  75          HD11      LEU  75   1.572  13.292  -9.899
  610   HD12  LEU  75          HD12      LEU  75   1.656  14.677 -10.990
  611   HD13  LEU  75          HD13      LEU  75   0.119  14.228 -10.247
  612   HD21  LEU  75          HD21      LEU  75   1.544  16.992 -10.075
  613   HD22  LEU  75          HD22      LEU  75   1.303  17.241  -8.343
  614   HD23  LEU  75          HD23      LEU  75  -0.022  16.641  -9.342
  615    H    TRP  76           H        TRP  76   3.268  11.611  -7.432
  616    HA   TRP  76           HA       TRP  76   5.295  13.257  -6.158
  617    HB2  TRP  76           HB2      TRP  76   5.348  10.403  -7.159
  618    HB3  TRP  76           HB3      TRP  76   6.754  11.223  -6.489
  619    HD1  TRP  76           HD1      TRP  76   3.885   9.147  -5.484
  620    HE1  TRP  76           HE1      TRP  76   3.677   9.044  -2.934
  621    HE3  TRP  76           HE3      TRP  76   7.064  12.944  -4.288
  622    HZ2  TRP  76           HZ2      TRP  76   4.719  10.403  -0.694
  623    HZ3  TRP  76           HZ3      TRP  76   7.400  13.489  -1.913
  624    HH2  TRP  76           HH2      TRP  76   6.246  12.247  -0.153
  625    H    THR  77           H        THR  77   6.137  14.755  -7.420
  626    HA   THR  77           HA       THR  77   7.104  13.974 -10.086
  627    HB   THR  77           HB       THR  77   7.306  16.437 -10.492
  628    HG1  THR  77           HG1      THR  77   5.672  17.406  -8.681
  629   HG21  THR  77          HG21      THR  77   4.546  15.495  -9.701
  630   HG22  THR  77          HG22      THR  77   5.316  15.239 -11.266
  631   HG23  THR  77          HG23      THR  77   4.898  16.870 -10.745
  632    H    GLY  78           H        GLY  78   9.269  15.023 -10.635
  633    HA2  GLY  78           HA2      GLY  78  11.271  14.393  -8.822
  634    HA3  GLY  78           HA3      GLY  78  11.462  15.530 -10.151
  635    H    ASP  79           H        ASP  79   9.458  17.348  -9.205
  636    HA   ASP  79           HA       ASP  79  10.965  18.996  -7.481
  637    HB2  ASP  79           HB2      ASP  79   9.274  19.828  -9.098
  638    HB3  ASP  79           HB3      ASP  79   8.007  19.108  -8.113
  639    H    GLN  80           H        GLN  80   7.942  17.171  -6.908
  640    HA   GLN  80           HA       GLN  80   7.818  17.829  -4.157
  641    HB2  GLN  80           HB2      GLN  80   5.813  17.156  -5.380
  642    HB3  GLN  80           HB3      GLN  80   6.485  15.549  -5.631
  643    HG2  GLN  80           HG2      GLN  80   6.388  15.061  -3.302
  644    HG3  GLN  80           HG3      GLN  80   5.955  16.724  -2.916
  645   HE21  GLN  80          HE21      GLN  80   4.863  13.668  -4.050
  646   HE22  GLN  80          HE22      GLN  80   3.178  14.040  -4.068
  647    H    GLU  81           H        GLU  81   9.218  15.101  -5.892
  648    HA   GLU  81           HA       GLU  81   9.804  13.490  -3.661
  649    HB2  GLU  81           HB2      GLU  81  11.250  13.770  -6.301
  650    HB3  GLU  81           HB3      GLU  81  11.588  12.510  -5.121
  651    HG2  GLU  81           HG2      GLU  81   9.321  11.666  -5.357
  652    HG3  GLU  81           HG3      GLU  81   8.953  12.946  -6.512
  653    H    LEU  82           H        LEU  82  11.558  16.148  -5.188
  654    HA   LEU  82           HA       LEU  82  13.846  16.023  -3.524
  655    HB2  LEU  82           HB2      LEU  82  13.877  17.260  -5.616
  656    HB3  LEU  82           HB3      LEU  82  12.639  18.351  -5.016
  657    HG   LEU  82           HG       LEU  82  14.287  18.989  -3.186
  658   HD11  LEU  82          HD11      LEU  82  16.190  17.581  -5.045
  659   HD12  LEU  82          HD12      LEU  82  15.805  17.123  -3.388
  660   HD13  LEU  82          HD13      LEU  82  16.657  18.632  -3.709
  661   HD21  LEU  82          HD21      LEU  82  15.466  20.557  -4.631
  662   HD22  LEU  82          HD22      LEU  82  13.755  20.448  -5.037
  663   HD23  LEU  82          HD23      LEU  82  14.955  19.639  -6.047
  664    H    GLU  83           H        GLU  83  10.812  17.855  -3.335
  665    HA   GLU  83           HA       GLU  83  11.433  19.352  -1.058
  666    HB2  GLU  83           HB2      GLU  83   8.758  18.356  -2.045
  667    HB3  GLU  83           HB3      GLU  83   8.958  19.527  -0.744
  668    HG2  GLU  83           HG2      GLU  83   9.778  19.853  -3.619
  669    HG3  GLU  83           HG3      GLU  83   8.478  20.694  -2.775
  670    H    LEU  84           H        LEU  84   9.956  16.152  -1.371
  671    HA   LEU  84           HA       LEU  84   9.642  15.662   1.388
  672    HB2  LEU  84           HB2      LEU  84   8.587  14.229  -0.270
  673    HB3  LEU  84           HB3      LEU  84  10.155  13.732  -0.880
  674    HG   LEU  84           HG       LEU  84  10.626  12.689   1.340
  675   HD11  LEU  84          HD11      LEU  84   7.715  13.270   1.850
  676   HD12  LEU  84          HD12      LEU  84   9.080  14.024   2.674
  677   HD13  LEU  84          HD13      LEU  84   8.779  12.296   2.867
  678   HD21  LEU  84          HD21      LEU  84   9.861  11.334  -0.518
  679   HD22  LEU  84          HD22      LEU  84   8.182  11.707  -0.126
  680   HD23  LEU  84          HD23      LEU  84   9.158  10.754   0.992
  681    H    GLN  85           H        GLN  85  12.259  14.948  -0.865
