*HEADER    OXIDOREDUCTASE                          13-JUL-15   2N5A              
*TITLE     STRUCTURES OF THE REDUCED STATE OF THE MUTANT D24A OF YEAST           
*TITLE    2 THIOREDOXIN 1                                                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: THIOREDOXIN-1;                                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: THIOREDOXIN I, TR-I, THIOREDOXIN-2;                         
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE S288C;                 
*SOURCE   3 ORGANISM_COMMON: BAKER'S YEAST;                                      
*SOURCE   4 ORGANISM_TAXID: 559292;                                              
*SOURCE   5 STRAIN: ATCC 204508 / S288C;                                         
*SOURCE   6 GENE: TRX1, TRX2, YLR043C;                                           
*SOURCE   7 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   8 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   9 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR: PET17B                                     
*KEYWDS    REDOX CATALYTIC ACTIVITY, WATER CAVITY, PROTEIN HYDRATION,            
*KEYWDS   2 OXIDOREDUCTASE                                                       
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    A.IQBAL, A.H.MORAES, A.P.VALENTE, F.C.L.ALMEIDA                       
*REVDAT   1   28-OCT-15 2N5A    0                                                


! V 2   Phi Psi
assign (resid  1 and name C ) (resid  2 and name N)
       (resid  2 and name CA) (resid  2 and name C) 1.0  -101.27    20.00  2
assign (resid  2 and name N) (resid  2 and name CA)
       (resid  2 and name C) (resid  3 and name  N) 1.0   129.26    20.00  2
! T 3   Phi Psi
assign (resid  2 and name C ) (resid  3 and name N)
       (resid  3 and name CA) (resid  3 and name C) 1.0   -89.46    31.81  2
assign (resid  3 and name N) (resid  3 and name CA)
       (resid  3 and name C) (resid  4 and name  N) 1.0   123.96    20.00  2
! Q 4   Phi Psi
assign (resid  3 and name C ) (resid  4 and name N)
       (resid  4 and name CA) (resid  4 and name C) 1.0   -95.02    29.16  2
assign (resid  4 and name N) (resid  4 and name CA)
       (resid  4 and name C) (resid  5 and name  N) 1.0   118.70    20.00  2
! F 5   Phi Psi
assign (resid  4 and name C ) (resid  5 and name N)
       (resid  5 and name CA) (resid  5 and name C) 1.0   -88.59    22.67  2
assign (resid  5 and name N) (resid  5 and name CA)
       (resid  5 and name C) (resid  6 and name  N) 1.0   131.91    37.68  2
! K 6   Phi Psi
assign (resid  5 and name C ) (resid  6 and name N)
       (resid  6 and name CA) (resid  6 and name C) 1.0  -107.12    26.74  2
assign (resid  6 and name N) (resid  6 and name CA)
       (resid  6 and name C) (resid  7 and name  N) 1.0   -18.52    20.00  2
! T 7   Phi Psi
assign (resid  6 and name C ) (resid  7 and name N)
       (resid  7 and name CA) (resid  7 and name C) 1.0  -135.44    20.00  2
assign (resid  7 and name N) (resid  7 and name CA)
       (resid  7 and name C) (resid  8 and name  N) 1.0   158.71    20.00  2
! A 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   -63.54    20.00  2
assign (resid  8 and name N) (resid  8 and name CA)
       (resid  8 and name C) (resid  9 and name  N) 1.0   -35.93    20.00  2
! S 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   -61.27    20.00  2
assign (resid  9 and name N) (resid  9 and name CA)
       (resid  9 and name C) (resid  10 and name  N) 1.0   -39.46    20.00  2
! E 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   -67.94    20.00  2
assign (resid  10 and name N) (resid  10 and name CA)
       (resid  10 and name C) (resid  11 and name  N) 1.0   -39.72    20.00  2
! F 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   -64.84    20.00  2
assign (resid  11 and name N) (resid  11 and name CA)
       (resid  11 and name C) (resid  12 and name  N) 1.0   -44.54    20.00  2
! D 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   -61.04    20.00  2
assign (resid  12 and name N) (resid  12 and name CA)
       (resid  12 and name C) (resid  13 and name  N) 1.0   -40.69    20.00  2
! S 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   -66.00    20.00  2
assign (resid  13 and name N) (resid  13 and name CA)
       (resid  13 and name C) (resid  14 and name  N) 1.0   -39.26    20.00  2
! A 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   -65.39    20.00  2
assign (resid  14 and name N) (resid  14 and name CA)
       (resid  14 and name C) (resid  15 and name  N) 1.0   -41.34    20.00  2
! I 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   -70.98    20.00  2
assign (resid  15 and name N) (resid  15 and name CA)
       (resid  15 and name C) (resid  16 and name  N) 1.0   -19.78    20.00  2
! A 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   -86.97    20.00  2
assign (resid  16 and name N) (resid  16 and name CA)
       (resid  16 and name C) (resid  17 and name  N) 1.0    -7.14    20.00  2
! Q 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  -106.92    61.19  2
assign (resid  17 and name N) (resid  17 and name CA)
       (resid  17 and name C) (resid  18 and name  N) 1.0   151.27    25.42  2
! K 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  -125.05    49.32  2
assign (resid  19 and name N) (resid  19 and name CA)
       (resid  19 and name C) (resid  20 and name  N) 1.0   151.94    26.90  2
! V 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  -111.40    23.98  2
assign (resid  21 and name N) (resid  21 and name CA)
       (resid  21 and name C) (resid  22 and name  N) 1.0   128.50    20.00  2
! V 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  -103.59    23.70  2
assign (resid  22 and name N) (resid  22 and name CA)
       (resid  22 and name C) (resid  23 and name  N) 1.0   123.86    20.00  2
! V 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  -110.01    20.00  2
assign (resid  23 and name N) (resid  23 and name CA)
       (resid  23 and name C) (resid  24 and name  N) 1.0   124.70    20.00  2
! A 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  -106.13    20.55  2
assign (resid  24 and name N) (resid  24 and name CA)
       (resid  24 and name C) (resid  25 and name  N) 1.0   117.71    20.00  2
! F 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   -90.57    20.00  2
assign (resid  25 and name N) (resid  25 and name CA)
       (resid  25 and name C) (resid  26 and name  N) 1.0   121.22    20.00  2
! Y 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  -142.98    20.00  2
assign (resid  26 and name N) (resid  26 and name CA)
       (resid  26 and name C) (resid  27 and name  N) 1.0   168.34    20.00  2
! A 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  -141.00    29.21  2
assign (resid  27 and name N) (resid  27 and name CA)
       (resid  27 and name C) (resid  28 and name  N) 1.0   148.71    25.83  2
! T 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   -64.83    20.00  2
assign (resid  28 and name N) (resid  28 and name CA)
       (resid  28 and name C) (resid  29 and name  N) 1.0   -23.35    20.00  2
! W 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   -88.92    20.00  2
assign (resid  29 and name N) (resid  29 and name CA)
       (resid  29 and name C) (resid  30 and name  N) 1.0    -3.74    20.00  2
! C 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   -80.81    32.79  2
assign (resid  30 and name N) (resid  30 and name CA)
       (resid  30 and name C) (resid  31 and name  N) 1.0   123.51    35.46  2
! C 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   -59.86    20.00  2
assign (resid  33 and name N) (resid  33 and name CA)
       (resid  33 and name C) (resid  34 and name  N) 1.0   -37.71    20.00  2
! K 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   -62.38    20.00  2
assign (resid  34 and name N) (resid  34 and name CA)
       (resid  34 and name C) (resid  35 and name  N) 1.0   -29.41    20.00  2
! M 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   -68.91    20.00  2
assign (resid  35 and name N) (resid  35 and name CA)
       (resid  35 and name C) (resid  36 and name  N) 1.0   -29.86    20.00  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   -95.47    20.00  2
assign (resid  36 and name N) (resid  36 and name CA)
       (resid  36 and name C) (resid  37 and name  N) 1.0    -2.29    20.00  2
! A 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   -56.52    20.00  2
assign (resid  37 and name N) (resid  37 and name CA)
       (resid  37 and name C) (resid  38 and name  N) 1.0   -45.66    20.00  2
! P 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   -61.81    20.00  2
assign (resid  38 and name N) (resid  38 and name CA)
       (resid  38 and name C) (resid  39 and name  N) 1.0   -37.35    20.00  2
! M 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   -69.34    20.00  2
assign (resid  39 and name N) (resid  39 and name CA)
       (resid  39 and name C) (resid  40 and name  N) 1.0   -42.13    20.00  2
! I 40  Phi Psi
assign (resid  39 and name C ) (resid  40 and name N)
       (resid  40 and name CA) (resid  40 and name C) 1.0   -65.79    20.00  2
assign (resid  40 and name N) (resid  40 and name CA)
       (resid  40 and name C) (resid  41 and name  N) 1.0   -36.58    20.00  2
! E 41  Phi Psi
assign (resid  40 and name C ) (resid  41 and name N)
       (resid  41 and name CA) (resid  41 and name C) 1.0   -63.98    20.00  2
assign (resid  41 and name N) (resid  41 and name CA)
       (resid  41 and name C) (resid  42 and name  N) 1.0   -40.95    20.00  2
! K 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   -65.11    20.00  2
assign (resid  42 and name N) (resid  42 and name CA)
       (resid  42 and name C) (resid  43 and name  N) 1.0   -40.78    20.00  2
! F 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   -64.31    20.00  2
assign (resid  43 and name N) (resid  43 and name CA)
       (resid  43 and name C) (resid  44 and name  N) 1.0   -43.18    20.00  2
! S 44  Phi Psi
assign (resid  43 and name C ) (resid  44 and name N)
       (resid  44 and name CA) (resid  44 and name C) 1.0   -63.86    20.00  2
assign (resid  44 and name N) (resid  44 and name CA)
       (resid  44 and name C) (resid  45 and name  N) 1.0   -35.75    20.00  2
! E 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   -71.07    20.00  2
assign (resid  45 and name N) (resid  45 and name CA)
       (resid  45 and name C) (resid  46 and name  N) 1.0   -32.07    20.00  2
! Q 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   -79.83    20.00  2
assign (resid  46 and name N) (resid  46 and name CA)
       (resid  46 and name C) (resid  47 and name  N) 1.0   -29.93    20.00  2
! Y 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  -130.76    20.00  2
assign (resid  47 and name N) (resid  47 and name CA)
       (resid  47 and name C) (resid  48 and name  N) 1.0    69.64    20.00  2
! P 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   -63.71    20.00  2
assign (resid  48 and name N) (resid  48 and name CA)
       (resid  48 and name C) (resid  49 and name  N) 1.0   -22.43    20.00  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   -86.51    20.00  2
assign (resid  49 and name N) (resid  49 and name CA)
       (resid  49 and name C) (resid  50 and name  N) 1.0    -1.20    21.45  2
! A 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  -122.71    20.00  2
assign (resid  50 and name N) (resid  50 and name CA)
       (resid  50 and name C) (resid  51 and name  N) 1.0   139.76    25.28  2
! D 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  -122.29    29.33  2
assign (resid  51 and name N) (resid  51 and name CA)
       (resid  51 and name C) (resid  52 and name  N) 1.0   142.19    20.87  2
! F 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  -108.65    27.80  2
assign (resid  52 and name N) (resid  52 and name CA)
       (resid  52 and name C) (resid  53 and name  N) 1.0   136.51    20.00  2
! Y 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  -130.55    20.00  2
assign (resid  53 and name N) (resid  53 and name CA)
       (resid  53 and name C) (resid  54 and name  N) 1.0   157.15    20.00  2
! K 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  -128.52    20.00  2
assign (resid  54 and name N) (resid  54 and name CA)
       (resid  54 and name C) (resid  55 and name  N) 1.0   141.84    22.35  2
! L 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  -137.60    21.42  2
assign (resid  55 and name N) (resid  55 and name CA)
       (resid  55 and name C) (resid  56 and name  N) 1.0   131.06    20.86  2
! D 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   -86.97    20.00  2
assign (resid  56 and name N) (resid  56 and name CA)
       (resid  56 and name C) (resid  57 and name  N) 1.0   109.86    20.00  2
! V 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   -61.13    20.00  2
assign (resid  57 and name N) (resid  57 and name CA)
       (resid  57 and name C) (resid  58 and name  N) 1.0   -27.14    20.00  2
! D 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   -72.22    20.00  2
assign (resid  58 and name N) (resid  58 and name CA)
       (resid  58 and name C) (resid  59 and name  N) 1.0   -23.82    25.62  2
! E 59  Phi Psi
assign (resid  58 and name C ) (resid  59 and name N)
       (resid  59 and name CA) (resid  59 and name C) 1.0   -85.49    26.13  2
assign (resid  59 and name N) (resid  59 and name CA)
       (resid  59 and name C) (resid  60 and name  N) 1.0   -18.02    23.64  2
! G 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   -58.02    20.00  2
assign (resid  61 and name N) (resid  61 and name CA)
       (resid  61 and name C) (resid  62 and name  N) 1.0   -41.28    20.00  2
! D 62  Phi Psi
assign (resid  61 and name C ) (resid  62 and name N)
       (resid  62 and name CA) (resid  62 and name C) 1.0   -63.46    20.00  2
assign (resid  62 and name N) (resid  62 and name CA)
       (resid  62 and name C) (resid  63 and name  N) 1.0   -40.87    20.00  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   -67.39    20.00  2
assign (resid  63 and name N) (resid  63 and name CA)
       (resid  63 and name C) (resid  64 and name  N) 1.0   -42.95    20.00  2
! A 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   -64.36    20.00  2
assign (resid  64 and name N) (resid  64 and name CA)
       (resid  64 and name C) (resid  65 and name  N) 1.0   -42.25    20.00  2
! Q 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   -65.16    20.00  2
assign (resid  65 and name N) (resid  65 and name CA)
       (resid  65 and name C) (resid  66 and name  N) 1.0   -39.85    20.00  2
! K 66  Phi Psi
assign (resid  65 and name C ) (resid  66 and name N)
       (resid  66 and name CA) (resid  66 and name C) 1.0   -66.04    20.00  2
assign (resid  66 and name N) (resid  66 and name CA)
       (resid  66 and name C) (resid  67 and name  N) 1.0   -30.08    20.00  2
! N 67  Phi Psi
assign (resid  66 and name C ) (resid  67 and name N)
       (resid  67 and name CA) (resid  67 and name C) 1.0   -98.24    20.00  2
assign (resid  67 and name N) (resid  67 and name CA)
       (resid  67 and name C) (resid  68 and name  N) 1.0     7.60    20.00  2
! E 68  Phi Psi
assign (resid  67 and name C ) (resid  68 and name N)
       (resid  68 and name CA) (resid  68 and name C) 1.0    58.59    20.00  2
assign (resid  68 and name N) (resid  68 and name CA)
       (resid  68 and name C) (resid  69 and name  N) 1.0    38.26    20.00  2
! V 69  Phi Psi
assign (resid  68 and name C ) (resid  69 and name N)
       (resid  69 and name CA) (resid  69 and name C) 1.0   -83.90    22.04  2
assign (resid  69 and name N) (resid  69 and name CA)
       (resid  69 and name C) (resid  70 and name  N) 1.0   128.21    20.00  2
! A 71  Phi Psi
assign (resid  70 and name C ) (resid  71 and name N)
       (resid  71 and name CA) (resid  71 and name C) 1.0  -124.11    43.75  2
assign (resid  71 and name N) (resid  71 and name CA)
       (resid  71 and name C) (resid  72 and name  N) 1.0   141.26    24.78  2
! M 72  Phi Psi
assign (resid  71 and name C ) (resid  72 and name N)
       (resid  72 and name CA) (resid  72 and name C) 1.0  -130.99    20.00  2
assign (resid  72 and name N) (resid  72 and name CA)
       (resid  72 and name C) (resid  73 and name  N) 1.0   144.70    28.61  2
! P 73  Phi Psi
assign (resid  72 and name C ) (resid  73 and name N)
       (resid  73 and name CA) (resid  73 and name C) 1.0   -72.77    20.00  2
assign (resid  73 and name N) (resid  73 and name CA)
       (resid  73 and name C) (resid  74 and name  N) 1.0   152.76    22.41  2
! T 74  Phi Psi
assign (resid  73 and name C ) (resid  74 and name N)
       (resid  74 and name CA) (resid  74 and name C) 1.0  -133.88    20.18  2
assign (resid  74 and name N) (resid  74 and name CA)
       (resid  74 and name C) (resid  75 and name  N) 1.0   136.78    20.00  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  -111.26    20.00  2
assign (resid  75 and name N) (resid  75 and name CA)
       (resid  75 and name C) (resid  76 and name  N) 1.0   126.01    20.00  2
! L 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  -125.59    21.27  2
assign (resid  76 and name N) (resid  76 and name CA)
       (resid  76 and name C) (resid  77 and name  N) 1.0   134.05    20.00  2
! L 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  -103.38    20.00  2
assign (resid  77 and name N) (resid  77 and name CA)
       (resid  77 and name C) (resid  78 and name  N) 1.0   126.63    20.00  2
! F 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  -118.58    20.00  2
assign (resid  78 and name N) (resid  78 and name CA)
       (resid  78 and name C) (resid  79 and name  N) 1.0   144.97    20.00  2
! K 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  -141.90    20.00  2
assign (resid  79 and name N) (resid  79 and name CA)
       (resid  79 and name C) (resid  80 and name  N) 1.0   128.55    20.00  2
! N 80  Phi Psi
assign (resid  79 and name C ) (resid  80 and name N)
       (resid  80 and name CA) (resid  80 and name C) 1.0    58.01    20.00  2
assign (resid  80 and name N) (resid  80 and name CA)
       (resid  80 and name C) (resid  81 and name  N) 1.0    35.22    20.00  2
! G 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    84.05    20.00  2
assign (resid  81 and name N) (resid  81 and name CA)
       (resid  81 and name C) (resid  82 and name  N) 1.0     7.97    20.14  2
! K 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  -123.70    20.00  2
assign (resid  82 and name N) (resid  82 and name CA)
       (resid  82 and name C) (resid  83 and name  N) 1.0   140.10    20.00  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   -69.95    20.00  2
!assign (resid  83 and name N) (resid  83 and name CA)
!       (resid  83 and name C) (resid  84 and name  N) 1.0   128.65    20.00  2
! V 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  -114.93    20.00  2
!assign (resid  84 and name N) (resid  84 and name CA)
!       (resid  84 and name C) (resid  85 and name  N) 1.0   -17.27    20.00  2
! A 85  Phi Psi
assign (resid  84 and name C ) (resid  85 and name N)
       (resid  85 and name CA) (resid  85 and name C) 1.0  -161.60    20.00  2
assign (resid  85 and name N) (resid  85 and name CA)
       (resid  85 and name C) (resid  86 and name  N) 1.0   155.88    20.71  2
! K 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  -130.01    24.84  2
assign (resid  86 and name N) (resid  86 and name CA)
       (resid  86 and name C) (resid  87 and name  N) 1.0   129.89    21.16  2
! V 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  -110.76    20.00  2
assign (resid  87 and name N) (resid  87 and name CA)
       (resid  87 and name C) (resid  88 and name  N) 1.0   124.14    20.00  2
! V 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  -104.09    23.32  2
!assign (resid  88 and name N) (resid  88 and name CA)
!       (resid  88 and name C) (resid  89 and name  N) 1.0   121.49    20.00  2
! G 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  -105.00    36.87  2
!assign (resid  89 and name N) (resid  89 and name CA)
       (resid  89 and name C) (resid  90 and name  N) 1.0   167.27    40.59  2
! N 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   -85.24    30.71  2
assign (resid  91 and name N) (resid  91 and name CA)
       (resid  91 and name C) (resid  92 and name  N) 1.0   122.94    31.30  2
! A 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   -63.70    20.00  2
assign (resid  93 and name N) (resid  93 and name CA)
       (resid  93 and name C) (resid  94 and name  N) 1.0   -38.51    20.00  2
! A 94  Phi Psi
assign (resid  93 and name C ) (resid  94 and name N)
       (resid  94 and name CA) (resid  94 and name C) 1.0   -67.30    20.00  2
assign (resid  94 and name N) (resid  94 and name CA)
       (resid  94 and name C) (resid  95 and name  N) 1.0   -38.19    20.00  2
! I 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   -67.21    20.00  2
assign (resid  95 and name N) (resid  95 and name CA)
       (resid  95 and name C) (resid  96 and name  N) 1.0   -44.61    20.00  2
! K 96  Phi Psi
assign (resid  95 and name C ) (resid  96 and name N)
       (resid  96 and name CA) (resid  96 and name C) 1.0   -61.15    20.00  2
assign (resid  96 and name N) (resid  96 and name CA)
       (resid  96 and name C) (resid  97 and name  N) 1.0   -43.54    20.00  2
! Q 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   -63.89    20.00  2
assign (resid  97 and name N) (resid  97 and name CA)
       (resid  97 and name C) (resid  98 and name  N) 1.0   -42.48    20.00  2
! A 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   -65.97    20.00  2
assign (resid  98 and name N) (resid  98 and name CA)
       (resid  98 and name C) (resid  99 and name  N) 1.0   -40.65    20.00  2
! I 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   -64.64    20.00  2
assign (resid  99 and name N) (resid  99 and name CA)
       (resid  99 and name C) (resid  100 and name  N) 1.0   -46.86    20.00  2
! A 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   -64.73    20.00  2
assign (resid  100 and name N) (resid  100 and name CA)
       (resid  100 and name C) (resid  101 and name  N) 1.0   -38.13    20.00  2
! A 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   -69.14    20.00  2
assign (resid  101 and name N) (resid  101 and name CA)
       (resid  101 and name C) (resid  102 and name  N) 1.0   -23.69    20.00  2
! N 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  -102.61    23.53  2
assign (resid  102 and name N) (resid  102 and name CA)
       (resid  102 and name C) (resid  103 and name  N) 1.0     1.32    27.45  2
#helix 1 > -4ppb/K