  682    HA   GLN  85           HA       GLN  85  14.004  13.604   0.804
  683    HB2  GLN  85           HB2      GLN  85  14.139  13.967  -1.700
  684    HB3  GLN  85           HB3      GLN  85  14.808  15.550  -1.361
  685    HG2  GLN  85           HG2      GLN  85  16.055  13.056  -0.278
  686    HG3  GLN  85           HG3      GLN  85  16.402  13.619  -1.906
  687   HE21  GLN  85          HE21      GLN  85  16.376  16.438  -1.220
  688   HE22  GLN  85          HE22      GLN  85  17.792  16.734  -0.281
  689    H    ARG  86           H        ARG  86  13.932  17.113   0.106
  690    HA   ARG  86           HA       ARG  86  16.018  17.818   1.848
  691    HB2  ARG  86           HB2      ARG  86  13.646  19.510   1.039
  692    HB3  ARG  86           HB3      ARG  86  15.164  20.104   1.692
  693    HG2  ARG  86           HG2      ARG  86  16.287  19.063  -0.313
  694    HG3  ARG  86           HG3      ARG  86  14.672  18.832  -0.980
  695    HD2  ARG  86           HD2      ARG  86  15.880  21.465  -0.154
  696    HD3  ARG  86           HD3      ARG  86  15.717  20.886  -1.806
  697    HE   ARG  86           HE       ARG  86  13.249  20.962  -1.403
  698   HH11  ARG  86          HH11      ARG  86  15.400  22.930   0.556
  699   HH12  ARG  86          HH12      ARG  86  14.240  24.200   0.769
  700   HH21  ARG  86          HH21      ARG  86  11.719  22.633  -1.101
  701   HH22  ARG  86          HH22      ARG  86  12.150  24.023  -0.148
  702    H    LEU  87           H        LEU  87  12.507  17.815   2.384
  703    HA   LEU  87           HA       LEU  87  12.633  18.986   4.956
  704    HB2  LEU  87           HB2      LEU  87  10.668  18.659   3.222
  705    HB3  LEU  87           HB3      LEU  87  10.381  17.204   4.157
  706    HG   LEU  87           HG       LEU  87  10.278  18.688   6.208
  707   HD11  LEU  87          HD11      LEU  87   9.735  21.050   5.795
  708   HD12  LEU  87          HD12      LEU  87  10.115  20.824   4.088
  709   HD13  LEU  87          HD13      LEU  87  11.378  20.645   5.304
  710   HD21  LEU  87          HD21      LEU  87   8.214  19.117   4.058
  711   HD22  LEU  87          HD22      LEU  87   7.974  19.311   5.795
  712   HD23  LEU  87          HD23      LEU  87   8.312  17.716   5.124
  713    H    PHE  88           H        PHE  88  12.477  15.664   3.825
  714    HA   PHE  88           HA       PHE  88  12.070  14.338   6.214
  715    HB2  PHE  88           HB2      PHE  88  11.853  12.896   4.482
  716    HB3  PHE  88           HB3      PHE  88  13.098  13.688   3.529
  717    HD1  PHE  88           HD1      PHE  88  12.608  11.372   6.397
  718    HD2  PHE  88           HD2      PHE  88  15.175  12.742   3.293
  719    HE1  PHE  88           HE1      PHE  88  14.149   9.505   6.847
  720    HE2  PHE  88           HE2      PHE  88  16.718  10.887   3.737
  721    HZ   PHE  88           HZ       PHE  88  16.207   9.265   5.520
  722    H    GLU  89           H        GLU  89  15.136  15.434   4.778
  723    HA   GLU  89           HA       GLU  89  16.773  14.263   6.788
  724    HB2  GLU  89           HB2      GLU  89  17.390  16.729   5.185
  725    HB3  GLU  89           HB3      GLU  89  18.538  15.651   5.951
  726    HG2  GLU  89           HG2      GLU  89  17.943  13.889   4.391
  727    HG3  GLU  89           HG3      GLU  89  16.750  14.958   3.645
  728    H    GLU  90           H        GLU  90  15.192  17.369   6.400
  729    HA   GLU  90           HA       GLU  90  16.656  18.746   8.381
  730    HB2  GLU  90           HB2      GLU  90  14.037  19.274   7.006
  731    HB3  GLU  90           HB3      GLU  90  14.716  20.391   8.187
  732    HG2  GLU  90           HG2      GLU  90  15.926  19.547   5.564
  733    HG3  GLU  90           HG3      GLU  90  15.283  21.135   5.982
  734    H    PHE  91           H        PHE  91  13.694  16.863   8.506
  735    HA   PHE  91           HA       PHE  91  13.548  17.464  11.385
  736    HB2  PHE  91           HB2      PHE  91  11.366  16.584   9.490
  737    HB3  PHE  91           HB3      PHE  91  11.162  16.759  11.231
  738    HD1  PHE  91           HD1      PHE  91  10.973  18.375   8.096
  739    HD2  PHE  91           HD2      PHE  91  11.728  19.072  12.223
  740    HE1  PHE  91           HE1      PHE  91  10.457  20.757   7.784
  741    HE2  PHE  91           HE2      PHE  91  11.210  21.457  11.919
  742    HZ   PHE  91           HZ       PHE  91  10.572  22.303   9.695
  743    H    ARG  92           H        ARG  92  15.049  15.351   9.714
  744    HA   ARG  92           HA       ARG  92  14.016  12.838  10.615
  745    HB2  ARG  92           HB2      ARG  92  15.512  13.160   8.623
  746    HB3  ARG  92           HB3      ARG  92  16.831  13.493   9.734
  747    HG2  ARG  92           HG2      ARG  92  16.480  11.239  10.717
  748    HG3  ARG  92           HG3      ARG  92  15.297  10.929   9.452
  749    HD2  ARG  92           HD2      ARG  92  16.885  11.002   7.767
  750    HD3  ARG  92           HD3      ARG  92  18.065  11.845   8.765
  751    HE   ARG  92           HE       ARG  92  18.062   9.638  10.087
  752   HH11  ARG  92          HH11      ARG  92  17.642   9.833   6.609
  753   HH12  ARG  92          HH12      ARG  92  18.268   8.241   6.326