assign ( residue   11 and name HN  ) ( residue   7  and name O )  1.80  0.00  0.50
assign ( residue   11 and name N  )  ( residue   7  and name O )  2.80  0.00  0.50

assign ( residue   14 and name HN  ) ( residue   10  and name O )  1.80  0.00  0.50
assign ( residue   14 and name N  )  ( residue   10  and name O )  2.80  0.00  0.50

assign ( residue   16 and name HN  ) ( residue   12  and name O )  1.80  0.00  0.50
assign ( residue   16 and name N  )  ( residue   12  and name O )  2.80  0.00  0.50


#helix 2 > -4ppb/K

assign ( residue   37 and name HN  ) ( residue   33  and name O )  1.80  0.00  0.50
assign ( residue   37 and name N  )  ( residue   33  and name O )  2.80  0.00  0.50

assign ( residue   38 and name HN  ) ( residue   34  and name O )  1.80  0.00  0.50
assign ( residue   38 and name N  )  ( residue   34  and name O )  2.80  0.00  0.50

assign ( residue   39 and name HN  ) ( residue   35  and name O )  1.80  0.00  0.50
assign ( residue   39 and name N  )  ( residue   35  and name O )  2.80  0.00  0.50

assign ( residue   41 and name HN  ) ( residue   37  and name O )  1.80  0.00  0.50
assign ( residue   41 and name N  )  ( residue   37  and name O )  2.80  0.00  0.50

assign ( residue   42 and name HN  ) ( residue   38  and name O )  1.80  0.00  0.50
assign ( residue   42 and name N  )  ( residue   38  and name O )  2.80  0.00  0.50

assign ( residue   43 and name HN  ) ( residue   39  and name O )  1.80  0.00  0.50
assign ( residue   43 and name N  )  ( residue   39  and name O )  2.80  0.00  0.50

assign ( residue   45 and name HN  ) ( residue   41  and name O )  1.80  0.00  0.50
assign ( residue   45 and name N  )  ( residue   41  and name O )  2.80  0.00  0.50

assign ( residue   46 and name HN  ) ( residue   42  and name O )  1.80  0.00  0.50
assign ( residue   46 and name N  )  ( residue   42  and name O )  2.80  0.00  0.50

#helix 3 > -4ppb/K

assign ( residue   60 and name HN  ) ( residue   56  and name O )  1.80  0.00  0.50
assign ( residue   60 and name N  )  ( residue   56  and name O )  2.80  0.00  0.50

assign ( residue   64 and name HN  ) ( residue   60  and name O )  1.80  0.00  0.50
assign ( residue   64 and name N  )  ( residue   60  and name O )  2.80  0.00  0.50

assign ( residue   65 and name HN  ) ( residue   61  and name O )  1.80  0.00  0.50
assign ( residue   65 and name N  )  ( residue   61  and name O )  2.80  0.00  0.50

assign ( residue   66 and name HN  ) ( residue   62  and name O )  1.80  0.00  0.50
assign ( residue   66 and name N  )  ( residue   62  and name O )  2.80  0.00  0.50

#helix 4 > -4ppb/K

assign ( residue   98 and name HN  ) ( residue   94  and name O )  1.80  0.00  0.50
assign ( residue   98 and name N  )  ( residue   94  and name O )  2.80  0.00  0.50

assign ( residue   101 and name HN  ) ( residue   97  and name O )  1.80  0.00  0.50
assign ( residue   101 and name N  )  ( residue   97  and name O )  2.80  0.00  0.50

assign ( residue   102 and name HN  ) ( residue   98  and name O )  1.80  0.00  0.50
assign ( residue   102 and name N  )  ( residue   98  and name O )  2.80  0.00  0.50


#betas > -4 ppb/K

assign (resid 3 and name n) (resid 52 and name o) 2.8 0.4 0.9
assign (resid 3 and name hn) (resid 52 and name o) 1.8 0.4 0.9
assign (resid 75 and name n) (resid 87 and name o) 2.8 0.4 0.9
assign (resid 75 and name hn) (resid 87 and name o) 1.8 0.4 0.9
assign (resid 77 and name n) (resid 85 and name o) 2.8 0.4 0.9
assign (resid 77 and name hn) (resid 85 and name o) 1.8 0.4 0.9
assign (resid 79 and name n) (resid 83 and name o) 2.8 0.4 0.9
assign (resid 79 and name hn) (resid 83 and name o) 1.8 0.4 0.9
assign (resid 25 and name n) (resid 74 and name o) 2.8 0.4 0.9
assign (resid 25 and name hn) (resid 74 and name o) 1.8 0.4 0.9
assign (resid 76 and name n) (resid 23 and name o) 2.8 0.4 0.9
assign (resid 76 and name hn) (resid 23 and name o) 1.8 0.4 0.9
assign (resid 23 and name n) (resid 76 and name o) 2.8 0.4 0.9
assign (resid 23 and name hn) (resid 76 and name o) 1.8 0.4 0.9
assign (resid 78 and name n) (resid 21 and name o) 2.8 0.4 0.9
assign (resid 78 and name hn) (resid 21 and name o) 1.8 0.4 0.9
assign (resid 21 and name n) (resid 78 and name o) 2.8 0.4 0.9
assign (resid 21 and name hn) (resid 78 and name o) 1.8 0.4 0.9
assign (resid 51 and name n) (resid 20 and name o) 2.8 0.4 0.9
assign (resid 51 and name hn) (resid 20 and name o) 1.8 0.4 0.9
assign (resid 54 and name n) (resid 3 and name o) 2.8 0.4 0.9
assign (resid 54 and name hn) (resid 3 and name o) 1.8 0.4 0.9
assign (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   23 and name HG23) 2.140 0.573 0.573 weight 1.000 ! spec=13C_...roma, no=16, id=2234, vol=9.510701e+05
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   23 and name HG21)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   23 and name HG22)
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   23 and name HG23)
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   23 and name HG21)
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   23 and name HG22)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   23 and name HG13)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   23 and name HG11)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   23 and name HG12)
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   23 and name HG13)
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   23 and name HG11)
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   23 and name HG12)
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   26 and name  HD2) 2.030 0.515 0.515 weight 1.000 ! spec=13C_...roma, no=22, id=2239, vol=1.311390e+06
    or (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   26 and name  HD1)
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   26 and name  HD2)
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   26 and name  HD1)
assign (segid "   A" and resid   47 and name  HB2) (segid "   A" and resid   47 and name  HD1) 2.155 0.580 0.580 weight 1.000 ! spec=13C_...roma, no=48, id=2262, vol=1.000445e+06
    or (segid "   A" and resid   47 and name  HB2) (segid "   A" and resid   47 and name  HD2)
    or (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   47 and name  HD1)
    or (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   47 and name  HD2)
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   47 and name  HD1) 2.650 0.878 0.878 weight 1.000 ! spec=13C_...roma, no=49, id=2263, vol=2.765978e+05
    or (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   47 and name  HD2)
    or (segid "   A" and resid   47 and name  HD1) (segid "   A" and resid   46 and name  HB1)
    or (segid "   A" and resid   47 and name  HD2) (segid "   A" and resid   46 and name  HB1)
assign (segid "   A" and resid   47 and name  HE1) (segid "   A" and resid   46 and name  HB2) 2.831 1.002 1.002 weight 1.000 ! spec=13C_...roma, no=55, id=2269, vol=1.842958e+05
    or (segid "   A" and resid   47 and name  HE2) (segid "   A" and resid   46 and name  HB2)
    or (segid "   A" and resid   47 and name  HE1) (segid "   A" and resid   46 and name  HB1)
    or (segid "   A" and resid   47 and name  HE2) (segid "   A" and resid   46 and name  HB1)
assign (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   15 and name HG12) 2.217 0.615 0.615 weight 1.000 ! spec=13C_NOESY, no=2, id=873, vol=5.380574e+06
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   15 and name HG12)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   15 and name HG12)
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   15 and name HG11)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   15 and name HG11)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   15 and name HG11)
assign (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   23 and name HG23) 1.941 0.471 0.471 weight 1.000 ! spec=13C_NOESY, no=3, id=874, vol=1.146073e+07
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   23 and name HG21)
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   23 and name HG22)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   23 and name HG23)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   23 and name HG21)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   23 and name HG22)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   23 and name HG23)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   23 and name HG21)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   23 and name HG22)
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   14 and name  HB2)
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   14 and name  HB3)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   14 and name  HB2)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   14 and name  HB3)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   14 and name  HB2)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   14 and name  HB3)
assign (segid "   A" and resid   27 and name  HB3) (segid "   A" and resid   29 and name  HD1) 2.637 0.869 0.869 weight 1.000 ! spec=13C_NOESY, no=30, id=901, vol=1.251775e+06
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   29 and name  HD1)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   29 and name  HD1)
    or (segid "   A" and resid   27 and name  HB3) (segid "   A" and resid   29 and name  HZ2)
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   29 and name  HZ2)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   29 and name  HZ2)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   27 and name  HB3) 2.584 0.835 0.835 weight 1.000 ! spec=13C_NOESY, no=31, id=902, vol=1.212044e+06
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   27 and name  HB2)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   27 and name  HB3)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   34 and name  HB1) 2.619 0.858 0.858 weight 1.000 ! spec=13C_NOESY, no=40, id=911, vol=2.261660e+06
    or (segid "   A" and resid   37 and name  HB3) (segid "   A" and resid   34 and name  HB1)
    or (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   34 and name  HB1)
    or (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   34 and name  HB2)
    or (segid "   A" and resid   37 and name  HB3) (segid "   A" and resid   34 and name  HB2)
    or (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   34 and name  HB2)
assign (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name  HB1) 1.731 0.375 0.375 weight 1.000 ! spec=13C_NOESY, no=54, id=925, vol=2.732981e+07
    or (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name  HB3)
    or (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name  HB2)
    or (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   94 and name  HB3)
    or (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   94 and name  HB1)
    or (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   94 and name  HB2)
assign (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   97 and name  HB1) 1.927 0.464 0.464 weight 1.000 ! spec=13C_NOESY, no=55, id=926, vol=1.350697e+07
    or (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   97 and name  HB2)
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   78 and name  HB1) 2.239 0.627 0.627 weight 1.000 ! spec=13C_NOESY, no=113, id=984, vol=5.290830e+06
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   78 and name  HB2)
assign (segid "   A" and resid   78 and name  HB1) (segid "   A" and resid   78 and name  HD2) 2.471 0.763 0.763 weight 1.000 ! spec=13C_NOESY, no=115, id=986, vol=3.174373e+06
    or (segid "   A" and resid   78 and name  HB1) (segid "   A" and resid   78 and name  HD1)
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   78 and name  HD2)
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   78 and name  HD1)
assign (segid "   A" and resid   78 and name  HB1) (segid "   A" and resid   15 and name   HB) 2.688 0.903 0.903 weight 1.000 ! spec=13C_NOESY, no=119, id=990, vol=1.840082e+06
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   15 and name   HB)
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   23 and name HG23)
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   23 and name HG21)
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   23 and name HG22)
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   13 and name  HB2) 1.965 0.483 0.483 weight 1.000 ! spec=13C_NOESY, no=120, id=991, vol=9.298380e+06
    or (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   13 and name  HB1)
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name   HA) 2.687 0.903 0.903 weight 1.000 ! spec=13C_NOESY, no=134, id=1005, vol=1.755671e+06
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   28 and name   HA)
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   26 and name   HA) 2.761 0.953 0.953 weight 1.000 ! spec=13C_NOESY, no=139, id=1010, vol=1.678191e+06
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name  HB1)
assign (segid "   A" and resid   47 and name   HA) (segid "   A" and resid   47 and name  HB2) 2.236 0.625 0.625 weight 1.000 ! spec=13C_NOESY, no=142, id=1013, vol=5.269382e+06
    or (segid "   A" and resid   47 and name   HA) (segid "   A" and resid   47 and name  HB1)
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name  HB1) 2.002 0.501 0.501 weight 1.000 ! spec=13C_NOESY, no=147, id=1018, vol=1.059102e+07
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name  HB2)
assign (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid   12 and name   HN) 2.567 0.824 0.824 weight 1.000 ! spec=13C_NOESY, no=152, id=1023, vol=2.510332e+06
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name  HB2)
assign (segid "   A" and resid   58 and name  HB1) (segid "   A" and resid   58 and name   HA) 2.186 0.597 0.597 weight 1.000 ! spec=13C_NOESY, no=172, id=1043, vol=6.453484e+06
    or (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   58 and name   HA)
assign (segid "   A" and resid   49 and name   HA) (segid "   A" and resid   49 and name  HB2) 2.065 0.533 0.533 weight 1.000 ! spec=13C_NOESY, no=178, id=1049, vol=9.300285e+06
    or (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   65 and name  HB1)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name   HA) 2.355 0.693 0.693 weight 1.000 ! spec=13C_NOESY, no=185, id=1056, vol=3.845362e+06
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name   HA)
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  102 and name  HB1) 2.538 0.805 0.805 weight 1.000 ! spec=13C_NOESY, no=223, id=1094, vol=2.547826e+06
    or (segid "   A" and resid  102 and name HD22) (segid "   A" and resid  102 and name  HB1)
assign (segid "   A" and resid   46 and name   HA) (segid "   A" and resid   46 and name  HB2) 1.991 0.496 0.496 weight 1.000 ! spec=13C_NOESY, no=247, id=1118, vol=1.045162e+07
    or (segid "   A" and resid   46 and name   HA) (segid "   A" and resid   46 and name  HB1)
assign (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   46 and name  HG2) 2.092 0.547 0.547 weight 1.000 ! spec=13C_NOESY, no=251, id=1122, vol=8.927900e+06
    or (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name  HG2)
assign (segid "   A" and resid   49 and name  HB2) (segid "   A" and resid   49 and name  HG1) 2.532 0.801 0.801 weight 1.000 ! spec=13C_NOESY, no=263, id=1134, vol=2.648000e+06
    or (segid "   A" and resid   49 and name  HB2) (segid "   A" and resid   49 and name  HG2)
assign (segid "   A" and resid   49 and name  HB1) (segid "   A" and resid   49 and name  HG2) 1.822 0.415 0.415 weight 1.000 ! spec=13C_NOESY, no=266, id=1137, vol=2.093410e+07
    or (segid "   A" and resid   49 and name  HB1) (segid "   A" and resid   49 and name  HG1)
assign (segid "   A" and resid   49 and name HE21) (segid "   A" and resid   49 and name  HG2) 2.564 0.822 0.822 weight 1.000 ! spec=13C_NOESY, no=267, id=1138, vol=2.376666e+06
    or (segid "   A" and resid   49 and name HE21) (segid "   A" and resid   49 and name  HG1)
assign (segid "   A" and resid   65 and name   HA) (segid "   A" and resid   65 and name  HB2) 2.045 0.523 0.523 weight 1.000 ! spec=13C_NOESY, no=269, id=1140, vol=9.911795e+06
    or (segid "   A" and resid   65 and name   HA) (segid "   A" and resid   65 and name  HB1)
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   39 and name   HA) 2.718 0.924 0.924 weight 1.000 ! spec=13C_NOESY, no=272, id=1143, vol=1.789600e+06
    or (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name   HA)
assign (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   97 and name  HB2) 1.930 0.465 0.465 weight 1.000 ! spec=13C_NOESY, no=274, id=1145, vol=1.478459e+07
    or (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   97 and name  HB1)
assign (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   10 and name   HA) 2.870 1.030 1.030 weight 1.000 ! spec=13C_NOESY, no=280, id=1151, vol=1.370086e+06
    or (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   10 and name   HA)
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid    5 and name  HE1) 2.773 0.961 0.961 weight 1.000 ! spec=13C_NOESY, no=282, id=1153, vol=1.427587e+06
    or (segid "   A" and resid   10 and name   HA) (segid "   A" and resid    5 and name  HE2)
    or (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   11 and name   HN)
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name  HB1) 2.218 0.615 0.615 weight 1.000 ! spec=13C_NOESY, no=291, id=1162, vol=6.004100e+06
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name  HB2)
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name  HB2) 2.118 0.561 0.561 weight 1.000 ! spec=13C_NOESY, no=292, id=1163, vol=8.212101e+06
    or (segid "   A" and resid   41 and name  HB1) (segid "   A" and resid   41 and name   HA)
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name  HB2) 1.841 0.423 0.423 weight 1.000 ! spec=13C_NOESY, no=300, id=1171, vol=1.749748e+07
    or (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name  HG1)
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   68 and name  HB2) 3.173 1.258 1.258 weight 1.000 ! spec=13C_NOESY, no=313, id=1184, vol=6.869531e+05
    or (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   68 and name  HB2)
assign (segid "   A" and resid   83 and name  HG1) (segid "   A" and resid   83 and name   HN) 2.850 1.015 1.015 weight 1.000 ! spec=13C_NOESY, no=326, id=1197, vol=1.269116e+06
    or (segid "   A" and resid   83 and name  HG2) (segid "   A" and resid   83 and name   HN)
assign (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   20 and name HD22) 1.719 0.369 0.369 weight 1.000 ! spec=13C_NOESY, no=337, id=1208, vol=2.656990e+07
    or (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   20 and name HD21)
    or (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   20 and name HD23)
    or (segid "   A" and resid   20 and name HD22) (segid "   A" and resid   77 and name  HB1)
    or (segid "   A" and resid   20 and name HD21) (segid "   A" and resid   77 and name  HB1)
    or (segid "   A" and resid   20 and name HD23) (segid "   A" and resid   77 and name  HB1)
assign (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   55 and name  HB2) 2.259 0.638 0.638 weight 1.000 ! spec=13C_NOESY, no=343, id=1214, vol=5.497413e+06
    or (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   55 and name  HB1)
assign (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   55 and name HD21) 2.435 0.741 0.741 weight 1.000 ! spec=13C_NOESY, no=350, id=1221, vol=3.422941e+06
    or (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   55 and name HD23)
    or (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   55 and name HD22)
    or (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   55 and name HD12)
    or (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   55 and name HD11)
    or (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   55 and name HD13)
assign (segid "   A" and resid   60 and name  HB1) (segid "   A" and resid   55 and name HD12) 2.383 0.710 0.710 weight 1.000 ! spec=13C_NOESY, no=363, id=1234, vol=4.081734e+06
    or (segid "   A" and resid   60 and name  HB1) (segid "   A" and resid   55 and name HD11)
    or (segid "   A" and resid   60 and name  HB1) (segid "   A" and resid   55 and name HD13)
    or (segid "   A" and resid   55 and name HD21) (segid "   A" and resid   60 and name  HB1)
    or (segid "   A" and resid   55 and name HD23) (segid "   A" and resid   60 and name  HB1)
    or (segid "   A" and resid   55 and name HD22) (segid "   A" and resid   60 and name  HB1)
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   54 and name  HB1) 2.101 0.552 0.552 weight 1.000 ! spec=13C_NOESY, no=364, id=1235, vol=8.521916e+06
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   75 and name  HB1)
assign (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   75 and name   HA) 2.661 0.885 0.885 weight 1.000 ! spec=13C_NOESY, no=365, id=1236, vol=1.968529e+06
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   75 and name  HB1)
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   75 and name  HB1) 2.851 1.016 1.016 weight 1.000 ! spec=13C_NOESY, no=373, id=1244, vol=1.265496e+06
    or (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   75 and name  HB2)
assign (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   74 and name   HA) 3.046 1.160 1.160 weight 1.000 ! spec=13C_NOESY, no=375, id=1246, vol=8.547024e+05
    or (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   24 and name   HA)
assign (segid "   A" and resid   75 and name  HB1) (segid "   A" and resid   24 and name   HA) 3.220 1.296 1.296 weight 1.000 ! spec=13C_NOESY, no=376, id=1247, vol=6.410194e+05
    or (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   24 and name   HA)
    or (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   74 and name   HA)
assign (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   75 and name HD11) 2.330 0.679 0.679 weight 1.000 ! spec=13C_NOESY, no=377, id=1248, vol=4.571858e+06
    or (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   75 and name HD13)
    or (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   75 and name HD12)
    or (segid "   A" and resid   75 and name  HB1) (segid "   A" and resid   75 and name HD22)
    or (segid "   A" and resid   75 and name  HB1) (segid "   A" and resid   75 and name HD21)
    or (segid "   A" and resid   75 and name  HB1) (segid "   A" and resid   75 and name HD23)
assign (segid "   A" and resid   75 and name  HB1) (segid "   A" and resid   75 and name HD22) 2.457 0.754 0.754 weight 1.000 ! spec=13C_NOESY, no=378, id=1249, vol=3.322010e+06
    or (segid "   A" and resid   75 and name  HB1) (segid "   A" and resid   75 and name HD21)
    or (segid "   A" and resid   75 and name  HB1) (segid "   A" and resid   75 and name HD23)
    or (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   75 and name HD22)
    or (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   75 and name HD21)
    or (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   75 and name HD23)
assign (segid "   A" and resid   75 and name HD22) (segid "   A" and resid   75 and name   HG) 2.059 0.530 0.530 weight 1.000 ! spec=13C_NOESY, no=380, id=1251, vol=9.428465e+06
    or (segid "   A" and resid   75 and name HD21) (segid "   A" and resid   75 and name   HG)
    or (segid "   A" and resid   75 and name HD23) (segid "   A" and resid   75 and name   HG)
    or (segid "   A" and resid   75 and name  HB1) (segid "   A" and resid   75 and name HD22)
    or (segid "   A" and resid   75 and name  HB1) (segid "   A" and resid   75 and name HD21)
    or (segid "   A" and resid   75 and name  HB1) (segid "   A" and resid   75 and name HD23)
assign (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name HD11) 2.544 0.809 0.809 weight 1.000 ! spec=13C_NOESY, no=392, id=1263, vol=2.783923e+06
    or (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name HD12)
    or (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name HD13)
    or (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name HD23)
    or (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name HD21)
    or (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name HD22)
assign (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   77 and name  HB1) 2.247 0.631 0.631 weight 1.000 ! spec=13C_NOESY, no=400, id=1271, vol=5.410716e+06
    or (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   77 and name  HB2)
assign (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   77 and name  HB2) 1.859 0.432 0.432 weight 1.000 ! spec=13C_NOESY, no=416, id=1287, vol=1.661769e+07
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   77 and name  HB2)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   77 and name  HB2)
    or (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   85 and name  HB2)
    or (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   85 and name  HB3)
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   85 and name  HB2)
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   85 and name  HB3)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   85 and name  HB2)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   85 and name  HB3)
assign (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   77 and name   HG) 2.031 0.516 0.516 weight 1.000 ! spec=13C_NOESY, no=423, id=1294, vol=1.024436e+07
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   77 and name   HG)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   77 and name   HG)
    or (segid "   A" and resid   77 and name   HG) (segid "   A" and resid   77 and name HD12)
    or (segid "   A" and resid   77 and name   HG) (segid "   A" and resid   77 and name HD11)
    or (segid "   A" and resid   77 and name   HG) (segid "   A" and resid   77 and name HD13)
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   78 and name  HB2) 2.712 0.920 0.920 weight 1.000 ! spec=13C_NOESY, no=430, id=1301, vol=1.623500e+06
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   78 and name  HB1)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name   HA) 2.797 0.978 0.978 weight 1.000 ! spec=13C_NOESY, no=431, id=1302, vol=1.383786e+06
    or (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid    5 and name  HE1)
    or (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid    5 and name  HE2)
assign (segid "   A" and resid   15 and name   HB) (segid "   A" and resid   15 and name HG12) 2.357 0.694 0.694 weight 1.000 ! spec=13C_NOESY, no=436, id=1307, vol=4.259019e+06