  754   HH21  ARG  92          HH21      ARG  92  18.899   7.548   9.697
  755   HH22  ARG  92          HH22      ARG  92  18.961   6.941   8.059
  756    H    ASP  93           H        ASP  93  15.839  15.338  11.972
  757    HA   ASP  93           HA       ASP  93  17.103  13.936  14.103
  758    HB2  ASP  93           HB2      ASP  93  17.845  16.165  13.396
  759    HB3  ASP  93           HB3      ASP  93  16.290  16.844  13.856
  760    H    SER  94           H        SER  94  13.917  14.271  13.426
  761    HA   SER  94           HA       SER  94  13.082  14.433  16.235
  762    HB2  SER  94           HB2      SER  94  11.375  14.554  13.734
  763    HB3  SER  94           HB3      SER  94  10.844  14.873  15.385
  764    HG   SER  94           HG       SER  94  12.980  16.390  14.752
  765    H    ASP  95           H        ASP  95  11.465  12.880  16.970
  766    HA   ASP  95           HA       ASP  95  12.224  10.217  16.180
  767    HB2  ASP  95           HB2      ASP  95  10.733   9.479  18.016
  768    HB3  ASP  95           HB3      ASP  95  11.939  10.650  18.536
  769    H    ASP  96           H        ASP  96   9.918  12.360  15.103
  770    HA   ASP  96           HA       ASP  96   8.755  10.214  13.527
  771    HB2  ASP  96           HB2      ASP  96   7.218  10.556  15.472
  772    HB3  ASP  96           HB3      ASP  96   6.995  12.223  14.954
  773    H    VAL  97           H        VAL  97  10.134  11.203  11.941
  774    HA   VAL  97           HA       VAL  97   9.993  13.949  11.340
  775    HB   VAL  97           HB       VAL  97  11.971  12.850  10.648
  776   HG11  VAL  97          HG11      VAL  97  10.934  10.582  10.367
  777   HG12  VAL  97          HG12      VAL  97  12.148  11.025   9.165
  778   HG13  VAL  97          HG13      VAL  97  10.432  11.101   8.755
  779   HG21  VAL  97          HG21      VAL  97  11.232  14.641   9.166
  780   HG22  VAL  97          HG22      VAL  97  10.375  13.464   8.169
  781   HG23  VAL  97          HG23      VAL  97  12.134  13.408   8.286
  782    H    LEU  98           H        LEU  98   8.153  11.206  10.137
  783    HA   LEU  98           HA       LEU  98   7.008  12.512   7.922
  784    HB2  LEU  98           HB2      LEU  98   6.127  10.174   9.573
  785    HB3  LEU  98           HB3      LEU  98   5.113  10.807   8.293
  786    HG   LEU  98           HG       LEU  98   7.176  10.480   6.779
  787   HD11  LEU  98          HD11      LEU  98   8.789  10.075   8.543
  788   HD12  LEU  98          HD12      LEU  98   8.668   8.687   7.462
  789   HD13  LEU  98          HD13      LEU  98   7.896   8.644   9.046
  790   HD21  LEU  98          HD21      LEU  98   6.558   8.150   6.365
  791   HD22  LEU  98          HD22      LEU  98   5.139   9.170   6.599
  792   HD23  LEU  98          HD23      LEU  98   5.688   8.111   7.898
  793    H    GLY  99           H        GLY  99   6.131  12.484  11.327
  794    HA2  GLY  99           HA2      GLY  99   3.625  13.788  11.014
  795    HA3  GLY  99           HA3      GLY  99   4.579  13.719  12.497
  796    H    HIS 100           H        HIS 100   6.918  14.892  11.215
  797    HA   HIS 100           HA       HIS 100   6.194  17.663  11.525
  798    HB2  HIS 100           HB2      HIS 100   8.815  16.267  10.978
  799    HB3  HIS 100           HB3      HIS 100   8.669  18.020  11.015
  800    HD1  HIS 100           HD1      HIS 100   9.055  19.065  13.216
  801    HD2  HIS 100           HD2      HIS 100   7.943  15.076  13.580
  802    HE1  HIS 100           HE1      HIS 100   9.234  18.533  15.666
  803    HE2  HIS 100           HE2      HIS 100   8.681  16.081  15.849
  804    H    ILE 101           H        ILE 101   6.967  15.431   8.965
  805    HA   ILE 101           HA       ILE 101   7.197  17.237   6.834
  806    HB   ILE 101           HB       ILE 101   6.140  14.397   6.859
  807   HG12  ILE 101          HG12      ILE 101   8.831  15.539   6.054
  808   HG13  ILE 101          HG13      ILE 101   8.501  14.657   7.541
  809   HG21  ILE 101          HG21      ILE 101   6.533  14.415   4.421
  810   HG22  ILE 101          HG22      ILE 101   6.891  16.141   4.508
  811   HG23  ILE 101          HG23      ILE 101   5.277  15.555   4.907
  812   HD11  ILE 101          HD11      ILE 101   8.281  13.549   4.751
  813   HD12  ILE 101          HD12      ILE 101   7.973  12.664   6.244
  814   HD13  ILE 101          HD13      ILE 101   9.597  13.253   5.887
  815    H    MET 102           H        MET 102   4.337  15.333   7.827
  816    HA   MET 102           HA       MET 102   2.533  16.378   6.019
  817    HB2  MET 102           HB2      MET 102   2.099  15.336   8.813
  818    HB3  MET 102           HB3      MET 102   0.778  15.760   7.733
  819    HG2  MET 102           HG2      MET 102   1.594  14.111   6.117
  820    HG3  MET 102           HG3      MET 102   2.870  13.650   7.239
  821    HE1  MET 102           HE1      MET 102   0.643  11.794   5.855
  822    HE2  MET 102           HE2      MET 102   0.245  10.694   7.176
  823    HE3  MET 102           HE3      MET 102   1.926  11.131   6.869
  824    H    LYS 103           H        LYS 103   3.348  17.623   9.228
  825    HA   LYS 103           HA       LYS 103   1.312  19.624   9.169
  826    HB2  LYS 103           HB2      LYS 103   3.720  19.327  10.968
  827    HB3  LYS 103           HB3      LYS 103   2.417  20.480  11.217
  828    HG2  LYS 103           HG2      LYS 103   2.113  17.482  11.201
  829    HG3  LYS 103           HG3      LYS 103   2.185  18.502  12.639
  830    HD2  LYS 103           HD2      LYS 103   0.146  19.636  11.975
  831    HD3  LYS 103           HD3      LYS 103   0.091  18.709  10.475
  832    HE2  LYS 103           HE2      LYS 103  -1.452  17.780  12.109
  833    HE3  LYS 103           HE3      LYS 103  -0.154  16.640  11.759
  834    HZ1  LYS 103           HZ1      LYS 103  -0.624  16.748  14.120
  835    HZ2  LYS 103           HZ2      LYS 103  -0.313  18.410  14.140
  836    HZ3  LYS 103           HZ3      LYS 103   0.935  17.321  13.806
  837    H    ASN 104           H        ASN 104   4.587  19.495   8.004
  838    HA   ASN 104           HA       ASN 104   4.666  22.433   7.888
  839    HB2  ASN 104           HB2      ASN 104   6.551  21.116   8.968
  840    HB3  ASN 104           HB3      ASN 104   6.978  20.581   7.344
  841   HD21  ASN 104          HD21      ASN 104   8.950  21.609   7.325
  842   HD22  ASN 104          HD22      ASN 104   9.109  23.326   7.246
  843    H    ILE 105           H        ILE 105   4.298  19.681   5.844
  844    HA   ILE 105           HA       ILE 105   5.299  21.110   3.509
  845    HB   ILE 105           HB       ILE 105   5.811  18.689   3.841
  846   HG12  ILE 105          HG12      ILE 105   5.379  18.027   1.473
  847   HG13  ILE 105          HG13      ILE 105   4.363  19.453   1.307
  848   HG21  ILE 105          HG21      ILE 105   3.671  17.929   4.692
  849   HG22  ILE 105          HG22      ILE 105   4.106  17.023   3.244
  850   HG23  ILE 105          HG23      ILE 105   2.903  18.309   3.151
  851   HD11  ILE 105          HD11      ILE 105   6.279  20.885   1.737
  852   HD12  ILE 105          HD12      ILE 105   6.588  19.805   0.378
  853   HD13  ILE 105          HD13      ILE 105   7.301  19.465   1.954
  854    H    THR 106           H        THR 106   4.051  21.197   1.549
  855    HA   THR 106           HA       THR 106   1.544  22.452   2.075
  856    HB   THR 106           HB       THR 106   3.309  23.250   0.487
  857    HG1  THR 106           HG1      THR 106   1.623  24.350  -0.163
  858   HG21  THR 106          HG21      THR 106   3.876  21.163  -0.596
  859   HG22  THR 106          HG22      THR 106   3.302  22.320  -1.797
  860   HG23  THR 106          HG23      THR 106   2.243  21.023  -1.244
  861    H    ALA 107           H        ALA 107   2.458  19.272   1.221
  862    HA   ALA 107           HA       ALA 107  -0.212  18.729   0.103
  863    HB1  ALA 107           HB1      ALA 107   0.749  16.775  -0.972
  864    HB2  ALA 107           HB2      ALA 107   2.311  17.112  -0.224
  865    HB3  ALA 107           HB3      ALA 107   1.648  18.226  -1.423
  866    H    LYS 108           H        LYS 108  -1.565  17.508   1.253
  867    HA   LYS 108           HA       LYS 108  -0.608  16.211   3.675
  868    HB2  LYS 108           HB2      LYS 108  -3.328  16.745   2.511
  869    HB3  LYS 108           HB3      LYS 108  -3.136  15.551   3.782
  870    HG2  LYS 108           HG2      LYS 108  -3.841  17.716   4.665
  871    HG3  LYS 108           HG3      LYS 108  -2.260  17.245   5.284
  872    HD2  LYS 108           HD2      LYS 108  -2.186  18.869   2.834
  873    HD3  LYS 108           HD3      LYS 108  -2.862  19.688   4.244
  874    HE2  LYS 108           HE2      LYS 108  -0.260  18.186   4.368
  875    HE3  LYS 108           HE3      LYS 108  -0.338  19.876   3.862
  876    HZ1  LYS 108           HZ1      LYS 108  -1.394  18.869   6.447
  877    HZ2  LYS 108           HZ2      LYS 108  -1.234  20.485   5.971
  878    HZ3  LYS 108           HZ3      LYS 108   0.144  19.541   6.255
  879    H    ARG 109           H        ARG 109   0.433  14.374   3.293
  880    HA   ARG 109           HA       ARG 109  -0.664  12.543   1.272
  881    HB2  ARG 109           HB2      ARG 109   2.131  12.447   2.404
  882    HB3  ARG 109           HB3      ARG 109   1.525  11.685   0.935
  883    HG2  ARG 109           HG2      ARG 109   1.267  13.881  -0.098
  884    HG3  ARG 109           HG3      ARG 109   1.855  14.649   1.378
  885    HD2  ARG 109           HD2      ARG 109   3.965  13.289   1.094
  886    HD3  ARG 109           HD3      ARG 109   3.370  12.851  -0.508
  887    HE   ARG 109           HE       ARG 109   3.337  15.326  -0.945
  888   HH11  ARG 109          HH11      ARG 109   5.531  13.912   1.386
  889   HH12  ARG 109          HH12      ARG 109   6.692  15.188   1.262
  890   HH21  ARG 109          HH21      ARG 109   4.866  17.026  -1.110
  891   HH22  ARG 109          HH22      ARG 109   6.316  16.960  -0.162
  892    H    SER 110           H        SER 110   0.205  10.185   1.869
  893    HA   SER 110           HA       SER 110  -0.890   9.654   4.529
  894    HB2  SER 110           HB2      SER 110  -0.340   7.613   2.365
  895    HB3  SER 110           HB3      SER 110  -1.422   7.462   3.751
  896    HG   SER 110           HG       SER 110  -2.716   9.116   2.791
  897    H    ARG 111           H        ARG 111   0.161   8.180   5.952
  898    HA   ARG 111           HA       ARG 111   2.921   8.539   6.208