    or (segid "   A" and resid   15 and name   HB) (segid "   A" and resid   15 and name HG11)
assign (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   11 and name  HD2) 2.525 0.797 0.797 weight 1.000 ! spec=13C_NOESY, no=441, id=1312, vol=2.539463e+06
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   11 and name  HD1)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   11 and name  HD2)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   11 and name  HD1)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   11 and name  HD2)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   11 and name  HD1)
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   78 and name  HD2)
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   78 and name  HD1)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   78 and name  HD2)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   78 and name  HD1)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   78 and name  HD2)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   78 and name  HD1)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name HG12) 2.948 1.086 1.086 weight 1.000 ! spec=13C_NOESY, no=449, id=1320, vol=9.465672e+05
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name HG11)
assign (segid "   A" and resid   36 and name   HB) (segid "   A" and resid   36 and name HG12) 2.301 0.662 0.662 weight 1.000 ! spec=13C_NOESY, no=459, id=1330, vol=4.911519e+06
    or (segid "   A" and resid   36 and name   HB) (segid "   A" and resid   36 and name HG11)
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name   HB) 2.095 0.549 0.549 weight 1.000 ! spec=13C_NOESY, no=474, id=1345, vol=8.769947e+06
    or (segid "   A" and resid   63 and name   HA) (segid "   A" and resid   63 and name   HB)
assign (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   99 and name HG23) 1.964 0.482 0.482 weight 1.000 ! spec=13C_NOESY, no=480, id=1351, vol=1.226527e+07
    or (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   99 and name HG21)
    or (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   99 and name HG22)
    or (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   99 and name   HA)
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   99 and name   HA)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   99 and name   HA)
assign (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   99 and name   HB) 2.342 0.686 0.686 weight 1.000 ! spec=13C_NOESY, no=484, id=1355, vol=4.179448e+06
    or (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   98 and name  HB3)
    or (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   98 and name  HB1)
    or (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   98 and name  HB2)
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   38 and name   HA) 1.901 0.452 0.452 weight 1.000 ! spec=13C_NOESY, no=499, id=1370, vol=1.395796e+07
    or (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   38 and name   HA)
assign (segid "   A" and resid   73 and name   HA) (segid "   A" and resid   26 and name  HB2) 2.334 0.681 0.681 weight 1.000 ! spec=13C_NOESY, no=503, id=1374, vol=4.176154e+06
    or (segid "   A" and resid   73 and name   HA) (segid "   A" and resid   26 and name  HB1)
assign (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   17 and name  HB1) 2.136 0.570 0.570 weight 1.000 ! spec=13C_NOESY, no=505, id=1376, vol=7.503380e+06
    or (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid   17 and name  HB1)
assign (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid   21 and name HG11) 3.029 1.147 1.147 weight 1.000 ! spec=13C_NOESY, no=507, id=1378, vol=9.623548e+05
    or (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid   21 and name HG12)
    or (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid   21 and name HG13)
    or (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid   21 and name HG23)
    or (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid   21 and name HG21)
    or (segid "   A" and resid   17 and name  HG2) (segid "   A" and resid   21 and name HG22)
    or (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   21 and name HG23)
    or (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   21 and name HG21)
    or (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   21 and name HG22)
assign (segid "   A" and resid   73 and name  HB1) (segid "   A" and resid   73 and name   HA) 2.701 0.912 0.912 weight 1.000 ! spec=13C_NOESY, no=508, id=1379, vol=1.851666e+06
    or (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   73 and name   HA)
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   73 and name  HB1) 3.103 1.203 1.203 weight 1.000 ! spec=13C_NOESY, no=510, id=1381, vol=6.087692e+05
    or (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   74 and name   HN)
assign (segid "   A" and resid   73 and name   HA) (segid "   A" and resid   72 and name  HB2) 2.338 0.683 0.683 weight 1.000 ! spec=13C_NOESY, no=511, id=1382, vol=4.131472e+06
    or (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   73 and name   HA)
assign (segid "   A" and resid   69 and name   HB) (segid "   A" and resid   69 and name HG11) 2.015 0.507 0.507 weight 1.000 ! spec=13C_NOESY, no=539, id=1410, vol=9.230454e+06
    or (segid "   A" and resid   69 and name   HB) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   69 and name   HB) (segid "   A" and resid   69 and name HG13)
    or (segid "   A" and resid   69 and name HG11) (segid "   A" and resid   64 and name  HB1)
    or (segid "   A" and resid   69 and name HG11) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   69 and name HG11) (segid "   A" and resid   64 and name  HB3)
    or (segid "   A" and resid   69 and name HG12) (segid "   A" and resid   64 and name  HB1)
    or (segid "   A" and resid   69 and name HG12) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   69 and name HG12) (segid "   A" and resid   64 and name  HB3)
    or (segid "   A" and resid   69 and name HG13) (segid "   A" and resid   64 and name  HB1)
    or (segid "   A" and resid   69 and name HG13) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   69 and name HG13) (segid "   A" and resid   64 and name  HB3)
assign (segid "   A" and resid    2 and name HG11) (segid "   A" and resid   52 and name  HB1) 2.336 0.682 0.682 weight 1.000 ! spec=13C_NOESY, no=548, id=1419, vol=3.803659e+06
    or (segid "   A" and resid    2 and name HG13) (segid "   A" and resid   52 and name  HB1)
    or (segid "   A" and resid    2 and name HG12) (segid "   A" and resid   52 and name  HB1)
    or (segid "   A" and resid   69 and name HG22) (segid "   A" and resid   25 and name  HB1)
    or (segid "   A" and resid   69 and name HG21) (segid "   A" and resid   25 and name  HB1)
    or (segid "   A" and resid   69 and name HG23) (segid "   A" and resid   25 and name  HB1)
assign (segid "   A" and resid   69 and name HG22) (segid "   A" and resid   64 and name  HB1) 1.905 0.454 0.454 weight 1.000 ! spec=13C_NOESY, no=550, id=1421, vol=1.296841e+07
    or (segid "   A" and resid   69 and name HG22) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   69 and name HG22) (segid "   A" and resid   64 and name  HB3)
    or (segid "   A" and resid   69 and name HG21) (segid "   A" and resid   64 and name  HB1)
    or (segid "   A" and resid   69 and name HG21) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   69 and name HG21) (segid "   A" and resid   64 and name  HB3)
    or (segid "   A" and resid   69 and name HG23) (segid "   A" and resid   64 and name  HB1)
    or (segid "   A" and resid   69 and name HG23) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   69 and name HG23) (segid "   A" and resid   64 and name  HB3)
    or (segid "   A" and resid   69 and name   HB) (segid "   A" and resid   69 and name HG22)
    or (segid "   A" and resid   69 and name   HB) (segid "   A" and resid   69 and name HG21)
    or (segid "   A" and resid   69 and name   HB) (segid "   A" and resid   69 and name HG23)
assign (segid "   A" and resid   21 and name   HB) (segid "   A" and resid   21 and name HG23) 2.055 0.528 0.528 weight 1.000 ! spec=13C_NOESY, no=580, id=1451, vol=9.820133e+06
    or (segid "   A" and resid   21 and name   HB) (segid "   A" and resid   21 and name HG21)
    or (segid "   A" and resid   21 and name   HB) (segid "   A" and resid   21 and name HG22)
    or (segid "   A" and resid   21 and name   HB) (segid "   A" and resid   21 and name HG11)
    or (segid "   A" and resid   21 and name   HB) (segid "   A" and resid   21 and name HG12)
    or (segid "   A" and resid   21 and name   HB) (segid "   A" and resid   21 and name HG13)
assign (segid "   A" and resid   23 and name HG23) (segid "   A" and resid   23 and name   HB) 2.216 0.614 0.614 weight 1.000 ! spec=13C_NOESY, no=597, id=1468, vol=5.883804e+06
    or (segid "   A" and resid   23 and name HG21) (segid "   A" and resid   23 and name   HB)
    or (segid "   A" and resid   23 and name HG22) (segid "   A" and resid   23 and name   HB)
    or (segid "   A" and resid   23 and name   HB) (segid "   A" and resid   23 and name HG13)
    or (segid "   A" and resid   23 and name   HB) (segid "   A" and resid   23 and name HG11)
    or (segid "   A" and resid   23 and name   HB) (segid "   A" and resid   23 and name HG12)
assign (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   72 and name   HN) 2.978 1.109 1.109 weight 1.000 ! spec=13C_NOESY, no=599, id=1470, vol=9.984428e+05
    or (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   72 and name  HB1)
assign (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   72 and name  HB2) 2.512 0.789 0.789 weight 1.000 ! spec=13C_NOESY, no=614, id=1485, vol=2.705668e+06
    or (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   72 and name  HB1)
assign (segid "   A" and resid   35 and name  HE1) (segid "   A" and resid   35 and name   HA) 2.778 0.965 0.965 weight 1.000 ! spec=13C_NOESY, no=618, id=1489, vol=1.209894e+06
    or (segid "   A" and resid   35 and name  HE3) (segid "   A" and resid   35 and name   HA)
    or (segid "   A" and resid   35 and name  HE2) (segid "   A" and resid   35 and name   HA)
    or (segid "   A" and resid   35 and name  HE1) (segid "   A" and resid   90 and name   HA)
    or (segid "   A" and resid   35 and name  HE3) (segid "   A" and resid   90 and name   HA)
    or (segid "   A" and resid   35 and name  HE2) (segid "   A" and resid   90 and name   HA)
assign (segid "   A" and resid   99 and name   HB) (segid "   A" and resid   99 and name HD11) 1.981 0.490 0.490 weight 1.000 ! spec=13C_NOESY, no=638, id=1509, vol=1.085766e+07
    or (segid "   A" and resid   99 and name   HB) (segid "   A" and resid   99 and name HD12)
    or (segid "   A" and resid   99 and name   HB) (segid "   A" and resid   99 and name HD13)
    or (segid "   A" and resid   99 and name HD11) (segid "   A" and resid   98 and name  HB3)
    or (segid "   A" and resid   99 and name HD11) (segid "   A" and resid   98 and name  HB1)
    or (segid "   A" and resid   99 and name HD11) (segid "   A" and resid   98 and name  HB2)
    or (segid "   A" and resid   99 and name HD12) (segid "   A" and resid   98 and name  HB3)
    or (segid "   A" and resid   99 and name HD12) (segid "   A" and resid   98 and name  HB1)
    or (segid "   A" and resid   99 and name HD12) (segid "   A" and resid   98 and name  HB2)
    or (segid "   A" and resid   99 and name HD13) (segid "   A" and resid   98 and name  HB3)
    or (segid "   A" and resid   99 and name HD13) (segid "   A" and resid   98 and name  HB1)
    or (segid "   A" and resid   99 and name HD13) (segid "   A" and resid   98 and name  HB2)
assign (segid "   A" and resid    7 and name   HB) (segid "   A" and resid    7 and name   HN) 2.871 1.030 1.030 weight 1.000 ! spec=13C_NOESY, no=690, id=1561, vol=1.119773e+06
    or (segid "   A" and resid    7 and name   HB) (segid "   A" and resid   10 and name   HN)
assign (segid "   A" and resid    7 and name   HB) (segid "   A" and resid    9 and name  HB2) 2.936 1.078 1.078 weight 1.000 ! spec=13C_NOESY, no=692, id=1563, vol=1.083035e+06
    or (segid "   A" and resid    7 and name   HB) (segid "   A" and resid    9 and name  HB1)
assign (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   15 and name HG23) 2.630 0.864 0.864 weight 1.000 ! spec=13C_NOESY, no=705, id=1576, vol=1.854795e+06
    or (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name HG22)
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid    5 and name  HE1) 2.871 1.030 1.030 weight 1.000 ! spec=13C_NOESY, no=715, id=1586, vol=1.152246e+06
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid    5 and name  HE2)
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   16 and name   HN)
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   69 and name HG22) 2.767 0.957 0.957 weight 1.000 ! spec=13C_NOESY, no=767, id=1638, vol=1.430472e+06
    or (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   69 and name HG21)
    or (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   69 and name HG23)
    or (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   55 and name HD21)
    or (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   55 and name HD23)
    or (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   55 and name HD22)
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name HG11) 2.477 0.767 0.767 weight 1.000 ! spec=13C_NOESY, no=810, id=1681, vol=2.395146e+06
    or (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name HG12)
assign (segid "   A" and resid   65 and name  HG2) (segid "   A" and resid   64 and name   HN) 2.966 1.100 1.100 weight 1.000 ! spec=13C_NOESY, no=821, id=1692, vol=1.127957e+06
    or (segid "   A" and resid   65 and name  HG1) (segid "   A" and resid   63 and name   HN)
    or (segid "   A" and resid   65 and name  HG1) (segid "   A" and resid   64 and name   HN)
    or (segid "   A" and resid   65 and name  HG2) (segid "   A" and resid   63 and name   HN)
assign (segid "   A" and resid   49 and name   HA) (segid "   A" and resid   49 and name  HG1) 3.039 1.155 1.155 weight 1.000 ! spec=13C_NOESY, no=861, id=1732, vol=8.661285e+05
    or (segid "   A" and resid   49 and name  HG2) (segid "   A" and resid   49 and name   HA)
assign (segid "   A" and resid   49 and name  HG2) (segid "   A" and resid   50 and name  HB3) 2.993 1.120 1.120 weight 1.000 ! spec=13C_NOESY, no=862, id=1733, vol=9.706280e+05
    or (segid "   A" and resid   49 and name  HG2) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   49 and name  HG2) (segid "   A" and resid   50 and name  HB2)
    or (segid "   A" and resid   49 and name  HG1) (segid "   A" and resid   50 and name  HB3)
    or (segid "   A" and resid   49 and name  HG1) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   49 and name  HG1) (segid "   A" and resid   50 and name  HB2)
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name  HB2) 2.322 0.674 0.674 weight 1.000 ! spec=13C_NOESY, no=906, id=1777, vol=4.515836e+06
    or (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name  HB1)
assign (segid "   A" and resid   55 and name HD21) (segid "   A" and resid   59 and name  HB2) 3.068 1.176 1.176 weight 1.000 ! spec=13C_NOESY, no=922, id=1793, vol=8.039602e+05
    or (segid "   A" and resid   55 and name HD23) (segid "   A" and resid   59 and name  HB2)
    or (segid "   A" and resid   55 and name HD22) (segid "   A" and resid   59 and name  HB2)
    or (segid "   A" and resid   55 and name HD21) (segid "   A" and resid   59 and name  HB1)
    or (segid "   A" and resid   55 and name HD23) (segid "   A" and resid   59 and name  HB1)
    or (segid "   A" and resid   55 and name HD22) (segid "   A" and resid   59 and name  HB1)
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   63 and name   HB) 2.142 0.573 0.573 weight 1.000 ! spec=13C_NOESY, no=956, id=1827, vol=7.199956e+06
    or (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   63 and name   HB)
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   55 and name HD21) 2.694 0.907 0.907 weight 1.000 ! spec=13C_NOESY, no=960, id=1831, vol=1.915283e+06
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   55 and name HD23)
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   55 and name HD22)
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   69 and name HG22)
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   69 and name HG21)
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   69 and name HG23)
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   66 and name   HA) 2.587 0.837 0.837 weight 1.000 ! spec=13C_NOESY, no=974, id=1845, vol=2.151879e+06
    or (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   65 and name   HA)
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   90 and name  HB1) 2.676 0.895 0.895 weight 1.000 ! spec=13C_NOESY, no=976, id=1847, vol=1.947542e+06
    or (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   90 and name  HB2)
    or (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   90 and name  HB3)
    or (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   90 and name  HB1)
    or (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   90 and name  HB2)
    or (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   90 and name  HB3)
assign (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   66 and name  HG1) 3.050 1.163 1.163 weight 1.000 ! spec=13C_NOESY, no=980, id=1851, vol=8.032699e+05
    or (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   69 and name   HB)
assign (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   70 and name  HB1) 2.155 0.580 0.580 weight 1.000 ! spec=13C_NOESY, no=993, id=1864, vol=6.517254e+06
    or (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   70 and name   HA)
assign (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   74 and name HG23) 2.846 1.013 1.013 weight 1.000 ! spec=13C_NOESY, no=1027, id=1898, vol=7.899401e+05
    or (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   74 and name HG22)
    or (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   74 and name HG21)
    or (segid "   A" and resid   74 and name HG23) (segid "   A" and resid   76 and name   HN)
    or (segid "   A" and resid   74 and name HG22) (segid "   A" and resid   76 and name   HN)
    or (segid "   A" and resid   74 and name HG21) (segid "   A" and resid   76 and name   HN)
assign (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   21 and name   HN) 2.996 1.122 1.122 weight 1.000 ! spec=13C_NOESY, no=1064, id=1935, vol=9.824195e+05
    or (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   76 and name   HN)
assign (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   77 and name  HB2) 2.422 0.733 0.733 weight 1.000 ! spec=13C_NOESY, no=1065, id=1936, vol=4.238104e+06
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   77 and name  HB2)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   77 and name  HB2)
    or (segid "   A" and resid   77 and name  HB2) (segid "   A" and resid   77 and name HD12)
    or (segid "   A" and resid   77 and name  HB2) (segid "   A" and resid   77 and name HD11)
    or (segid "   A" and resid   77 and name  HB2) (segid "   A" and resid   77 and name HD13)
    or (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   77 and name HD21)
    or (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   77 and name HD23)
    or (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   77 and name HD22)
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   78 and name   HA) 2.927 1.071 1.071 weight 1.000 ! spec=13C_NOESY, no=1069, id=1940, vol=1.026982e+06
    or (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   78 and name   HA)
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   21 and name HG23) 2.758 0.951 0.951 weight 1.000 ! spec=13C_NOESY, no=1073, id=1944, vol=1.538183e+06
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   21 and name HG21)
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   21 and name HG22)
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   76 and name HD23)
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   76 and name HD21)
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   76 and name HD22)
assign (segid "   A" and resid   80 and name  HB1) (segid "   A" and resid   82 and name  HG1) 3.066 1.175 1.175 weight 1.000 ! spec=13C_NOESY, no=1087, id=1958, vol=8.179114e+05
    or (segid "   A" and resid   80 and name  HB1) (segid "   A" and resid   82 and name  HG2)
assign (segid "   A" and resid   83 and name  HG2) (segid "   A" and resid   84 and name HG21) 2.883 1.039 1.039 weight 1.000 ! spec=13C_NOESY, no=1114, id=1985, vol=1.200710e+06
    or (segid "   A" and resid   83 and name  HG2) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid   83 and name  HG2) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   83 and name  HG1) (segid "   A" and resid   84 and name HG21)
    or (segid "   A" and resid   83 and name  HG1) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid   83 and name  HG1) (segid "   A" and resid   84 and name HG22)
assign (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   77 and name  HB1) 2.582 0.834 0.834 weight 1.000 ! spec=13C_NOESY, no=1123, id=1994, vol=2.566196e+06
    or (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   85 and name  HB2)
    or (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   85 and name  HB3)
assign (segid "   A" and resid   84 and name HG21) (segid "   A" and resid  102 and name HD22) 3.089 1.193 1.193 weight 1.000 ! spec=13C_NOESY, no=1127, id=1998, vol=6.904438e+05
    or (segid "   A" and resid   84 and name HG23) (segid "   A" and resid  102 and name HD22)
    or (segid "   A" and resid   84 and name HG22) (segid "   A" and resid  102 and name HD22)
    or (segid "   A" and resid   84 and name HG21) (segid "   A" and resid  102 and name   HN)
    or (segid "   A" and resid   84 and name HG23) (segid "   A" and resid  102 and name   HN)
    or (segid "   A" and resid   84 and name HG22) (segid "   A" and resid  102 and name   HN)
assign (segid "   A" and resid   84 and name HG21) (segid "   A" and resid  102 and name   HA) 3.152 1.242 1.242 weight 1.000 ! spec=13C_NOESY, no=1131, id=2002, vol=6.431129e+05
    or (segid "   A" and resid   84 and name HG23) (segid "   A" and resid  102 and name   HA)
    or (segid "   A" and resid   84 and name HG22) (segid "   A" and resid  102 and name   HA)
    or (segid "   A" and resid   84 and name HG21) (segid "   A" and resid   79 and name   HA)
    or (segid "   A" and resid   84 and name HG23) (segid "   A" and resid   79 and name   HA)
    or (segid "   A" and resid   84 and name HG22) (segid "   A" and resid   79 and name   HA)
assign (segid "   A" and resid   89 and name  HA2) (segid "   A" and resid   36 and name HD11) 3.174 1.259 1.259 weight 1.000 ! spec=13C_NOESY, no=1172, id=2043, vol=6.904564e+05
    or (segid "   A" and resid   89 and name  HA2) (segid "   A" and resid   36 and name HD13)
    or (segid "   A" and resid   89 and name  HA2) (segid "   A" and resid   36 and name HD12)
    or (segid "   A" and resid   89 and name  HA2) (segid "   A" and resid   75 and name HD11)
    or (segid "   A" and resid   89 and name  HA2) (segid "   A" and resid   75 and name HD13)
    or (segid "   A" and resid   89 and name  HA2) (segid "   A" and resid   75 and name HD12)