  899    HB2  ARG 111           HB2      ARG 111   1.011   6.556   7.429
  900    HB3  ARG 111           HB3      ARG 111   2.722   6.561   7.834
  901    HG2  ARG 111           HG2      ARG 111   0.886   8.922   8.176
  902    HG3  ARG 111           HG3      ARG 111   1.306   7.780   9.456
  903    HD2  ARG 111           HD2      ARG 111   3.649   8.363   9.238
  904    HD3  ARG 111           HD3      ARG 111   3.281   9.447   7.902
  905    HE   ARG 111           HE       ARG 111   2.022  10.801   9.541
  906   HH11  ARG 111          HH11      ARG 111   4.504   8.597  10.664
  907   HH12  ARG 111          HH12      ARG 111   4.821   9.492  12.121
  908   HH21  ARG 111          HH21      ARG 111   2.420  11.952  11.485
  909   HH22  ARG 111          HH22      ARG 111   3.654  11.387  12.578
  910    H    ALA 112           H        ALA 112   1.120   5.672   5.099
  911    HA   ALA 112           HA       ALA 112   3.356   4.066   4.570
  912    HB1  ALA 112           HB1      ALA 112   1.099   3.164   4.705
  913    HB2  ALA 112           HB2      ALA 112   1.857   2.729   3.173
  914    HB3  ALA 112           HB3      ALA 112   0.656   4.018   3.227
  915    H    ARG 113           H        ARG 113   1.875   6.619   2.716
  916    HA   ARG 113           HA       ARG 113   3.128   5.919   0.245
  917    HB2  ARG 113           HB2      ARG 113   1.454   8.164   1.215
  918    HB3  ARG 113           HB3      ARG 113   2.491   8.486  -0.168
  919    HG2  ARG 113           HG2      ARG 113   0.653   6.122  -0.100
  920    HG3  ARG 113           HG3      ARG 113   0.104   7.718  -0.615
  921    HD2  ARG 113           HD2      ARG 113   0.757   6.373  -2.534
  922    HD3  ARG 113           HD3      ARG 113   1.826   7.762  -2.344
  923    HE   ARG 113           HE       ARG 113   3.455   6.187  -1.349
  924   HH11  ARG 113          HH11      ARG 113   0.928   4.934  -3.437
  925   HH12  ARG 113          HH12      ARG 113   1.850   3.543  -3.909
  926   HH21  ARG 113          HH21      ARG 113   4.665   4.361  -1.998
  927   HH22  ARG 113          HH22      ARG 113   3.962   3.224  -3.093
  928    H    ILE 114           H        ILE 114   3.925   7.975   2.945
  929    HA   ILE 114           HA       ILE 114   6.141   9.237   1.609
  930    HB   ILE 114           HB       ILE 114   5.430   9.150   4.548
  931   HG12  ILE 114          HG12      ILE 114   4.953  11.325   2.497
  932   HG13  ILE 114          HG13      ILE 114   3.722  10.207   3.075
  933   HG21  ILE 114          HG21      ILE 114   7.769   9.656   4.266
  934   HG22  ILE 114          HG22      ILE 114   6.907  11.129   4.712
  935   HG23  ILE 114          HG23      ILE 114   7.394  10.863   3.039
  936   HD11  ILE 114          HD11      ILE 114   5.221  12.165   4.801
  937   HD12  ILE 114          HD12      ILE 114   3.914  11.097   5.318
  938   HD13  ILE 114          HD13      ILE 114   3.592  12.396   4.168
  939    H    VAL 115           H        VAL 115   5.710   6.719   4.066
  940    HA   VAL 115           HA       VAL 115   8.370   6.066   4.541
  941    HB   VAL 115           HB       VAL 115   5.901   4.328   4.536
  942   HG11  VAL 115          HG11      VAL 115   7.211   2.662   5.777
  943   HG12  VAL 115          HG12      VAL 115   8.667   3.619   5.506
  944   HG13  VAL 115          HG13      VAL 115   7.823   2.895   4.139
  945   HG21  VAL 115          HG21      VAL 115   5.835   5.994   6.242
  946   HG22  VAL 115          HG22      VAL 115   7.504   5.664   6.708
  947   HG23  VAL 115          HG23      VAL 115   6.250   4.461   7.010
  948    H    ASP 116           H        ASP 116   6.140   4.605   2.183
  949    HA   ASP 116           HA       ASP 116   7.943   2.816   1.027
  950    HB2  ASP 116           HB2      ASP 116   5.482   2.773   0.656
  951    HB3  ASP 116           HB3      ASP 116   5.631   4.211  -0.348
  952    H    LYS 117           H        LYS 117   7.329   6.204   0.391
  953    HA   LYS 117           HA       LYS 117   8.720   6.305  -2.066
  954    HB2  LYS 117           HB2      LYS 117   6.984   7.953  -1.161
  955    HB3  LYS 117           HB3      LYS 117   8.302   8.648  -0.225
  956    HG2  LYS 117           HG2      LYS 117   7.924   9.887  -2.285
  957    HG3  LYS 117           HG3      LYS 117   9.521   9.136  -2.276
  958    HD2  LYS 117           HD2      LYS 117   8.679   7.316  -3.676
  959    HD3  LYS 117           HD3      LYS 117   7.073   8.049  -3.671
  960    HE2  LYS 117           HE2      LYS 117   7.838   9.928  -4.895
  961    HE3  LYS 117           HE3      LYS 117   9.523   9.466  -4.678
  962    HZ1  LYS 117           HZ1      LYS 117   9.025   7.451  -6.006
  963    HZ2  LYS 117           HZ2      LYS 117   8.875   8.897  -6.870
  964    HZ3  LYS 117           HZ3      LYS 117   7.491   8.080  -6.333
  965    H    LEU 118           H        LEU 118   9.688   6.951   1.293
  966    HA   LEU 118           HA       LEU 118  12.280   7.905   0.756
  967    HB2  LEU 118           HB2      LEU 118  11.417   6.212   3.095
  968    HB3  LEU 118           HB3      LEU 118  12.891   7.145   2.992
  969    HG   LEU 118           HG       LEU 118  10.083   8.135   3.341
  970   HD11  LEU 118          HD11      LEU 118  11.221   7.508   5.338