assign (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   90 and name  HB1) 2.667 0.889 0.889 weight 1.000 ! spec=13C_NOESY, no=1179, id=2050, vol=1.822726e+06
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   90 and name  HB2)
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   90 and name  HB3)
    or (segid "   A" and resid   90 and name  HB1) (segid "   A" and resid   36 and name   HN)
    or (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   36 and name   HN)
    or (segid "   A" and resid   90 and name  HB3) (segid "   A" and resid   36 and name   HN)
assign (segid "   A" and resid   90 and name  HB1) (segid "   A" and resid   73 and name  HB1) 2.426 0.736 0.736 weight 1.000 ! spec=13C_NOESY, no=1183, id=2054, vol=3.369727e+06
    or (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   73 and name  HB1)
    or (segid "   A" and resid   90 and name  HB3) (segid "   A" and resid   73 and name  HB1)
    or (segid "   A" and resid   90 and name  HB1) (segid "   A" and resid   73 and name  HG2)
    or (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   73 and name  HG2)
    or (segid "   A" and resid   90 and name  HB3) (segid "   A" and resid   73 and name  HG2)
    or (segid "   A" and resid   90 and name  HB1) (segid "   A" and resid   73 and name  HG1)
    or (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   73 and name  HG1)
    or (segid "   A" and resid   90 and name  HB3) (segid "   A" and resid   73 and name  HG1)
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid   98 and name   HA) 2.581 0.833 0.833 weight 1.000 ! spec=13C_NOESY, no=1205, id=2076, vol=2.216925e+06
    or (segid "   A" and resid  102 and name HD22) (segid "   A" and resid   98 and name   HA)
assign (segid "   A" and resid    6 and name  HB1) (segid "   A" and resid    6 and name   HA) 2.599 0.844 0.844 weight 1.000 ! spec=13C_NOESY, no=1218, id=2089, vol=2.318891e+06
    or (segid "   A" and resid    6 and name  HB2) (segid "   A" and resid    6 and name   HA)
assign (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   19 and name   HA) 1.862 0.434 0.434 weight 1.000 ! spec=13C_NOESY, no=1230, id=2101, vol=1.533419e+07
    or (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   19 and name   HA)
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   17 and name  HB2) 2.888 1.042 1.042 weight 1.000 ! spec=13C_NOESY, no=1234, id=2105, vol=1.150955e+06
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HB2)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   17 and name  HG2) 2.565 0.822 0.822 weight 1.000 ! spec=13C_NOESY, no=1235, id=2106, vol=2.457396e+06
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   17 and name  HG1)
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   19 and name  HG2) 2.062 0.531 0.531 weight 1.000 ! spec=13C_NOESY, no=1237, id=2108, vol=8.788722e+06
    or (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   19 and name  HG2)
    or (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   19 and name  HG1)
    or (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   19 and name  HG1)
assign (segid "   A" and resid   19 and name  HD2) (segid "   A" and resid   17 and name  HG2) 3.199 1.279 1.279 weight 1.000 ! spec=13C_NOESY, no=1240, id=2111, vol=6.546869e+05
    or (segid "   A" and resid   19 and name  HD2) (segid "   A" and resid   17 and name  HG1)
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name  HB1) 1.919 0.460 0.460 weight 1.000 ! spec=13C_NOESY, no=1245, id=2116, vol=1.411606e+07
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name  HB2)
assign (segid "   A" and resid   66 and name  HG1) (segid "   A" and resid   11 and name  HB2) 2.573 0.828 0.828 weight 1.000 ! spec=13C_NOESY, no=1250, id=2121, vol=2.247217e+06
    or (segid "   A" and resid   66 and name  HG2) (segid "   A" and resid   11 and name  HB2)
assign (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   79 and name  HB2) 2.131 0.568 0.568 weight 1.000 ! spec=13C_NOESY, no=1270, id=2141, vol=7.617127e+06
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   79 and name  HB1)
assign (segid "   A" and resid   95 and name HG21) (segid "   A" and resid   95 and name   HN) 2.681 0.899 0.899 weight 1.000 ! spec=13C_NOESY, no=1305, id=2176, vol=1.648880e+06
    or (segid "   A" and resid   95 and name HG22) (segid "   A" and resid   95 and name   HN)
    or (segid "   A" and resid   95 and name HG23) (segid "   A" and resid   95 and name   HN)
    or (segid "   A" and resid   95 and name HG21) (segid "   A" and resid   99 and name   HN)
    or (segid "   A" and resid   95 and name HG22) (segid "   A" and resid   99 and name   HN)
    or (segid "   A" and resid   95 and name HG23) (segid "   A" and resid   99 and name   HN)
assign (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   38 and name  HB1) 2.489 0.774 0.774 weight 1.000 ! spec=13C_NOESY, no=1314, id=2185, vol=2.872669e+06
    or (segid "   A" and resid   38 and name  HD1) (segid "   A" and resid   38 and name  HB2)
    or (segid "   A" and resid   38 and name  HD1) (segid "   A" and resid   38 and name  HB1)
    or (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   38 and name  HB2)
assign (segid "   A" and resid   33 and name  HB2) (segid "   A" and resid   33 and name   HA) 2.294 0.658 0.658 weight 1.000 ! spec=13C_NOESY, no=1342, id=2213, vol=4.462192e+06
    or (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   33 and name  HB1)
assign (segid "   A" and resid   82 and name  HG1) (segid "   A" and resid   83 and name   HN) 3.348 1.401 1.401 weight 1.000 ! spec=13C_NOESY, no=1347, id=2218, vol=4.487454e+05
    or (segid "   A" and resid   82 and name  HG2) (segid "   A" and resid   83 and name   HN)
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   81 and name  HA2) 2.280 0.650 0.650 weight 1.000 ! spec=15N_Noesy, no=10, id=9, vol=1.579138e+06
    or (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   16 and name   HA)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name  HB2) 2.359 0.696 0.696 weight 1.000 ! spec=15N_Noesy, no=16, id=15, vol=2.069197e+06
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name  HB1)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   75 and name  HB1) 3.444 1.483 1.483 weight 1.000 ! spec=15N_Noesy, no=26, id=25, vol=1.728351e+05
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   75 and name  HB2)
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name  HB2) 2.915 1.062 1.062 weight 1.000 ! spec=15N_Noesy, no=29, id=28, vol=4.287596e+05
    or (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name  HB1)
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   45 and name  HB1) 3.310 1.370 1.370 weight 1.000 ! spec=15N_Noesy, no=40, id=39, vol=1.978229e+05
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   45 and name  HB2)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name   HA) 2.885 1.040 1.040 weight 1.000 ! spec=15N_Noesy, no=44, id=43, vol=3.483400e+05
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name   HA)
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   45 and name  HB1) 2.356 0.694 0.694 weight 1.000 ! spec=15N_Noesy, no=53, id=52, vol=2.379995e+06
    or (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   46 and name  HB2)
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name  HG2) 2.910 1.058 1.058 weight 1.000 ! spec=15N_Noesy, no=58, id=57, vol=2.486192e+05
    or (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name  HG1)
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   65 and name  HG2) 2.810 0.987 0.987 weight 1.000 ! spec=15N_Noesy, no=61, id=60, vol=1.144593e+05
    or (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   65 and name  HG1)
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   97 and name  HB1) 2.091 0.546 0.546 weight 1.000 ! spec=15N_Noesy, no=62, id=61, vol=2.846750e+06
    or (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   97 and name  HB2)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name  HB1) 2.382 0.709 0.709 weight 1.000 ! spec=15N_Noesy, no=65, id=64, vol=1.209192e+06
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name   HA)
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   45 and name  HB2) 2.284 0.652 0.652 weight 1.000 ! spec=15N_Noesy, no=71, id=70, vol=2.287376e+06
    or (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   45 and name  HB1)
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   59 and name  HB1) 2.365 0.699 0.699 weight 1.000 ! spec=15N_Noesy, no=80, id=79, vol=1.736288e+06
    or (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   59 and name  HB2)
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   67 and name  HB1) 3.300 1.361 1.361 weight 1.000 ! spec=15N_Noesy, no=83, id=82, vol=1.377987e+05
    or (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   26 and name  HB2)
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   82 and name  HB2) 2.190 0.600 0.600 weight 1.000 ! spec=15N_Noesy, no=85, id=84, vol=3.725390e+06
    or (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   83 and name  HB2)
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   55 and name  HB2) 2.533 0.802 0.802 weight 1.000 ! spec=15N_Noesy, no=90, id=89, vol=1.197551e+06
    or (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   55 and name  HB1)
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   60 and name  HB1) 3.072 1.180 1.180 weight 1.000 ! spec=15N_Noesy, no=96, id=95, vol=2.266812e+05
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   64 and name  HB1)
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   64 and name  HB3)
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   76 and name HD11) 2.754 0.948 0.948 weight 1.000 ! spec=15N_Noesy, no=109, id=108, vol=7.771978e+05
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   76 and name HD12)
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   76 and name HD13)
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   75 and name HD11)
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   75 and name HD13)
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   75 and name HD12)
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   76 and name HD23)
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   76 and name HD21)
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   76 and name HD22)
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   86 and name  HB1) 2.677 0.896 0.896 weight 1.000 ! spec=15N_Noesy, no=111, id=110, vol=8.339861e+05
    or (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   77 and name   HG)
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   58 and name  HB1) 3.111 1.210 1.210 weight 1.000 ! spec=15N_Noesy, no=120, id=119, vol=1.476194e+05
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   56 and name  HB2)
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   58 and name  HB2)
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   76 and name   HN) 3.148 1.239 1.239 weight 1.000 ! spec=15N_Noesy, no=125, id=124, vol=2.531480e+05
    or (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   87 and name   HN)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name   HA) 2.616 0.855 0.855 weight 1.000 ! spec=15N_Noesy, no=130, id=129, vol=7.396584e+05
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name   HA)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name HG11) 2.770 0.959 0.959 weight 1.000 ! spec=15N_Noesy, no=132, id=131, vol=7.225101e+05
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name HG12)
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   77 and name HD21) 2.680 0.898 0.898 weight 1.000 ! spec=15N_Noesy, no=149, id=148, vol=9.430624e+05
    or (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   77 and name HD23)
    or (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   77 and name HD22)
    or (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   99 and name HG23)
    or (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   99 and name HG21)
    or (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   99 and name HG22)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   77 and name   HG) 3.051 1.164 1.164 weight 1.000 ! spec=15N_Noesy, no=183, id=182, vol=2.568124e+05
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   75 and name  HB1)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   76 and name  HB1) 3.583 1.605 1.605 weight 1.000 ! spec=15N_Noesy, no=187, id=186, vol=3.444198e+04
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name   HB)
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    1 and name  HG2) 3.503 1.534 1.534 weight 1.000 ! spec=15N_Noesy, no=202, id=201, vol=5.967725e+04
    or (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    1 and name  HG1)
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid   10 and name  HB2) 3.257 1.326 1.326 weight 1.000 ! spec=15N_Noesy, no=237, id=236, vol=2.363993e+05
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid   10 and name  HB1)
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name  HG2) 2.476 0.766 0.766 weight 1.000 ! spec=15N_Noesy, no=238, id=237, vol=1.109606e+06
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name  HG1)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name  HG1) 2.705 0.915 0.915 weight 1.000 ! spec=15N_Noesy, no=245, id=244, vol=7.452779e+05
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name  HG2)
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name   HN) 3.455 1.492 1.492 weight 1.000 ! spec=15N_Noesy, no=253, id=252, vol=1.519794e+05
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   10 and name   HN)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   11 and name  HB2) 3.464 1.500 1.500 weight 1.000 ! spec=15N_Noesy, no=260, id=259, vol=1.896486e+05
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   11 and name  HB1)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   12 and name  HB2) 3.121 1.218 1.218 weight 1.000 ! spec=15N_Noesy, no=268, id=267, vol=2.273364e+05
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name  HG2)
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HB1) 2.201 0.606 0.606 weight 1.000 ! spec=15N_Noesy, no=281, id=280, vol=2.222020e+06
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HB2)
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   16 and name   HN) 3.200 1.280 1.280 weight 1.000 ! spec=15N_Noesy, no=284, id=283, vol=3.132511e+05
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   11 and name   HN)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   11 and name   HN) 3.060 1.170 1.170 weight 1.000 ! spec=15N_Noesy, no=292, id=291, vol=3.654700e+05
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   16 and name   HN)
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   13 and name   HA) 2.926 1.070 1.070 weight 1.000 ! spec=15N_Noesy, no=296, id=295, vol=3.065567e+05
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name   HA)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   13 and name   HA) 2.423 0.734 0.734 weight 1.000 ! spec=15N_Noesy, no=301, id=300, vol=1.076886e+06
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name   HA)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   17 and name   HN) 2.180 0.594 0.594 weight 1.000 ! spec=15N_Noesy, no=302, id=301, vol=1.871621e+06
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   16 and name   HN)
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   18 and name   HN) 3.106 1.206 1.206 weight 1.000 ! spec=15N_Noesy, no=304, id=303, vol=1.230429e+05
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   81 and name   HN)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   19 and name  HB2) 3.043 1.158 1.158 weight 1.000 ! spec=15N_Noesy, no=316, id=315, vol=2.769708e+05
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name  HB2)
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   17 and name  HG1) 3.327 1.384 1.384 weight 1.000 ! spec=15N_Noesy, no=329, id=328, vol=1.321601e+05
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   17 and name  HG2)
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   55 and name  HB1) 3.457 1.494 1.494 weight 1.000 ! spec=15N_Noesy, no=356, id=355, vol=1.721397e+05
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   50 and name  HB3)
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   50 and name  HB2)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name  HZ3) 3.359 1.410 1.410 weight 1.000 ! spec=15N_Noesy, no=386, id=385, vol=1.442927e+05
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name  HD1)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   33 and name   HA) 3.203 1.283 1.283 weight 1.000 ! spec=15N_Noesy, no=390, id=389, vol=2.324253e+05
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   34 and name   HA)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   35 and name   HA) 3.052 1.164 1.164 weight 1.000 ! spec=15N_Noesy, no=391, id=390, vol=3.272866e+05
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name   HA)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   36 and name   HA) 2.759 0.952 0.952 weight 1.000 ! spec=15N_Noesy, no=400, id=399, vol=4.390158e+05
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name   HA)
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   46 and name   HN) 2.760 0.952 0.952 weight 1.000 ! spec=15N_Noesy, no=425, id=424, vol=5.797092e+05
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   42 and name   HN)
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   47 and name   HN)
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   47 and name  HB2) 3.484 1.517 1.517 weight 1.000 ! spec=15N_Noesy, no=428, id=427, vol=1.075451e+05
    or (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   47 and name  HB1)
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   43 and name   HA) 2.918 1.064 1.064 weight 1.000 ! spec=15N_Noesy, no=432, id=431, vol=4.166028e+05
    or (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   44 and name  HB2)
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid    2 and name HG11) 3.409 1.453 1.453 weight 1.000 ! spec=15N_Noesy, no=444, id=443, vol=1.055160e+05
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid    2 and name HG13)
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid    2 and name HG12)
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   55 and name HD21)
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   55 and name HD23)
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   55 and name HD22)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name   HN) 2.486 0.773 0.773 weight 1.000 ! spec=15N_Noesy, no=449, id=448, vol=1.233466e+05
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   37 and name   HN)
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name  HB1) 2.737 0.937 0.937 weight 1.000 ! spec=15N_Noesy, no=471, id=470, vol=6.177943e+05
    or (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name  HB2)
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name  HB1) 2.765 0.956 0.956 weight 1.000 ! spec=15N_Noesy, no=484, id=483, vol=7.982836e+05
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   51 and name  HB1)
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   23 and name HG13) 3.364 1.414 1.414 weight 1.000 ! spec=15N_Noesy, no=486, id=485, vol=2.187889e+05
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   23 and name HG11)
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   23 and name HG12)
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   23 and name HG23)
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   23 and name HG21)
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   23 and name HG22)
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   55 and name  HB2) 2.965 1.099 1.099 weight 1.000 ! spec=15N_Noesy, no=515, id=514, vol=4.425108e+05
    or (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   55 and name  HB1)
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   82 and name  HG2) 2.820 0.994 0.994 weight 1.000 ! spec=15N_Noesy, no=528, id=527, vol=5.710984e+05
    or (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   82 and name  HG1)
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   58 and name  HB2) 3.518 1.547 1.547 weight 1.000 ! spec=15N_Noesy, no=533, id=532, vol=7.666685e+04
    or (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   56 and name  HB2)
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   59 and name  HB2) 2.497 0.780 0.780 weight 1.000 ! spec=15N_Noesy, no=534, id=533, vol=1.007480e+06
    or (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   59 and name  HB1)
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   66 and name  HG1) 2.495 0.778 0.778 weight 1.000 ! spec=15N_Noesy, no=577, id=576, vol=1.243679e+06
    or (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   66 and name  HG2)
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   64 and name  HB1) 3.034 1.150 1.150 weight 1.000 ! spec=15N_Noesy, no=580, id=579, vol=2.703078e+05
    or (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   64 and name  HB3)
    or (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   66 and name  HG2)
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   66 and name  HB2) 2.801 0.981 0.981 weight 1.000 ! spec=15N_Noesy, no=582, id=581, vol=6.305612e+05
    or (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   66 and name  HB1)
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   69 and name   HB) 3.185 1.268 1.268 weight 1.000 ! spec=15N_Noesy, no=595, id=594, vol=1.692609e+05
    or (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   64 and name  HB1)
    or (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   64 and name  HB3)
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   68 and name  HB2) 2.850 1.015 1.015 weight 1.000 ! spec=15N_Noesy, no=598, id=597, vol=4.475113e+05
    or (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   67 and name  HB2)
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   67 and name  HB1) 3.442 1.481 1.481 weight 1.000 ! spec=15N_Noesy, no=599, id=598, vol=3.079584e+04
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name  HB2)
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   79 and name  HB2) 3.728 1.738 1.738 weight 1.000 ! spec=15N_Noesy, no=669, id=668, vol=7.218108e+04
    or (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   79 and name  HB1)
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   57 and name   HA) 3.005 1.129 1.129 weight 1.000 ! spec=15N_Noesy, no=676, id=675, vol=2.099674e+05
    or (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   81 and name  HA1)
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   83 and name  HG1) 2.709 0.917 0.917 weight 1.000 ! spec=15N_Noesy, no=690, id=689, vol=7.941764e+05
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   83 and name  HG2)
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   85 and name  HB2) 3.153 1.243 1.243 weight 1.000 ! spec=15N_Noesy, no=691, id=690, vol=3.259664e+05
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   85 and name  HB3)
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   77 and name  HB2)
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   77 and name  HB1)
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   76 and name HD23) 2.687 0.903 0.903 weight 1.000 ! spec=15N_Noesy, no=692, id=691, vol=4.750762e+05