  971   HD12  LEU 118          HD12      LEU 118  11.229   9.272   5.258
  972   HD13  LEU 118          HD13      LEU 118  12.685   8.358   4.841
  973   HD21  LEU 118          HD21      LEU 118  11.136   9.526   1.608
  974   HD22  LEU 118          HD22      LEU 118  12.520   9.788   2.670
  975   HD23  LEU 118          HD23      LEU 118  10.933  10.410   3.120
  976    H    LEU 119           H        LEU 119  11.123   4.635   1.453
  977    HA   LEU 119           HA       LEU 119  13.555   3.281   1.254
  978    HB2  LEU 119           HB2      LEU 119  10.691   2.498   0.911
  979    HB3  LEU 119           HB3      LEU 119  11.942   1.356   0.469
  980    HG   LEU 119           HG       LEU 119  11.118   0.907   2.709
  981   HD11  LEU 119          HD11      LEU 119  13.246   0.840   3.880
  982   HD12  LEU 119          HD12      LEU 119  13.924   1.996   2.734
  983   HD13  LEU 119          HD13      LEU 119  13.438   0.392   2.185
  984   HD21  LEU 119          HD21      LEU 119  12.107   3.672   3.421
  985   HD22  LEU 119          HD22      LEU 119  11.533   2.458   4.567
  986   HD23  LEU 119          HD23      LEU 119  10.421   3.148   3.384
  987    H    ALA 120           H        ALA 120  11.283   4.317  -1.179
  988    HA   ALA 120           HA       ALA 120  12.409   2.753  -3.282
  989    HB1  ALA 120           HB1      ALA 120  10.615   5.163  -3.498
  990    HB2  ALA 120           HB2      ALA 120  10.057   3.513  -3.227
  991    HB3  ALA 120           HB3      ALA 120  10.888   3.928  -4.729
  992    H    LEU 121           H        LEU 121  12.658   6.164  -2.316
  993    HA   LEU 121           HA       LEU 121  14.468   6.919  -4.372
  994    HB2  LEU 121           HB2      LEU 121  13.529   8.058  -1.789
  995    HB3  LEU 121           HB3      LEU 121  14.999   8.708  -2.480
  996    HG   LEU 121           HG       LEU 121  13.822   9.405  -4.459
  997   HD11  LEU 121          HD11      LEU 121  11.354   8.223  -3.220
  998   HD12  LEU 121          HD12      LEU 121  12.217   7.577  -4.617
  999   HD13  LEU 121          HD13      LEU 121  11.432   9.153  -4.716
 1000   HD21  LEU 121          HD21      LEU 121  12.329  11.071  -3.448
 1001   HD22  LEU 121          HD22      LEU 121  13.849  10.917  -2.563
 1002   HD23  LEU 121          HD23      LEU 121  12.380  10.172  -1.929
 1003    H    GLY 122           H        GLY 122  14.813   5.282  -1.358
 1004    HA2  GLY 122           HA2      GLY 122  16.711   4.321  -0.425
 1005    HA3  GLY 122           HA3      GLY 122  17.680   5.077  -1.687
 1006    H    LEU 123           H        LEU 123  15.388   6.778   0.346
 1007    HA   LEU 123           HA       LEU 123  17.461   8.580   1.252
 1008    HB2  LEU 123           HB2      LEU 123  14.508   8.424   1.865
 1009    HB3  LEU 123           HB3      LEU 123  15.575   9.688   2.450
 1010    HG   LEU 123           HG       LEU 123  14.803   9.148  -0.415
 1011   HD11  LEU 123          HD11      LEU 123  14.286  11.459   1.444
 1012   HD12  LEU 123          HD12      LEU 123  13.101  10.312   0.822
 1013   HD13  LEU 123          HD13      LEU 123  13.896  11.439  -0.275
 1014   HD21  LEU 123          HD21      LEU 123  16.183  11.083  -0.995
 1015   HD22  LEU 123          HD22      LEU 123  17.152   9.772  -0.324
 1016   HD23  LEU 123          HD23      LEU 123  16.757  11.172   0.672
 1017    H    VAL 124           H        VAL 124  15.616   5.929   2.311
 1018    HA   VAL 124           HA       VAL 124  17.385   5.589   4.620
 1019    HB   VAL 124           HB       VAL 124  15.541   4.650   5.931
 1020   HG11  VAL 124          HG11      VAL 124  16.072   6.980   6.298
 1021   HG12  VAL 124          HG12      VAL 124  14.331   6.736   6.433
 1022   HG13  VAL 124          HG13      VAL 124  15.010   7.459   4.976
 1023   HG21  VAL 124          HG21      VAL 124  14.079   3.864   4.231
 1024   HG22  VAL 124          HG22      VAL 124  13.865   5.486   3.578
 1025   HG23  VAL 124          HG23      VAL 124  13.197   5.076   5.157
 1026    H    ALA 125           H        ALA 125  17.382   3.323   5.304
 1027    HA   ALA 125           HA       ALA 125  17.048   1.536   2.979
 1028    HB1  ALA 125           HB1      ALA 125  19.333   1.644   3.807
 1029    HB2  ALA 125           HB2      ALA 125  18.649   0.051   4.131
 1030    HB3  ALA 125           HB3      ALA 125  18.785   1.233   5.433
 1031    H    GLU 126           H        GLU 126  15.808   2.402   5.971
 1032    HA   GLU 126           HA       GLU 126  13.978   0.174   6.006
 1033    HB2  GLU 126           HB2      GLU 126  14.530  -0.505   8.279
 1034    HB3  GLU 126           HB3      GLU 126  15.900  -0.739   7.200
 1035    HG2  GLU 126           HG2      GLU 126  16.782   1.461   8.015
 1036    HG3  GLU 126           HG3      GLU 126  15.507   1.444   9.227
 1037    H    ARG 127           H        ARG 127  12.543   0.392   8.046
 1038    HA   ARG 127           HA       ARG 127  11.514   3.064   7.899
 1039    HB2  ARG 127           HB2      ARG 127  10.467   0.614   9.292
 1040    HB3  ARG 127           HB3      ARG 127   9.637   2.165   9.260
 1041    HG2  ARG 127           HG2      ARG 127   9.720   2.023   6.743
 1042    HG3  ARG 127           HG3      ARG 127  10.246   0.347   6.946
 1043    HD2  ARG 127           HD2      ARG 127   8.188   0.002   8.349
 1044    HD3  ARG 127           HD3      ARG 127   7.677   1.611   7.835
 1045    HE   ARG 127           HE       ARG 127   8.275   0.159   5.538
 1046   HH11  ARG 127          HH11      ARG 127   5.952   0.039   8.149
 1047   HH12  ARG 127          HH12      ARG 127   4.706  -0.685   7.186
 1048   HH21  ARG 127          HH21      ARG 127   6.639  -0.784   4.256
 1049   HH22  ARG 127          HH22      ARG 127   5.097  -1.156   4.965
 1050    H    ARG 128           H        ARG 128  13.472   1.369  10.188
 1051    HA   ARG 128           HA       ARG 128  12.839   2.485  12.609
 1052    HB2  ARG 128           HB2      ARG 128  15.686   2.339  11.620
 1053    HB3  ARG 128           HB3      ARG 128  15.137   2.289  13.285
 1054    HG2  ARG 128           HG2      ARG 128  13.997   0.113  12.702
 1055    HG3  ARG 128           HG3      ARG 128  14.899   0.168  11.184
 1056    HD2  ARG 128           HD2      ARG 128  16.961   0.541  12.707
 1057    HD3  ARG 128           HD3      ARG 128  15.929  -0.099  13.984
 1058    HE   ARG 128           HE       ARG 128  16.350  -1.629  11.507
 1059   HH11  ARG 128          HH11      ARG 128  16.673  -1.336  14.986
 1060   HH12  ARG 128          HH12      ARG 128  17.221  -2.964  15.203
 1061   HH21  ARG 128          HH21      ARG 128  17.040  -3.780  11.793
 1062   HH22  ARG 128          HH22      ARG 128  17.424  -4.363  13.382
 1063    H    GLU 129           H        GLU 129  14.781   3.946  10.053
 1064    HA   GLU 129           HA       GLU 129  15.628   6.160  11.590
 1065    HB2  GLU 129           HB2      GLU 129  15.609   5.770   8.599
 1066    HB3  GLU 129           HB3      GLU 129  16.525   6.997   9.469
 1067    HG2  GLU 129           HG2      GLU 129  16.870   4.013   9.692
 1068    HG3  GLU 129           HG3      GLU 129  17.955   5.139   8.862
 1069    H    LEU 130           H        LEU 130  12.643   5.572  10.091
 1070    HA   LEU 130           HA       LEU 130  12.178   8.375   9.485
 1071    HB2  LEU 130           HB2      LEU 130   9.763   6.873   9.291
 1072    HB3  LEU 130           HB3      LEU 130  10.679   7.653   8.023
 1073    HG   LEU 130           HG       LEU 130  11.179   4.842   9.003
 1074   HD11  LEU 130          HD11      LEU 130  10.105   4.157   6.906
 1075   HD12  LEU 130          HD12      LEU 130   9.680   5.839   6.591
 1076   HD13  LEU 130          HD13      LEU 130   8.996   5.002   7.985
 1077   HD21  LEU 130          HD21      LEU 130  12.500   4.585   6.980
 1078   HD22  LEU 130          HD22      LEU 130  13.145   5.891   7.974
 1079   HD23  LEU 130          HD23      LEU 130  12.189   6.267   6.538
 1080    H    TYR 131           H        TYR 131  12.000   6.405  12.153
 1081    HA   TYR 131           HA       TYR 131  10.626   8.522  13.585
 1082    HB2  TYR 131           HB2      TYR 131   9.293   6.685  14.852
 1083    HB3  TYR 131           HB3      TYR 131   8.698   7.252  13.299
 1084    HD1  TYR 131           HD1      TYR 131   8.262   5.738  11.585
 1085    HD2  TYR 131           HD2      TYR 131  10.669   4.496  14.868
 1086    HE1  TYR 131           HE1      TYR 131   8.183   3.428  10.759
 1087    HE2  TYR 131           HE2      TYR 131  10.601   2.179  14.044
 1088    HH   TYR 131           HH       TYR 131   9.121   0.784  12.628
 1089    H    LYS 132           H        LYS 132  13.283   7.855  13.505
 1090    HA   LYS 132           HA       LYS 132  13.733   7.100  16.307
 1091    HB2  LYS 132           HB2      LYS 132  14.546   5.192  15.251
 1092    HB3  LYS 132           HB3      LYS 132  15.082   6.082  13.837
 1093    HG2  LYS 132           HG2      LYS 132  16.825   7.126  15.423
 1094    HG3  LYS 132           HG3      LYS 132  16.427   5.776  16.490
 1095    HD2  LYS 132           HD2      LYS 132  17.171   4.182  14.944
 1096    HD3  LYS 132           HD3      LYS 132  17.113   5.328  13.604
 1097    HE2  LYS 132           HE2      LYS 132  18.955   6.601  14.764
 1098    HE3  LYS 132           HE3      LYS 132  19.097   5.232  15.866
 1099    HZ1  LYS 132           HZ1      LYS 132  19.687   3.812  14.077
 1100    HZ2  LYS 132           HZ2      LYS 132  20.657   5.190  13.948
 1101    HZ3  LYS 132           HZ3      LYS 132  19.323   4.990  12.916
 1102    H    LYS 133           H        LYS 133  14.564   8.924  17.332
 1103    HA   LYS 133           HA       LYS 133  16.394  10.488  15.659
 1104    HB2  LYS 133           HB2      LYS 133  16.144  12.347  17.233
 1105    HB3  LYS 133           HB3      LYS 133  14.638  11.906  16.443
 1106    HG2  LYS 133           HG2      LYS 133  13.901  10.763  18.471
 1107    HG3  LYS 133           HG3      LYS 133  15.421  11.181  19.263
 1108    HD2  LYS 133           HD2      LYS 133  14.875  13.591  18.854
 1109    HD3  LYS 133           HD3      LYS 133  13.294  13.078  18.270
 1110    HE2  LYS 133           HE2      LYS 133  14.381  12.510  21.024
 1111    HE3  LYS 133           HE3      LYS 133  13.286  13.831  20.632
 1112    HZ1  LYS 133           HZ1      LYS 133  12.699  10.937  20.333
 1113    HZ2  LYS 133           HZ2      LYS 133  11.645  12.198  19.912
 1114    HZ3  LYS 133           HZ3      LYS 133  12.086  11.963  21.527
 1115    H    ARG 134           H        ARG 134  17.821   8.685  16.090