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   76 and name HD21)
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   76 and name HD22)
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   84 and name HG13)
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   84 and name HG11)
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   84 and name HG12)
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   85 and name  HB2) 2.356 0.694 0.694 weight 1.000 ! spec=15N_Noesy, no=697, id=696, vol=1.634597e+06
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   85 and name  HB3)
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   77 and name  HB2)
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   84 and name   HA) 2.395 0.717 0.717 weight 1.000 ! spec=15N_Noesy, no=701, id=700, vol=9.924795e+05
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   85 and name   HA)
assign (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   88 and name   HA) 2.106 0.554 0.554 weight 1.000 ! spec=15N_Noesy, no=731, id=730, vol=2.597177e+06
    or (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   89 and name  HA2)
assign (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   91 and name  HB2) 2.651 0.879 0.879 weight 1.000 ! spec=15N_Noesy, no=742, id=741, vol=6.905507e+05
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   91 and name  HB1)
assign (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   36 and name HD11) 2.616 0.855 0.855 weight 1.000 ! spec=15N_Noesy, no=745, id=744, vol=9.871844e+05
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   36 and name HD13)
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   36 and name HD12)
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   75 and name HD11)
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   75 and name HD13)
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   75 and name HD12)
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   75 and name HD22)
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   75 and name HD21)
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   75 and name HD23)
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   98 and name   HA) 2.453 0.752 0.752 weight 1.000 ! spec=15N_Noesy, no=765, id=764, vol=1.363558e+06
    or (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   42 and name   HA)
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   97 and name  HB2) 2.393 0.716 0.716 weight 1.000 ! spec=15N_Noesy, no=768, id=767, vol=1.361286e+06
    or (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   97 and name  HB1)
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   99 and name HG23) 3.114 1.212 1.212 weight 1.000 ! spec=15N_Noesy, no=775, id=774, vol=2.857775e+05
    or (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   99 and name HG21)
    or (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   99 and name HG22)
    or (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   99 and name HG11)
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid  102 and name   HN) 3.231 1.305 1.305 weight 1.000 ! spec=15N_Noesy, no=778, id=777, vol=1.639613e+05
    or (segid "   A" and resid  100 and name   HN) (segid "   A" and resid  102 and name HD22)
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  102 and name  HB2) 3.203 1.283 1.283 weight 1.000 ! spec=15N_Noesy, no=811, id=810, vol=1.963281e+05
    or (segid "   A" and resid  102 and name HD22) (segid "   A" and resid  102 and name  HB2)
assign (segid "   A" and resid   17 and name HE22) (segid "   A" and resid   19 and name  HG1) 2.822 0.996 0.996 weight 1.000 ! spec=15N_Noesy, no=832, id=831, vol=3.481985e+05
    or (segid "   A" and resid   17 and name HE22) (segid "   A" and resid   19 and name  HG2)
assign (segid "   A" and resid   17 and name HE22) (segid "   A" and resid   51 and name  HB2) 2.391 0.714 0.714 weight 1.000 ! spec=15N_Noesy, no=834, id=833, vol=9.724871e+05
    or (segid "   A" and resid   91 and name HD22) (segid "   A" and resid   91 and name  HB2)
assign (segid "   A" and resid   17 and name HE22) (segid "   A" and resid   17 and name HE21) 1.856 0.431 0.431 weight 1.000 ! spec=15N_Noesy, no=836, id=835, vol=5.662111e+06
    or (segid "   A" and resid   91 and name HD22) (segid "   A" and resid   91 and name HD21)
assign (segid "   A" and resid   91 and name HD21) (segid "   A" and resid   91 and name  HB2) 2.698 0.910 0.910 weight 1.000 ! spec=15N_Noesy, no=839, id=838, vol=3.698185e+05
    or (segid "   A" and resid   17 and name HE21) (segid "   A" and resid   51 and name  HB2)
assign (segid "   A" and resid   17 and name HE21) (segid "   A" and resid   19 and name  HG1) 3.102 1.203 1.203 weight 1.000 ! spec=15N_Noesy, no=841, id=840, vol=2.058595e+05
    or (segid "   A" and resid   17 and name HE21) (segid "   A" and resid   19 and name  HG2)
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HB2) 2.643 0.873 0.873 weight 1.000 ! spec=15N_Noesy, no=859, id=858, vol=1.220273e+06
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HB1)
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   64 and name  HB1) 2.957 1.093 1.093 weight 1.000 ! spec=15N_Noesy, no=860, id=859, vol=5.734494e+05
    or (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   64 and name  HB3)
    or (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   69 and name   HB)
assign (segid "   A" and resid   91 and name HD22) (segid "   A" and resid   91 and name  HB1) 3.167 1.254 1.254 weight 1.000 ! spec=15N_Noesy, no=862, id=861, vol=3.987040e+05
    or (segid "   A" and resid   91 and name HD22) (segid "   A" and resid   91 and name  HB2)
assign (segid "   A" and resid   67 and name HD21) (segid "   A" and resid   64 and name  HB1) 3.508 1.538 1.538 weight 1.000 ! spec=15N_Noesy, no=868, id=867, vol=1.237304e+05
    or (segid "   A" and resid   67 and name HD21) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   67 and name HD21) (segid "   A" and resid   64 and name  HB3)
    or (segid "   A" and resid   67 and name HD21) (segid "   A" and resid   66 and name  HG1)
assign (segid "   A" and resid    5 and name   HZ) (segid "   A" and resid    5 and name  HE1) 2.263 0.640 0.640 weight 1.000 ! spec=13C_...roma, no=2, id=2225, vol=7.588554e+05
    or (segid "   A" and resid    5 and name   HZ) (segid "   A" and resid    5 and name  HE2)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    5 and name  HE1) 2.197 0.604 0.604 weight 1.000 ! spec=13C_...roma, no=3, id=2226, vol=8.192610e+05
    or (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    5 and name  HE2)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    5 and name  HE1)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    5 and name  HE2)
assign (segid "   A" and resid    5 and name  HB1) (segid "   A" and resid    5 and name  HD1) 2.478 0.768 0.768 weight 1.000 ! spec=13C_...roma, no=5, id=2228, vol=3.838409e+05
    or (segid "   A" and resid    5 and name  HB1) (segid "   A" and resid    5 and name  HD2)
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid    5 and name  HD1) 2.387 0.712 0.712 weight 1.000 ! spec=13C_...roma, no=6, id=2229, vol=5.570974e+05
    or (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid    5 and name  HD2)
assign (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid    5 and name  HD1) 2.376 0.705 0.705 weight 1.000 ! spec=13C_...roma, no=8, id=2231, vol=5.601169e+05
    or (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid    5 and name  HD2)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   55 and name HD12) 2.368 0.701 0.701 weight 1.000 ! spec=13C_...roma, no=9, id=2232, vol=5.465369e+05
    or (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   55 and name HD11)
    or (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   55 and name HD13)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   55 and name HD12)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   55 and name HD11)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   55 and name HD13)
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid    5 and name  HE1) 2.615 0.855 0.855 weight 1.000 ! spec=13C_...roma, no=17, id=2235, vol=3.308148e+05
    or (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid    5 and name  HE2)
assign (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid   11 and name  HB2) 2.277 0.648 0.648 weight 1.000 ! spec=13C_...roma, no=20, id=2238, vol=7.115660e+05
    or (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid   11 and name  HB2)
assign (segid "   A" and resid   11 and name  HD2) (segid "   A" and resid   15 and name HG11) 2.444 0.747 0.747 weight 1.000 ! spec=13C_...roma, no=25, id=2241, vol=4.069237e+05
    or (segid "   A" and resid   11 and name  HD1) (segid "   A" and resid   15 and name HG11)
assign (segid "   A" and resid   11 and name  HE2) (segid "   A" and resid   15 and name HG11) 2.564 0.822 0.822 weight 1.000 ! spec=13C_...roma, no=27, id=2243, vol=2.819242e+05
    or (segid "   A" and resid   11 and name  HE1) (segid "   A" and resid   15 and name HG11)
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   26 and name  HD2) 2.465 0.760 0.760 weight 1.000 ! spec=13C_...roma, no=30, id=2246, vol=4.546988e+05
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   26 and name  HD1)
assign (segid "   A" and resid   26 and name  HE2) (segid "   A" and resid   24 and name  HB1) 2.176 0.592 0.592 weight 1.000 ! spec=13C_...roma, no=31, id=2247, vol=1.036406e+06
    or (segid "   A" and resid   26 and name  HE2) (segid "   A" and resid   24 and name  HB3)
    or (segid "   A" and resid   26 and name  HE2) (segid "   A" and resid   24 and name  HB2)
    or (segid "   A" and resid   26 and name  HE1) (segid "   A" and resid   24 and name  HB1)
    or (segid "   A" and resid   26 and name  HE1) (segid "   A" and resid   24 and name  HB3)
    or (segid "   A" and resid   26 and name  HE1) (segid "   A" and resid   24 and name  HB2)
assign (segid "   A" and resid   26 and name  HD2) (segid "   A" and resid   26 and name  HE2) 2.024 0.512 0.512 weight 1.000 ! spec=13C_...roma, no=33, id=2249, vol=1.322198e+06
    or (segid "   A" and resid   26 and name  HD2) (segid "   A" and resid   26 and name  HE1)
    or (segid "   A" and resid   26 and name  HD1) (segid "   A" and resid   26 and name  HE2)
    or (segid "   A" and resid   26 and name  HD1) (segid "   A" and resid   26 and name  HE1)
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name  HD1) 2.367 0.700 0.700 weight 1.000 ! spec=13C_...roma, no=35, id=2250, vol=4.707824e+05
assign (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   58 and name   HA) 2.641 0.872 0.872 weight 1.000 ! spec=13C_...roma, no=36, id=2251, vol=2.918773e+05
assign (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   29 and name  HD1) 2.526 0.798 0.798 weight 1.000 ! spec=13C_...roma, no=37, id=2252, vol=3.103688e+05
assign (segid "   A" and resid   29 and name  HH2) (segid "   A" and resid   29 and name  HZ3) 2.271 0.645 0.645 weight 1.000 ! spec=13C_...roma, no=38, id=2253, vol=9.200628e+05
assign (segid "   A" and resid   29 and name  HZ2) (segid "   A" and resid   29 and name  HH2) 2.168 0.587 0.587 weight 1.000 ! spec=13C_...roma, no=40, id=2255, vol=1.663941e+06
assign (segid "   A" and resid   29 and name  HZ3) (segid "   A" and resid   29 and name  HE3) 2.348 0.689 0.689 weight 1.000 ! spec=13C_...roma, no=42, id=2256, vol=1.169228e+06
assign (segid "   A" and resid   43 and name  HD1) (segid "   A" and resid   43 and name  HB1) 2.773 0.961 0.961 weight 1.000 ! spec=13C_...roma, no=44, id=2258, vol=2.368366e+05
    or (segid "   A" and resid   43 and name  HD2) (segid "   A" and resid   43 and name  HB1)
assign (segid "   A" and resid   43 and name  HD1) (segid "   A" and resid   75 and name HD22) 2.809 0.986 0.986 weight 1.000 ! spec=13C_...roma, no=45, id=2259, vol=2.392802e+05
    or (segid "   A" and resid   43 and name  HD1) (segid "   A" and resid   75 and name HD21)
    or (segid "   A" and resid   43 and name  HD1) (segid "   A" and resid   75 and name HD23)
    or (segid "   A" and resid   43 and name  HD2) (segid "   A" and resid   75 and name HD22)
    or (segid "   A" and resid   43 and name  HD2) (segid "   A" and resid   75 and name HD21)
    or (segid "   A" and resid   43 and name  HD2) (segid "   A" and resid   75 and name HD23)
assign (segid "   A" and resid   47 and name   HA) (segid "   A" and resid   47 and name  HD1) 2.722 0.926 0.926 weight 1.000 ! spec=13C_...roma, no=47, id=2261, vol=2.106968e+05
    or (segid "   A" and resid   47 and name   HA) (segid "   A" and resid   47 and name  HD2)
assign (segid "   A" and resid   47 and name  HD1) (segid "   A" and resid   50 and name  HB3) 2.624 0.860 0.860 weight 1.000 ! spec=13C_...roma, no=50, id=2264, vol=2.521779e+05
    or (segid "   A" and resid   47 and name  HD1) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   47 and name  HD1) (segid "   A" and resid   50 and name  HB2)
    or (segid "   A" and resid   47 and name  HD2) (segid "   A" and resid   50 and name  HB3)
    or (segid "   A" and resid   47 and name  HD2) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   47 and name  HD2) (segid "   A" and resid   50 and name  HB2)
assign (segid "   A" and resid   47 and name  HD1) (segid "   A" and resid   47 and name  HE1) 1.964 0.482 0.482 weight 1.000 ! spec=13C_...roma, no=52, id=2266, vol=1.621327e+06
    or (segid "   A" and resid   47 and name  HD1) (segid "   A" and resid   47 and name  HE2)
    or (segid "   A" and resid   47 and name  HD2) (segid "   A" and resid   47 and name  HE1)
    or (segid "   A" and resid   47 and name  HD2) (segid "   A" and resid   47 and name  HE2)
assign (segid "   A" and resid   47 and name  HE1) (segid "   A" and resid   96 and name  HB1) 2.739 0.938 0.938 weight 1.000 ! spec=13C_...roma, no=56, id=2270, vol=1.953079e+05
    or (segid "   A" and resid   47 and name  HE2) (segid "   A" and resid   96 and name  HB1)
assign (segid "   A" and resid   47 and name  HE1) (segid "   A" and resid   50 and name  HB3) 2.481 0.770 0.770 weight 1.000 ! spec=13C_...roma, no=57, id=2271, vol=4.005746e+05
    or (segid "   A" and resid   47 and name  HE1) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   47 and name  HE1) (segid "   A" and resid   50 and name  HB2)
    or (segid "   A" and resid   47 and name  HE2) (segid "   A" and resid   50 and name  HB3)
    or (segid "   A" and resid   47 and name  HE2) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   47 and name  HE2) (segid "   A" and resid   50 and name  HB2)
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   53 and name  HD2) 2.217 0.615 0.615 weight 1.000 ! spec=13C_...roma, no=59, id=2273, vol=8.479476e+05
    or (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   53 and name  HD1)
assign (segid "   A" and resid   53 and name  HD2) (segid "   A" and resid   14 and name  HB2) 2.321 0.673 0.673 weight 1.000 ! spec=13C_...roma, no=60, id=2274, vol=6.014583e+05
    or (segid "   A" and resid   53 and name  HD2) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   53 and name  HD2) (segid "   A" and resid   14 and name  HB3)
    or (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   14 and name  HB2)
    or (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   14 and name  HB3)
assign (segid "   A" and resid   53 and name  HD2) (segid "   A" and resid   21 and name HG11) 2.407 0.724 0.724 weight 1.000 ! spec=13C_...roma, no=61, id=2275, vol=4.868283e+05
    or (segid "   A" and resid   53 and name  HD2) (segid "   A" and resid   21 and name HG12)
    or (segid "   A" and resid   53 and name  HD2) (segid "   A" and resid   21 and name HG13)
    or (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   21 and name HG11)
    or (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   21 and name HG12)
    or (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   21 and name HG13)
assign (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   53 and name  HE2) 2.295 0.658 0.658 weight 1.000 ! spec=13C_...roma, no=65, id=2279, vol=6.952156e+05
    or (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   53 and name  HE1)
assign (segid "   A" and resid   53 and name  HE2) (segid "   A" and resid   21 and name HG11) 2.359 0.696 0.696 weight 1.000 ! spec=13C_...roma, no=66, id=2280, vol=5.093190e+05
    or (segid "   A" and resid   53 and name  HE2) (segid "   A" and resid   21 and name HG12)
    or (segid "   A" and resid   53 and name  HE2) (segid "   A" and resid   21 and name HG13)
    or (segid "   A" and resid   53 and name  HE1) (segid "   A" and resid   21 and name HG11)
    or (segid "   A" and resid   53 and name  HE1) (segid "   A" and resid   21 and name HG12)
    or (segid "   A" and resid   53 and name  HE1) (segid "   A" and resid   21 and name HG13)
assign (segid "   A" and resid   53 and name  HE2) (segid "   A" and resid   14 and name  HB2) 2.200 0.605 0.605 weight 1.000 ! spec=13C_...roma, no=67, id=2281, vol=7.752830e+05
    or (segid "   A" and resid   53 and name  HE2) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   53 and name  HE2) (segid "   A" and resid   14 and name  HB3)
    or (segid "   A" and resid   53 and name  HE1) (segid "   A" and resid   14 and name  HB2)
    or (segid "   A" and resid   53 and name  HE1) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   53 and name  HE1) (segid "   A" and resid   14 and name  HB3)
assign (segid "   A" and resid   54 and name  HB1) (segid "   A" and resid   26 and name  HE2) 2.552 0.814 0.814 weight 1.000 ! spec=13C_...roma, no=82, id=2282, vol=3.422562e+05
    or (segid "   A" and resid   54 and name  HB1) (segid "   A" and resid   26 and name  HE1)
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    8 and name   HA) 1.705 0.363 0.363 weight 1.000 ! spec=13C_NOESY, no=6, id=877, vol=2.811256e+07
    or (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    8 and name   HA)
    or (segid "   A" and resid    8 and name  HB3) (segid "   A" and resid    8 and name   HA)
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name  HB2) 1.906 0.454 0.454 weight 1.000 ! spec=13C_NOESY, no=8, id=879, vol=1.495346e+07
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name  HB3)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name   HA) 2.131 0.568 0.568 weight 1.000 ! spec=13C_NOESY, no=9, id=880, vol=7.658953e+06
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name  HB3) 1.885 0.444 0.444 weight 1.000 ! spec=13C_NOESY, no=11, id=882, vol=1.453942e+07
    or (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name  HB1)
    or (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name  HB2)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name   HA) 2.339 0.684 0.684 weight 1.000 ! spec=13C_NOESY, no=15, id=886, vol=3.919016e+06
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name   HA) 2.401 0.720 0.720 weight 1.000 ! spec=13C_NOESY, no=16, id=887, vol=3.382836e+06
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   16 and name   HA) 2.317 0.671 0.671 weight 1.000 ! spec=13C_NOESY, no=17, id=888, vol=4.090465e+06
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name  HB1) 2.132 0.568 0.568 weight 1.000 ! spec=13C_NOESY, no=18, id=889, vol=7.611539e+06
    or (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name  HB3)
    or (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name  HB2)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name   HA) 2.022 0.511 0.511 weight 1.000 ! spec=13C_NOESY, no=19, id=890, vol=9.936113e+06
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name   HA) 2.689 0.904 0.904 weight 1.000 ! spec=13C_NOESY, no=20, id=891, vol=1.934023e+06
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name   HN) 2.351 0.691 0.691 weight 1.000 ! spec=13C_NOESY, no=24, id=895, vol=4.026013e+06
    or (segid "   A" and resid   24 and name  HB3) (segid "   A" and resid   24 and name   HN)
    or (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name   HN)
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name  HB3) 2.216 0.614 0.614 weight 1.000 ! spec=13C_NOESY, no=25, id=896, vol=5.965821e+06
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   57 and name HG13) 2.569 0.825 0.825 weight 1.000 ! spec=13C_NOESY, no=26, id=897, vol=2.376722e+06
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   57 and name HG11)
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   57 and name HG12)
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   28 and name   HN) 2.263 0.640 0.640 weight 1.000 ! spec=13C_NOESY, no=27, id=898, vol=5.206885e+06
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HB3) 2.608 0.850 0.850 weight 1.000 ! spec=13C_NOESY, no=29, id=900, vol=1.323620e+06
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   27 and name  HB3) (segid "   A" and resid   30 and name  HB1) 2.577 0.830 0.830 weight 1.000 ! spec=13C_NOESY, no=32, id=903, vol=1.471804e+06
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   30 and name  HB1)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   30 and name  HB1)
assign (segid "   A" and resid   27 and name  HB3) (segid "   A" and resid   30 and name  HB2) 2.661 0.885 0.885 weight 1.000 ! spec=13C_NOESY, no=33, id=904, vol=1.251636e+06
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   30 and name  HB2)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   30 and name  HB2)
assign (segid "   A" and resid   27 and name  HB3) (segid "   A" and resid   57 and name HG13) 2.326 0.676 0.676 weight 1.000 ! spec=13C_NOESY, no=34, id=905, vol=2.601568e+06
    or (segid "   A" and resid   27 and name  HB3) (segid "   A" and resid   57 and name HG11)
    or (segid "   A" and resid   27 and name  HB3) (segid "   A" and resid   57 and name HG12)
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   57 and name HG13)
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   57 and name HG11)
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   57 and name HG12)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   57 and name HG13)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   57 and name HG11)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   57 and name HG12)
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name  HB1) 2.006 0.503 0.503 weight 1.000 ! spec=13C_NOESY, no=36, id=907, vol=1.006750e+07
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name  HB3)
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name  HB2)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name  HB1) 2.247 0.631 0.631 weight 1.000 ! spec=13C_NOESY, no=37, id=908, vol=5.340542e+06
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name  HB3)
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name  HB2)
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   50 and name  HB3) 1.911 0.456 0.456 weight 1.000 ! spec=13C_NOESY, no=42, id=913, vol=1.411039e+07
    or (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   50 and name  HB2)
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   64 and name  HB1) 1.941 0.471 0.471 weight 1.000 ! spec=13C_NOESY, no=43, id=914, vol=1.332364e+07
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   64 and name  HB3)
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   69 and name HG11) 2.413 0.728 0.728 weight 1.000 ! spec=13C_NOESY, no=44, id=915, vol=3.539542e+06
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   64 and name   HA) 2.253 0.634 0.634 weight 1.000 ! spec=13C_NOESY, no=46, id=917, vol=5.019548e+06