 1116    HA   ARG 134           HA       ARG 134  19.699   9.755  18.053
 1117    HB2  ARG 134           HB2      ARG 134  18.964   6.866  17.682
 1118    HB3  ARG 134           HB3      ARG 134  20.635   7.273  18.042
 1119    HG2  ARG 134           HG2      ARG 134  19.681   6.789  20.113
 1120    HG3  ARG 134           HG3      ARG 134  19.721   8.550  20.045
 1121    HD2  ARG 134           HD2      ARG 134  17.352   8.485  19.252
 1122    HD3  ARG 134           HD3      ARG 134  17.352   6.752  19.579
 1123    HE   ARG 134           HE       ARG 134  17.852   8.777  21.669
 1124   HH11  ARG 134          HH11      ARG 134  16.344   5.806  20.584
 1125   HH12  ARG 134          HH12      ARG 134  15.541   5.517  22.094
 1126   HH21  ARG 134          HH21      ARG 134  16.795   8.396  23.652
 1127   HH22  ARG 134          HH22      ARG 134  15.787   7.000  23.834
 1128    H    GLN 135           H        GLN 135  20.269  10.962  16.225
 1129    HA   GLN 135           HA       GLN 135  21.282   9.421  13.949
 1130    HB2  GLN 135           HB2      GLN 135  20.482  12.321  14.157
 1131    HB3  GLN 135           HB3      GLN 135  21.184  11.591  12.717
 1132    HG2  GLN 135           HG2      GLN 135  18.575  10.822  14.019
 1133    HG3  GLN 135           HG3      GLN 135  18.771  11.726  12.517
 1134   HE21  GLN 135          HE21      GLN 135  17.413   9.170  13.023
 1135   HE22  GLN 135          HE22      GLN 135  18.176   8.005  11.978
 1136    H    LYS 136           H        LYS 136  23.295   8.946  14.090
 1137    HA   LYS 136           HA       LYS 136  25.242  11.073  14.605
 1138    HB2  LYS 136           HB2      LYS 136  26.659   9.468  15.818
 1139    HB3  LYS 136           HB3      LYS 136  25.105   9.663  16.616
 1140    HG2  LYS 136           HG2      LYS 136  24.355   7.577  15.414
 1141    HG3  LYS 136           HG3      LYS 136  26.038   7.352  14.938
 1142    HD2  LYS 136           HD2      LYS 136  25.680   6.034  16.879
 1143    HD3  LYS 136           HD3      LYS 136  26.631   7.433  17.381
 1144    HE2  LYS 136           HE2      LYS 136  24.644   8.509  18.255
 1145    HE3  LYS 136           HE3      LYS 136  23.638   7.194  17.655
 1146    HZ1  LYS 136           HZ1      LYS 136  24.744   5.686  19.165
 1147    HZ2  LYS 136           HZ2      LYS 136  24.087   6.982  20.023
 1148    HZ3  LYS 136           HZ3      LYS 136  25.749   6.922  19.727
 1149    H    LYS 137           H        LYS 137  27.549   9.690  13.983
 1150    HA   LYS 137           HA       LYS 137  27.294   9.501  11.160
 1151    HB2  LYS 137           HB2      LYS 137  29.345  10.327  12.269
 1152    HB3  LYS 137           HB3      LYS 137  29.654   8.707  12.872
 1153    HG2  LYS 137           HG2      LYS 137  29.366   9.183   9.935
 1154    HG3  LYS 137           HG3      LYS 137  30.882   9.558  10.748
 1155    HD2  LYS 137           HD2      LYS 137  31.464   7.417  10.547
 1156    HD3  LYS 137           HD3      LYS 137  30.137   6.986  11.622
 1157    HE2  LYS 137           HE2      LYS 137  29.957   5.701   9.601
 1158    HE3  LYS 137           HE3      LYS 137  28.629   6.865   9.649
 1159    HZ1  LYS 137           HZ1      LYS 137  31.146   7.094   8.076
 1160    HZ2  LYS 137           HZ2      LYS 137  29.966   8.302   8.172
 1161    HZ3  LYS 137           HZ3      LYS 137  29.596   6.816   7.464
 1162    H    LEU 138           H        LEU 138  26.026   7.882  10.498
 1163    HA   LEU 138           HA       LEU 138  27.411   5.297  10.488
 1164    HB2  LEU 138           HB2      LEU 138  24.451   5.746  10.738
 1165    HB3  LEU 138           HB3      LEU 138  25.107   4.280  10.056
 1166    HG   LEU 138           HG       LEU 138  24.566   3.746  12.272
 1167   HD11  LEU 138          HD11      LEU 138  26.692   3.244  13.337
 1168   HD12  LEU 138          HD12      LEU 138  27.511   4.369  12.256
 1169   HD13  LEU 138          HD13      LEU 138  26.754   2.914  11.605
 1170   HD21  LEU 138          HD21      LEU 138  25.340   5.062  14.207
 1171   HD22  LEU 138          HD22      LEU 138  24.214   5.938  13.170
 1172   HD23  LEU 138          HD23      LEU 138  25.942   6.289  13.092
 1173    H    ALA 139           H        ALA 139  26.794   4.044   8.481
 1174    HA   ALA 139           HA       ALA 139  26.905   5.651   6.157
 1175    HB1  ALA 139           HB1      ALA 139  26.608   3.574   4.928
 1176    HB2  ALA 139           HB2      ALA 139  26.095   2.754   6.402
 1177    HB3  ALA 139           HB3      ALA 139  27.751   3.342   6.251
 1178    H    SER 140           H        SER 140  25.208   5.400   4.361
 1179    HA   SER 140           HA       SER 140  22.832   6.603   5.206
 1180    HB2  SER 140           HB2      SER 140  22.117   5.817   2.776
 1181    HB3  SER 140           HB3      SER 140  23.311   7.093   3.013
 1182    HG   SER 140           HG       SER 140  24.519   5.848   1.824
 1183    H    SER 141           H        SER 141  21.227   5.743   6.303
 1184    HA   SER 141           HA       SER 141  20.103   3.194   5.509
 1185    HB2  SER 141           HB2      SER 141  20.918   3.765   8.375
 1186    HB3  SER 141           HB3      SER 141  20.076   2.326   7.800
 1187    HG   SER 141           HG       SER 141  22.370   2.818   6.413