assign (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name  HB1) 2.032 0.516 0.516 weight 1.000 ! spec=13C_NOESY, no=49, id=920, vol=9.714041e+06
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name  HB2)
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name  HB3)
assign (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   75 and name HD11) 2.294 0.658 0.658 weight 1.000 ! spec=13C_NOESY, no=50, id=921, vol=4.889535e+06
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   75 and name HD13)
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   75 and name HD12)
assign (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   93 and name  HB1) 1.816 0.412 0.412 weight 1.000 ! spec=13C_NOESY, no=52, id=923, vol=2.029452e+07
    or (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   93 and name  HB3)
    or (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   93 and name  HB2)
assign (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   96 and name  HB2) 2.181 0.595 0.595 weight 1.000 ! spec=13C_NOESY, no=53, id=924, vol=6.369561e+06
assign (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   91 and name  HB1) 2.334 0.681 0.681 weight 1.000 ! spec=13C_NOESY, no=56, id=927, vol=3.941715e+06
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   91 and name  HB1)
    or (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   91 and name  HB1)
assign (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   91 and name  HB2) 2.546 0.810 0.810 weight 1.000 ! spec=13C_NOESY, no=57, id=928, vol=2.372500e+06
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   91 and name  HB2)
    or (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   91 and name  HB2)
assign (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   94 and name   HA) 2.266 0.642 0.642 weight 1.000 ! spec=13C_NOESY, no=59, id=930, vol=5.169953e+06
assign (segid "   A" and resid  101 and name   HN) (segid "   A" and resid  101 and name   HA) 2.234 0.624 0.624 weight 1.000 ! spec=13C_NOESY, no=60, id=931, vol=6.195377e+06
assign (segid "   A" and resid   98 and name   HA) (segid "   A" and resid   98 and name  HB3) 1.666 0.347 0.347 weight 1.000 ! spec=13C_NOESY, no=61, id=932, vol=3.138846e+07
    or (segid "   A" and resid   98 and name   HA) (segid "   A" and resid   98 and name  HB1)
    or (segid "   A" and resid   98 and name   HA) (segid "   A" and resid   98 and name  HB2)
assign (segid "   A" and resid   98 and name  HB3) (segid "   A" and resid   99 and name   HN) 2.324 0.675 0.675 weight 1.000 ! spec=13C_NOESY, no=64, id=935, vol=4.219665e+06
    or (segid "   A" and resid   98 and name  HB1) (segid "   A" and resid   99 and name   HN)
    or (segid "   A" and resid   98 and name  HB2) (segid "   A" and resid   99 and name   HN)
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   98 and name  HB3) 2.020 0.510 0.510 weight 1.000 ! spec=13C_NOESY, no=65, id=936, vol=9.546475e+06
    or (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   98 and name  HB1)
    or (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   98 and name  HB2)
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid   63 and name HG11) 2.047 0.524 0.524 weight 1.000 ! spec=13C_NOESY, no=68, id=939, vol=9.203674e+06
    or (segid "   A" and resid    8 and name   HA) (segid "   A" and resid   63 and name HG13)
    or (segid "   A" and resid    8 and name   HA) (segid "   A" and resid   63 and name HG12)
assign (segid "   A" and resid  101 and name  HB1) (segid "   A" and resid  102 and name   HN) 2.256 0.636 0.636 weight 1.000 ! spec=13C_NOESY, no=71, id=942, vol=5.043281e+06
    or (segid "   A" and resid  101 and name  HB3) (segid "   A" and resid  102 and name   HN)
    or (segid "   A" and resid  101 and name  HB2) (segid "   A" and resid  102 and name   HN)
assign (segid "   A" and resid   89 and name  HA1) (segid "   A" and resid   89 and name  HA2) 2.024 0.512 0.512 weight 1.000 ! spec=13C_NOESY, no=74, id=945, vol=1.030477e+07
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name  HB1) 2.493 0.777 0.777 weight 1.000 ! spec=13C_NOESY, no=75, id=946, vol=2.762895e+06
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name  HB2) 2.843 1.010 1.010 weight 1.000 ! spec=13C_NOESY, no=76, id=947, vol=1.415162e+06
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid    5 and name  HB1) 2.058 0.529 0.529 weight 1.000 ! spec=13C_NOESY, no=80, id=951, vol=9.524268e+06
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid   55 and name HD12) 2.756 0.950 0.950 weight 1.000 ! spec=13C_NOESY, no=82, id=953, vol=1.638781e+06
    or (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid   55 and name HD11)
    or (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid   55 and name HD13)
assign (segid "   A" and resid    5 and name  HB1) (segid "   A" and resid   55 and name HD12) 2.606 0.849 0.849 weight 1.000 ! spec=13C_NOESY, no=83, id=954, vol=2.200361e+06
    or (segid "   A" and resid    5 and name  HB1) (segid "   A" and resid   55 and name HD11)
    or (segid "   A" and resid    5 and name  HB1) (segid "   A" and resid   55 and name HD13)
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   11 and name   HN) 2.181 0.594 0.594 weight 1.000 ! spec=13C_NOESY, no=87, id=958, vol=6.384600e+06
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name   HN) 2.594 0.841 0.841 weight 1.000 ! spec=13C_NOESY, no=88, id=959, vol=2.103660e+06
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid    5 and name   HZ) 2.662 0.886 0.886 weight 1.000 ! spec=13C_NOESY, no=89, id=960, vol=1.811090e+06
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   25 and name  HB1) 2.558 0.818 0.818 weight 1.000 ! spec=13C_NOESY, no=90, id=961, vol=2.317112e+06
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   25 and name  HB2) 2.841 1.009 1.009 weight 1.000 ! spec=13C_NOESY, no=91, id=962, vol=1.201874e+06
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   25 and name  HB2) 2.185 0.597 0.597 weight 1.000 ! spec=13C_NOESY, no=95, id=966, vol=6.330242e+06
assign (segid "   A" and resid   43 and name  HB2) (segid "   A" and resid   43 and name  HD1) 2.753 0.948 0.948 weight 1.000 ! spec=13C_NOESY, no=105, id=976, vol=1.644766e+06
    or (segid "   A" and resid   43 and name  HB2) (segid "   A" and resid   43 and name  HD2)
assign (segid "   A" and resid   43 and name  HB1) (segid "   A" and resid   43 and name   HN) 2.986 1.114 1.114 weight 1.000 ! spec=13C_NOESY, no=106, id=977, vol=9.810492e+05
assign (segid "   A" and resid   43 and name  HB2) (segid "   A" and resid   43 and name   HN) 2.885 1.040 1.040 weight 1.000 ! spec=13C_NOESY, no=107, id=978, vol=1.140415e+06
assign (segid "   A" and resid   52 and name   HA) (segid "   A" and resid   52 and name  HB1) 2.501 0.782 0.782 weight 1.000 ! spec=13C_NOESY, no=109, id=980, vol=2.784185e+06
assign (segid "   A" and resid   52 and name   HA) (segid "   A" and resid   52 and name  HB2) 2.749 0.945 0.945 weight 1.000 ! spec=13C_NOESY, no=110, id=981, vol=1.511142e+06
assign (segid "   A" and resid   78 and name  HB1) (segid "   A" and resid   79 and name   HN) 2.882 1.038 1.038 weight 1.000 ! spec=13C_NOESY, no=116, id=987, vol=1.216554e+06
assign (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   44 and name  HB2) 2.294 0.658 0.658 weight 1.000 ! spec=13C_NOESY, no=122, id=993, vol=2.941314e+06
assign (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   48 and name   HA) 3.183 1.267 1.267 weight 1.000 ! spec=13C_NOESY, no=125, id=996, vol=3.681969e+05
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   47 and name  HD1) 3.109 1.208 1.208 weight 1.000 ! spec=13C_NOESY, no=126, id=997, vol=4.996321e+05
    or (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   47 and name  HD2)
assign (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   44 and name   HN) 2.931 1.074 1.074 weight 1.000 ! spec=13C_NOESY, no=128, id=999, vol=7.288929e+05
assign (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   70 and name   HA) 2.438 0.743 0.743 weight 1.000 ! spec=13C_NOESY, no=131, id=1002, vol=3.087087e+06
assign (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   28 and name HG21) 2.197 0.604 0.604 weight 1.000 ! spec=13C_NOESY, no=136, id=1007, vol=6.075666e+06
    or (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   28 and name HG22)
    or (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   28 and name HG23)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name   HA) 2.551 0.813 0.813 weight 1.000 ! spec=13C_NOESY, no=137, id=1008, vol=2.279953e+06
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name  HB1) 2.215 0.613 0.613 weight 1.000 ! spec=13C_NOESY, no=138, id=1009, vol=5.944566e+06
assign (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   26 and name   HN) 3.205 1.284 1.284 weight 1.000 ! spec=13C_NOESY, no=141, id=1012, vol=7.247082e+05
assign (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid    8 and name   HA) 2.945 1.084 1.084 weight 1.000 ! spec=13C_NOESY, no=144, id=1015, vol=1.074754e+06
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   11 and name  HD2) 2.440 0.744 0.744 weight 1.000 ! spec=13C_NOESY, no=148, id=1019, vol=3.478658e+06
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   11 and name  HD1)
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name   HA) 2.235 0.624 0.624 weight 1.000 ! spec=13C_NOESY, no=149, id=1020, vol=6.079215e+06
assign (segid "   A" and resid   12 and name  HB2) (segid "   A" and resid    9 and name   HA) 2.870 1.029 1.029 weight 1.000 ! spec=13C_NOESY, no=151, id=1022, vol=1.205591e+06
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name  HB2) 2.534 0.802 0.802 weight 1.000 ! spec=13C_NOESY, no=153, id=1024, vol=2.728219e+06
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   62 and name   HA) 2.303 0.663 0.663 weight 1.000 ! spec=13C_NOESY, no=158, id=1029, vol=4.410601e+06
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   62 and name   HN) 3.020 1.140 1.140 weight 1.000 ! spec=13C_NOESY, no=160, id=1031, vol=8.236890e+05
assign (segid "   A" and resid   51 and name  HB1) (segid "   A" and resid   51 and name   HA) 2.664 0.887 0.887 weight 1.000 ! spec=13C_NOESY, no=162, id=1033, vol=1.893298e+06
assign (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   51 and name   HA) 2.610 0.851 0.851 weight 1.000 ! spec=13C_NOESY, no=163, id=1034, vol=2.171216e+06
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name  HB1) 2.612 0.853 0.853 weight 1.000 ! spec=13C_NOESY, no=164, id=1035, vol=2.185308e+06
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name  HB2) 2.653 0.880 0.880 weight 1.000 ! spec=13C_NOESY, no=165, id=1036, vol=1.973417e+06
assign (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   60 and name   HN) 3.315 1.374 1.374 weight 1.000 ! spec=13C_NOESY, no=168, id=1039, vol=4.508500e+05
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   56 and name  HB2) 2.385 0.711 0.711 weight 1.000 ! spec=13C_NOESY, no=169, id=1040, vol=3.840605e+06
assign (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   56 and name  HB2) 2.119 0.561 0.561 weight 1.000 ! spec=13C_NOESY, no=171, id=1042, vol=8.529707e+06
assign (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   62 and name  HB1) 2.081 0.542 0.542 weight 1.000 ! spec=13C_NOESY, no=174, id=1045, vol=9.632348e+06
assign (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   63 and name   HN) 2.549 0.812 0.812 weight 1.000 ! spec=13C_NOESY, no=175, id=1046, vol=2.360561e+06
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   62 and name   HA) 2.541 0.807 0.807 weight 1.000 ! spec=13C_NOESY, no=176, id=1047, vol=2.330902e+06
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name   HA) 2.708 0.917 0.917 weight 1.000 ! spec=13C_NOESY, no=177, id=1048, vol=1.539245e+06
assign (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   91 and name  HB2) 2.668 0.890 0.890 weight 1.000 ! spec=13C_NOESY, no=180, id=1051, vol=1.960609e+06
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   80 and name  HB2) 2.029 0.515 0.515 weight 1.000 ! spec=13C_NOESY, no=183, id=1054, vol=9.243135e+06
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name  HB1) 2.081 0.541 0.541 weight 1.000 ! spec=13C_NOESY, no=184, id=1055, vol=8.276828e+06
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   30 and name  HB1) 2.295 0.658 0.658 weight 1.000 ! spec=13C_NOESY, no=190, id=1061, vol=5.286001e+06
assign (segid "   A" and resid   67 and name   HA) (segid "   A" and resid   67 and name  HB2) 2.463 0.758 0.758 weight 1.000 ! spec=13C_NOESY, no=192, id=1063, vol=3.713044e+06
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   67 and name   HN) 2.631 0.865 0.865 weight 1.000 ! spec=13C_NOESY, no=194, id=1065, vol=2.094287e+06
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   58 and name  HB2) 2.591 0.839 0.839 weight 1.000 ! spec=13C_NOESY, no=196, id=1067, vol=2.417364e+06
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   76 and name HD11) 3.107 1.207 1.207 weight 1.000 ! spec=13C_NOESY, no=199, id=1070, vol=7.282380e+05
    or (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   76 and name HD12)
    or (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   76 and name HD13)
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   80 and name  HB2) 2.148 0.577 0.577 weight 1.000 ! spec=13C_NOESY, no=203, id=1074, vol=6.603026e+06
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   80 and name  HB1) 2.276 0.648 0.648 weight 1.000 ! spec=13C_NOESY, no=204, id=1075, vol=4.786658e+06
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   91 and name  HB1) 2.304 0.664 0.664 weight 1.000 ! spec=13C_NOESY, no=208, id=1079, vol=4.503083e+06
assign (segid "   A" and resid   91 and name  HB2) (segid "   A" and resid   91 and name   HA) 2.681 0.899 0.899 weight 1.000 ! spec=13C_NOESY, no=210, id=1081, vol=1.833769e+06
assign (segid "   A" and resid   91 and name  HB2) (segid "   A" and resid   75 and name HD11) 3.250 1.320 1.320 weight 1.000 ! spec=13C_NOESY, no=213, id=1084, vol=6.245261e+05
    or (segid "   A" and resid   91 and name  HB2) (segid "   A" and resid   75 and name HD13)
    or (segid "   A" and resid   91 and name  HB2) (segid "   A" and resid   75 and name HD12)
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name  HB2) 2.289 0.655 0.655 weight 1.000 ! spec=13C_NOESY, no=214, id=1085, vol=5.170947e+06
assign (segid "   A" and resid  102 and name  HB1) (segid "   A" and resid  102 and name  HB2) 2.103 0.553 0.553 weight 1.000 ! spec=13C_NOESY, no=217, id=1088, vol=7.888778e+06
assign (segid "   A" and resid  102 and name  HB2) (segid "   A" and resid   84 and name HG21) 2.555 0.816 0.816 weight 1.000 ! spec=13C_NOESY, no=220, id=1091, vol=2.614168e+06
    or (segid "   A" and resid  102 and name  HB2) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid  102 and name  HB2) (segid "   A" and resid   84 and name HG22)
assign (segid "   A" and resid  102 and name HD21) (segid "   A" and resid  102 and name  HB2) 2.839 1.007 1.007 weight 1.000 ! spec=13C_NOESY, no=224, id=1095, vol=1.204167e+06
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid   84 and name HG13) 2.750 0.945 0.945 weight 1.000 ! spec=13C_NOESY, no=226, id=1097, vol=1.649782e+06
    or (segid "   A" and resid  102 and name   HA) (segid "   A" and resid   84 and name HG11)
    or (segid "   A" and resid  102 and name   HA) (segid "   A" and resid   84 and name HG12)
assign (segid "   A" and resid  102 and name  HB1) (segid "   A" and resid  102 and name   HA) 2.468 0.761 0.761 weight 1.000 ! spec=13C_NOESY, no=229, id=1100, vol=3.676110e+06
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    4 and name   HA) 2.069 0.535 0.535 weight 1.000 ! spec=13C_NOESY, no=230, id=1101, vol=8.981349e+06
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   45 and name  HB1) 2.598 0.844 0.844 weight 1.000 ! spec=13C_NOESY, no=232, id=1103, vol=2.291966e+06
assign (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    4 and name   HN) 2.844 1.011 1.011 weight 1.000 ! spec=13C_NOESY, no=234, id=1105, vol=1.302041e+06
assign (segid "   A" and resid    4 and name  HB2) (segid "   A" and resid    4 and name   HN) 2.846 1.012 1.012 weight 1.000 ! spec=13C_NOESY, no=235, id=1106, vol=1.214696e+06
assign (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    4 and name   HA) 2.953 1.090 1.090 weight 1.000 ! spec=13C_NOESY, no=236, id=1107, vol=9.069696e+05
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   17 and name  HB2) 2.368 0.701 0.701 weight 1.000 ! spec=13C_NOESY, no=239, id=1110, vol=3.846645e+06
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name   HA) 2.186 0.598 0.598 weight 1.000 ! spec=13C_NOESY, no=241, id=1112, vol=5.861496e+06
assign (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   17 and name   HA) 2.761 0.953 0.953 weight 1.000 ! spec=13C_NOESY, no=244, id=1115, vol=1.706744e+06
assign (segid "   A" and resid   46 and name  HG1) (segid "   A" and resid   46 and name   HN) 2.615 0.855 0.855 weight 1.000 ! spec=13C_NOESY, no=245, id=1116, vol=2.090908e+06
assign (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   26 and name  HB2) 2.035 0.517 0.517 weight 1.000 ! spec=13C_NOESY, no=246, id=1117, vol=1.019044e+07
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   46 and name  HB2) 2.367 0.700 0.700 weight 1.000 ! spec=13C_NOESY, no=252, id=1123, vol=3.999426e+06
assign (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   33 and name   HA) 2.584 0.835 0.835 weight 1.000 ! spec=13C_NOESY, no=254, id=1125, vol=2.185329e+06
assign (segid "   A" and resid   46 and name  HG1) (segid "   A" and resid   46 and name  HG2) 1.847 0.426 0.426 weight 1.000 ! spec=13C_NOESY, no=255, id=1126, vol=1.567768e+07
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name   HA) 2.569 0.825 0.825 weight 1.000 ! spec=13C_NOESY, no=256, id=1127, vol=2.223328e+06
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name   HA) 2.334 0.681 0.681 weight 1.000 ! spec=13C_NOESY, no=257, id=1128, vol=3.917799e+06
assign (segid "   A" and resid   49 and name   HA) (segid "   A" and resid   49 and name  HB2) 2.488 0.774 0.774 weight 1.000 ! spec=13C_NOESY, no=259, id=1130, vol=3.108566e+06
assign (segid "   A" and resid   49 and name  HB1) (segid "   A" and resid   49 and name   HA) 2.531 0.800 0.800 weight 1.000 ! spec=13C_NOESY, no=262, id=1133, vol=2.700564e+06
assign (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   84 and name   HA) 2.028 0.514 0.514 weight 1.000 ! spec=13C_NOESY, no=265, id=1136, vol=9.779605e+06
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   66 and name   HA) 2.108 0.556 0.556 weight 1.000 ! spec=13C_NOESY, no=268, id=1139, vol=7.174273e+06
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   65 and name   HA) 2.390 0.714 0.714 weight 1.000 ! spec=13C_NOESY, no=270, id=1141, vol=3.596145e+06
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name  HG1) 1.912 0.457 0.457 weight 1.000 ! spec=13C_NOESY, no=276, id=1147, vol=1.547040e+07
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   97 and name  HB2) 2.453 0.752 0.752 weight 1.000 ! spec=13C_NOESY, no=278, id=1149, vol=3.384134e+06
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid    5 and name  HD1) 2.873 1.032 1.032 weight 1.000 ! spec=13C_NOESY, no=281, id=1152, vol=1.372994e+06
    or (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid    5 and name  HD2)
assign (segid "   A" and resid   10 and name  HG2) (segid "   A" and resid   10 and name   HA) 2.810 0.987 0.987 weight 1.000 ! spec=13C_NOESY, no=283, id=1154, vol=1.323550e+06
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name  HG2) 2.677 0.896 0.896 weight 1.000 ! spec=13C_NOESY, no=284, id=1155, vol=1.854635e+06
assign (segid "   A" and resid   10 and name  HG2) (segid "   A" and resid   10 and name  HG1) 1.780 0.396 0.396 weight 1.000 ! spec=13C_NOESY, no=285, id=1156, vol=2.333065e+07
assign (segid "   A" and resid   10 and name  HG1) (segid "   A" and resid   10 and name   HN) 2.693 0.906 0.906 weight 1.000 ! spec=13C_NOESY, no=288, id=1159, vol=1.859809e+06
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name  HB2) 2.037 0.518 0.518 weight 1.000 ! spec=13C_NOESY, no=289, id=1160, vol=9.720508e+06
assign (segid "   A" and resid   41 and name  HG2) (segid "   A" and resid    1 and name   HA) 2.432 0.739 0.739 weight 1.000 ! spec=13C_NOESY, no=294, id=1165, vol=3.578356e+06
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name   HB) 2.359 0.695 0.695 weight 1.000 ! spec=13C_NOESY, no=297, id=1168, vol=4.264973e+06
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   45 and name   HA) 2.354 0.693 0.693 weight 1.000 ! spec=13C_NOESY, no=301, id=1172, vol=3.824194e+06
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   47 and name  HD1) 2.807 0.985 0.985 weight 1.000 ! spec=13C_NOESY, no=302, id=1173, vol=1.333041e+06
    or (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   47 and name  HD2)
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name  HG1) 2.397 0.718 0.718 weight 1.000 ! spec=13C_NOESY, no=303, id=1174, vol=3.465733e+06
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   59 and name   HA) 2.304 0.664 0.664 weight 1.000 ! spec=13C_NOESY, no=304, id=1175, vol=4.501621e+06
assign (segid "   A" and resid   59 and name  HB1) (segid "   A" and resid   59 and name   HA) 2.628 0.863 0.863 weight 1.000 ! spec=13C_NOESY, no=305, id=1176, vol=2.019430e+06
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   73 and name  HG2) 2.694 0.907 0.907 weight 1.000 ! spec=13C_NOESY, no=306, id=1177, vol=1.928490e+06
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   59 and name  HB2) 2.390 0.714 0.714 weight 1.000 ! spec=13C_NOESY, no=307, id=1178, vol=4.007029e+06
assign (segid "   A" and resid   68 and name   HA) (segid "   A" and resid   68 and name  HB2) 1.929 0.465 0.465 weight 1.000 ! spec=13C_NOESY, no=309, id=1180, vol=1.329739e+07
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   68 and name   HA) 1.881 0.442 0.442 weight 1.000 ! spec=13C_NOESY, no=310, id=1181, vol=1.518169e+07
assign (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   68 and name   HN) 3.082 1.187 1.187 weight 1.000 ! spec=13C_NOESY, no=312, id=1183, vol=8.518230e+05
assign (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   83 and name  HG1) 2.083 0.542 0.542 weight 1.000 ! spec=13C_NOESY, no=315, id=1186, vol=9.715848e+06
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   83 and name   HA) 2.012 0.506 0.506 weight 1.000 ! spec=13C_NOESY, no=316, id=1187, vol=1.013108e+07
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   83 and name   HA) 2.459 0.756 0.756 weight 1.000 ! spec=13C_NOESY, no=317, id=1188, vol=3.062257e+06
assign (segid "   A" and resid   83 and name  HB1) (segid "   A" and resid   83 and name   HA) 2.673 0.893 0.893 weight 1.000 ! spec=13C_NOESY, no=318, id=1189, vol=1.926840e+06
assign (segid "   A" and resid   83 and name  HB1) (segid "   A" and resid   83 and name   HN) 2.625 0.862 0.862 weight 1.000 ! spec=13C_NOESY, no=319, id=1190, vol=2.089299e+06
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   83 and name  HB2) 2.693 0.907 0.907 weight 1.000 ! spec=13C_NOESY, no=320, id=1191, vol=1.871100e+06
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   83 and name  HG2) 3.097 1.199 1.199 weight 1.000 ! spec=13C_NOESY, no=324, id=1195, vol=7.528666e+05
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   83 and name  HG1) 3.085 1.190 1.190 weight 1.000 ! spec=13C_NOESY, no=325, id=1196, vol=8.524096e+05
assign (segid "   A" and resid   20 and name  HB1) (segid "   A" and resid   20 and name   HA) 2.954 1.091 1.091 weight 1.000 ! spec=13C_NOESY, no=329, id=1200, vol=1.032424e+06
assign (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   20 and name   HA) 2.805 0.983 0.983 weight 1.000 ! spec=13C_NOESY, no=330, id=1201, vol=1.483401e+06
assign (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   20 and name  HB1) 2.108 0.556 0.556 weight 1.000 ! spec=13C_NOESY, no=332, id=1203, vol=8.308898e+06
assign (segid "   A" and resid   20 and name  HB1) (segid "   A" and resid   20 and name HD11) 3.035 1.151 1.151 weight 1.000 ! spec=13C_NOESY, no=333, id=1204, vol=7.420201e+05
    or (segid "   A" and resid   20 and name  HB1) (segid "   A" and resid   20 and name HD13)
    or (segid "   A" and resid   20 and name  HB1) (segid "   A" and resid   20 and name HD12)
assign (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   20 and name HD22) 2.492 0.776 0.776 weight 1.000 ! spec=13C_NOESY, no=334, id=1205, vol=3.273071e+06
    or (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   20 and name HD21)
    or (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   20 and name HD23)
assign (segid "   A" and resid   20 and name  HB1) (segid "   A" and resid   99 and name HG23) 2.614 0.854 0.854 weight 1.000 ! spec=13C_NOESY, no=335, id=1206, vol=2.088024e+06
    or (segid "   A" and resid   20 and name  HB1) (segid "   A" and resid   99 and name HG21)
    or (segid "   A" and resid   20 and name  HB1) (segid "   A" and resid   99 and name HG22)
assign (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   55 and name HD21) 2.261 0.639 0.639 weight 1.000 ! spec=13C_NOESY, no=336, id=1207, vol=5.757875e+06
    or (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   55 and name HD23)
    or (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   55 and name HD22)
assign (segid "   A" and resid  102 and name  HB1) (segid "   A" and resid   20 and name HD22) 2.263 0.640 0.640 weight 1.000 ! spec=13C_NOESY, no=338, id=1209, vol=4.777007e+06
    or (segid "   A" and resid  102 and name  HB1) (segid "   A" and resid   20 and name HD21)
    or (segid "   A" and resid  102 and name  HB1) (segid "   A" and resid   20 and name HD23)
assign (segid "   A" and resid  102 and name  HB2) (segid "   A" and resid   20 and name HD22) 2.281 0.650 0.650 weight 1.000 ! spec=13C_NOESY, no=339, id=1210, vol=4.367138e+06
    or (segid "   A" and resid  102 and name  HB2) (segid "   A" and resid   20 and name HD21)
    or (segid "   A" and resid  102 and name  HB2) (segid "   A" and resid   20 and name HD23)
assign (segid "   A" and resid   20 and name HD22) (segid "   A" and resid   20 and name   HA) 1.983 0.492 0.492 weight 1.000 ! spec=13C_NOESY, no=340, id=1211, vol=1.112331e+07
    or (segid "   A" and resid   20 and name HD21) (segid "   A" and resid   20 and name   HA)
    or (segid "   A" and resid   20 and name HD23) (segid "   A" and resid   20 and name   HA)
assign (segid "   A" and resid   20 and name HD22) (segid "   A" and resid   84 and name HG21) 1.758 0.386 0.386 weight 1.000 ! spec=13C_NOESY, no=342, id=1213, vol=2.011070e+07
    or (segid "   A" and resid   20 and name HD22) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid   20 and name HD22) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   20 and name HD21) (segid "   A" and resid   84 and name HG21)
    or (segid "   A" and resid   20 and name HD21) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid   20 and name HD21) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   20 and name HD23) (segid "   A" and resid   84 and name HG21)
    or (segid "   A" and resid   20 and name HD23) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid   20 and name HD23) (segid "   A" and resid   84 and name HG22)
assign (segid "   A" and resid   55 and name HD21) (segid "   A" and resid   57 and name   HN) 2.903 1.053 1.053 weight 1.000 ! spec=13C_NOESY, no=352, id=1223, vol=1.220327e+06
    or (segid "   A" and resid   55 and name HD23) (segid "   A" and resid   57 and name   HN)
    or (segid "   A" and resid   55 and name HD22) (segid "   A" and resid   57 and name   HN)
assign (segid "   A" and resid   55 and name HD21) (segid "   A" and resid   55 and name   HA) 3.165 1.252 1.252 weight 1.000 ! spec=13C_NOESY, no=353, id=1224, vol=6.522775e+05
    or (segid "   A" and resid   55 and name HD23) (segid "   A" and resid   55 and name   HA)
    or (segid "   A" and resid   55 and name HD22) (segid "   A" and resid   55 and name   HA)
assign (segid "   A" and resid   55 and name   HG) (segid "   A" and resid   55 and name   HA) 2.939 1.079 1.079 weight 1.000 ! spec=13C_NOESY, no=358, id=1229, vol=1.101988e+06
assign (segid "   A" and resid   60 and name  HB1) (segid "   A" and resid   60 and name   HN) 3.063 1.173 1.173 weight 1.000 ! spec=13C_NOESY, no=361, id=1232, vol=8.433166e+05
assign (segid "   A" and resid   75 and name   HG) (segid "   A" and resid   75 and name   HN) 2.766 0.956 0.956 weight 1.000 ! spec=13C_NOESY, no=369, id=1240, vol=1.413116e+06
assign (segid "   A" and resid   75 and name   HG) (segid "   A" and resid   75 and name   HA) 2.650 0.878 0.878 weight 1.000 ! spec=13C_NOESY, no=370, id=1241, vol=1.780546e+06
assign (segid "   A" and resid   75 and name HD22) (segid "   A" and resid   75 and name   HA) 2.893 1.047 1.047 weight 1.000 ! spec=13C_NOESY, no=379, id=1250, vol=9.994344e+05
    or (segid "   A" and resid   75 and name HD21) (segid "   A" and resid   75 and name   HA)
    or (segid "   A" and resid   75 and name HD23) (segid "   A" and resid   75 and name   HA)
assign (segid "   A" and resid   75 and name HD22) (segid "   A" and resid   75 and name   HN) 3.066 1.175 1.175 weight 1.000 ! spec=13C_NOESY, no=382, id=1253, vol=7.792174e+05
    or (segid "   A" and resid   75 and name HD21) (segid "   A" and resid   75 and name   HN)
    or (segid "   A" and resid   75 and name HD23) (segid "   A" and resid   75 and name   HN)
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   76 and name   HA) 2.590 0.838 0.838 weight 1.000 ! spec=13C_NOESY, no=383, id=1254, vol=2.348130e+06
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   76 and name   HA) 2.007 0.504 0.504 weight 1.000 ! spec=13C_NOESY, no=384, id=1255, vol=1.037350e+07
assign (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   76 and name  HB1) 2.616 0.856 0.856 weight 1.000 ! spec=13C_NOESY, no=385, id=1256, vol=2.087354e+06
assign (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   77 and name   HN) 3.067 1.176 1.176 weight 1.000 ! spec=13C_NOESY, no=389, id=1260, vol=7.500076e+05
assign (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid   76 and name HD11) 2.544 0.809 0.809 weight 1.000 ! spec=13C_NOESY, no=393, id=1264, vol=2.684104e+06
    or (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid   76 and name HD12)
    or (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid   76 and name HD13)
assign (segid "   A" and resid   76 and name HD11) (segid "   A" and resid   11 and name  HE2) 2.271 0.645 0.645 weight 1.000 ! spec=13C_NOESY, no=395, id=1266, vol=4.682356e+06
    or (segid "   A" and resid   76 and name HD11) (segid "   A" and resid   11 and name  HE1)
    or (segid "   A" and resid   76 and name HD12) (segid "   A" and resid   11 and name  HE2)
    or (segid "   A" and resid   76 and name HD12) (segid "   A" and resid   11 and name  HE1)
    or (segid "   A" and resid   76 and name HD13) (segid "   A" and resid   11 and name  HE2)
    or (segid "   A" and resid   76 and name HD13) (segid "   A" and resid   11 and name  HE1)
assign (segid "   A" and resid   76 and name HD11) (segid "   A" and resid   76 and name   HA) 2.959 1.095 1.095 weight 1.000 ! spec=13C_NOESY, no=396, id=1267, vol=9.019899e+05
    or (segid "   A" and resid   76 and name HD12) (segid "   A" and resid   76 and name   HA)
    or (segid "   A" and resid   76 and name HD13) (segid "   A" and resid   76 and name   HA)
assign (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name HD11) 2.285 0.653 0.653 weight 1.000 ! spec=13C_NOESY, no=397, id=1268, vol=5.663263e+06
    or (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name HD12)
    or (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name HD13)
assign (segid "   A" and resid   76 and name HD11) (segid "   A" and resid   68 and name  HB1) 2.340 0.685 0.685 weight 1.000 ! spec=13C_NOESY, no=398, id=1269, vol=4.070171e+06
    or (segid "   A" and resid   76 and name HD12) (segid "   A" and resid   68 and name  HB1)
    or (segid "   A" and resid   76 and name HD13) (segid "   A" and resid   68 and name  HB1)
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   77 and name  HB2) 3.114 1.212 1.212 weight 1.000 ! spec=13C_NOESY, no=406, id=1277, vol=7.434079e+05
assign (segid "   A" and resid  102 and name HD21) (segid "   A" and resid   77 and name HD21) 2.578 0.831 0.831 weight 1.000 ! spec=13C_NOESY, no=407, id=1278, vol=2.062941e+06
    or (segid "   A" and resid  102 and name HD21) (segid "   A" and resid   77 and name HD23)
    or (segid "   A" and resid  102 and name HD21) (segid "   A" and resid   77 and name HD22)
assign (segid "   A" and resid   77 and name HD21) (segid "   A" and resid  102 and name HD22) 2.749 0.944 0.944 weight 1.000 ! spec=13C_NOESY, no=408, id=1279, vol=1.447370e+06
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid  102 and name HD22)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid  102 and name HD22)
assign (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   77 and name   HA) 2.942 1.082 1.082 weight 1.000 ! spec=13C_NOESY, no=409, id=1280, vol=9.641466e+05
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   77 and name   HA)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   77 and name   HA)
assign (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   99 and name   HA) 2.251 0.633 0.633 weight 1.000 ! spec=13C_NOESY, no=410, id=1281, vol=4.730916e+06
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   99 and name   HA)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   99 and name   HA)
assign (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   98 and name   HA) 3.152 1.242 1.242 weight 1.000 ! spec=13C_NOESY, no=411, id=1282, vol=5.358900e+05
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   98 and name   HA)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   98 and name   HA)
assign (segid "   A" and resid   77 and name HD21) (segid "   A" and resid  102 and name  HB2) 2.821 0.995 0.995 weight 1.000 ! spec=13C_NOESY, no=413, id=1284, vol=1.188249e+06
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid  102 and name  HB2)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid  102 and name  HB2)
assign (segid "   A" and resid  102 and name  HB1) (segid "   A" and resid   77 and name HD21) 2.534 0.803 0.803 weight 1.000 ! spec=13C_NOESY, no=414, id=1285, vol=2.315638e+06
    or (segid "   A" and resid  102 and name  HB1) (segid "   A" and resid   77 and name HD23)
    or (segid "   A" and resid  102 and name  HB1) (segid "   A" and resid   77 and name HD22)
assign (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   77 and name   HG) 2.095 0.549 0.549 weight 1.000 ! spec=13C_NOESY, no=415, id=1286, vol=7.957955e+06
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   77 and name   HG)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   77 and name   HG)
assign (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   99 and name HD11) 2.905 1.055 1.055 weight 1.000 ! spec=13C_NOESY, no=418, id=1289, vol=1.027166e+06
    or (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   99 and name HD12)
    or (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   99 and name HD13)
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   99 and name HD11)
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   99 and name HD12)
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   99 and name HD13)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   99 and name HD11)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   99 and name HD12)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   99 and name HD13)
assign (segid "   A" and resid   77 and name   HG) (segid "   A" and resid   77 and name   HA) 2.559 0.819 0.819 weight 1.000 ! spec=13C_NOESY, no=419, id=1290, vol=2.381889e+06
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   77 and name   HG) 3.088 1.192 1.192 weight 1.000 ! spec=13C_NOESY, no=420, id=1291, vol=7.206984e+05
assign (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   78 and name   HN) 3.767 1.773 1.773 weight 1.000 ! spec=13C_NOESY, no=425, id=1296, vol=2.470855e+05
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   78 and name   HN)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   78 and name   HN)
assign (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   84 and name   HN) 3.556 1.580 1.580 weight 1.000 ! spec=13C_NOESY, no=426, id=1297, vol=2.787188e+05
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   84 and name   HN)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   84 and name   HN)
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   77 and name HD21) 2.940 1.081 1.081 weight 1.000 ! spec=13C_NOESY, no=427, id=1298, vol=9.457510e+05
    or (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   77 and name HD23)
    or (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   77 and name HD22)
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   43 and name  HD1) 2.250 0.633 0.633 weight 1.000 ! spec=13C_NOESY, no=432, id=1303, vol=5.327811e+06
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   43 and name  HD2)
assign (segid "   A" and resid   15 and name   HB) (segid "   A" and resid   15 and name   HA) 2.267 0.642 0.642 weight 1.000 ! spec=13C_NOESY, no=434, id=1305, vol=5.047764e+06
assign (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   21 and name HG11) 2.315 0.670 0.670 weight 1.000 ! spec=13C_NOESY, no=438, id=1309, vol=4.364678e+06
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   21 and name HG12)
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   21 and name HG13)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   21 and name HG11)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   21 and name HG12)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   21 and name HG13)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   21 and name HG11)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   21 and name HG12)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   21 and name HG13)
assign (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   78 and name  HB2) 2.590 0.838 0.838 weight 1.000 ! spec=13C_NOESY, no=440, id=1311, vol=2.091538e+06
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   78 and name  HB2)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   78 and name  HB2)
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name HD11) 2.201 0.606 0.606 weight 1.000 ! spec=13C_NOESY, no=442, id=1313, vol=5.624968e+06
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name HD13)
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name HD12)
assign (segid "   A" and resid   15 and name   HB) (segid "   A" and resid   15 and name   HN) 2.908 1.057 1.057 weight 1.000 ! spec=13C_NOESY, no=443, id=1314, vol=1.158607e+06
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   39 and name  HE3) 2.169 0.588 0.588 weight 1.000 ! spec=13C_NOESY, no=456, id=1327, vol=6.367060e+06
    or (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   39 and name  HE1)
    or (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   39 and name  HE2)
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name   HB) 2.230 0.622 0.622 weight 1.000 ! spec=13C_NOESY, no=457, id=1328, vol=5.800310e+06
assign (segid "   A" and resid   36 and name   HB) (segid "   A" and resid   36 and name HD11) 2.012 0.506 0.506 weight 1.000 ! spec=13C_NOESY, no=458, id=1329, vol=1.151570e+07
    or (segid "   A" and resid   36 and name   HB) (segid "   A" and resid   36 and name HD13)
    or (segid "   A" and resid   36 and name   HB) (segid "   A" and resid   36 and name HD12)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name   HB) 2.369 0.702 0.702 weight 1.000 ! spec=13C_NOESY, no=460, id=1331, vol=4.025458e+06
assign (segid "   A" and resid   36 and name HD11) (segid "   A" and resid   90 and name   HA) 2.292 0.657 0.657 weight 1.000 ! spec=13C_NOESY, no=464, id=1335, vol=4.440224e+06
    or (segid "   A" and resid   36 and name HD13) (segid "   A" and resid   90 and name   HA)
    or (segid "   A" and resid   36 and name HD12) (segid "   A" and resid   90 and name   HA)
assign (segid "   A" and resid   36 and name HD11) (segid "   A" and resid   35 and name  HB2) 1.980 0.490 0.490 weight 1.000 ! spec=13C_NOESY, no=465, id=1336, vol=1.117623e+07
    or (segid "   A" and resid   36 and name HD13) (segid "   A" and resid   35 and name  HB2)
    or (segid "   A" and resid   36 and name HD12) (segid "   A" and resid   35 and name  HB2)
assign (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   36 and name HD11) 2.342 0.686 0.686 weight 1.000 ! spec=13C_NOESY, no=468, id=1339, vol=4.017742e+06
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   36 and name HD13)
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   36 and name HD12)
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name   HB) 2.467 0.761 0.761 weight 1.000 ! spec=13C_NOESY, no=469, id=1340, vol=3.018856e+06
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   43 and name  HB1) 2.454 0.752 0.752 weight 1.000 ! spec=13C_NOESY, no=471, id=1342, vol=3.090922e+06
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name HG21) 1.915 0.459 0.459 weight 1.000 ! spec=13C_NOESY, no=475, id=1346, vol=1.536315e+07
    or (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name HG22)
    or (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name HG23)
assign (segid "   A" and resid   95 and name HG21) (segid "   A" and resid   95 and name   HB) 2.197 0.603 0.603 weight 1.000 ! spec=13C_NOESY, no=477, id=1348, vol=6.493030e+06
    or (segid "   A" and resid   95 and name HG22) (segid "   A" and resid   95 and name   HB)
    or (segid "   A" and resid   95 and name HG23) (segid "   A" and resid   95 and name   HB)
assign (segid "   A" and resid   95 and name   HB) (segid "   A" and resid   96 and name   HN) 2.490 0.775 0.775 weight 1.000 ! spec=13C_NOESY, no=478, id=1349, vol=2.915645e+06
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name   HB) 2.848 1.014 1.014 weight 1.000 ! spec=13C_NOESY, no=479, id=1350, vol=1.307524e+06
assign (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   99 and name HD11) 2.214 0.612 0.612 weight 1.000 ! spec=13C_NOESY, no=481, id=1352, vol=5.524534e+06
    or (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   99 and name HD12)
    or (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   99 and name HD13)
assign (segid "   A" and resid   99 and name HD11) (segid "   A" and resid   99 and name HG11) 1.903 0.453 0.453 weight 1.000 ! spec=13C_NOESY, no=482, id=1353, vol=1.424200e+07
    or (segid "   A" and resid   99 and name HD12) (segid "   A" and resid   99 and name HG11)
    or (segid "   A" and resid   99 and name HD13) (segid "   A" and resid   99 and name HG11)
assign (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   77 and name   HG) 2.454 0.753 0.753 weight 1.000 ! spec=13C_NOESY, no=485, id=1356, vol=3.066753e+06
assign (segid "   A" and resid   99 and name   HA) (segid "   A" and resid  102 and name HD22) 2.923 1.068 1.068 weight 1.000 ! spec=13C_NOESY, no=486, id=1357, vol=1.031642e+06
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   99 and name   HA) 2.474 0.765 0.765 weight 1.000 ! spec=13C_NOESY, no=487, id=1358, vol=2.921710e+06
assign (segid "   A" and resid   99 and name   HB) (segid "   A" and resid   43 and name  HB2) 2.606 0.849 0.849 weight 1.000 ! spec=13C_NOESY, no=490, id=1361, vol=2.450314e+06
assign (segid "   A" and resid   99 and name   HB) (segid "   A" and resid   99 and name HG11) 2.288 0.654 0.654 weight 1.000 ! spec=13C_NOESY, no=492, id=1363, vol=5.198613e+06
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   38 and name   HA) 2.558 0.818 0.818 weight 1.000 ! spec=13C_NOESY, no=495, id=1366, vol=2.360902e+06
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name   HA) 2.856 1.020 1.020 weight 1.000 ! spec=13C_NOESY, no=496, id=1367, vol=1.122474e+06
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   41 and name  HB1) 1.933 0.467 0.467 weight 1.000 ! spec=13C_NOESY, no=500, id=1371, vol=1.278545e+07
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   37 and name  HB1) 2.853 1.017 1.017 weight 1.000 ! spec=13C_NOESY, no=501, id=1372, vol=7.201149e+05
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   37 and name  HB3)
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   37 and name  HB2)
assign (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name   HA) 2.507 0.785 0.785 weight 1.000 ! spec=13C_NOESY, no=502, id=1373, vol=2.820913e+06
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    1 and name   HA) 2.326 0.676 0.676 weight 1.000 ! spec=13C_NOESY, no=514, id=1385, vol=3.842246e+06
assign (segid "   A" and resid    1 and name   HA) (segid "   A" and resid    2 and name HG21) 2.622 0.859 0.859 weight 1.000 ! spec=13C_NOESY, no=517, id=1388, vol=2.106554e+06
    or (segid "   A" and resid    1 and name   HA) (segid "   A" and resid    2 and name HG23)
    or (segid "   A" and resid    1 and name   HA) (segid "   A" and resid    2 and name HG22)
assign (segid "   A" and resid    2 and name   HA) (segid "   A" and resid    2 and name   HB) 2.633 0.866 0.866 weight 1.000 ! spec=13C_NOESY, no=518, id=1389, vol=2.055503e+06
assign (segid "   A" and resid    2 and name   HA) (segid "   A" and resid   52 and name  HB1) 2.349 0.690 0.690 weight 1.000 ! spec=13C_NOESY, no=519, id=1390, vol=4.133660e+06
assign (segid "   A" and resid    2 and name HG21) (segid "   A" and resid    2 and name   HA) 2.276 0.648 0.648 weight 1.000 ! spec=13C_NOESY, no=521, id=1392, vol=4.372083e+06
    or (segid "   A" and resid    2 and name HG23) (segid "   A" and resid    2 and name   HA)
    or (segid "   A" and resid    2 and name HG22) (segid "   A" and resid    2 and name   HA)
assign (segid "   A" and resid   88 and name HG22) (segid "   A" and resid   88 and name   HB) 1.876 0.440 0.440 weight 1.000 ! spec=13C_NOESY, no=522, id=1393, vol=1.530053e+07
    or (segid "   A" and resid   88 and name HG21) (segid "   A" and resid   88 and name   HB)
    or (segid "   A" and resid   88 and name HG23) (segid "   A" and resid   88 and name   HB)
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   84 and name   HA) 2.593 0.841 0.841 weight 1.000 ! spec=13C_NOESY, no=526, id=1397, vol=2.080887e+06
assign (segid "   A" and resid   63 and name   HA) (segid "   A" and resid   63 and name   HB) 2.751 0.946 0.946 weight 1.000 ! spec=13C_NOESY, no=528, id=1399, vol=1.762924e+06
assign (segid "   A" and resid   69 and name HG11) (segid "   A" and resid   25 and name  HB2) 2.218 0.615 0.615 weight 1.000 ! spec=13C_NOESY, no=529, id=1400, vol=5.126920e+06
    or (segid "   A" and resid   69 and name HG12) (segid "   A" and resid   25 and name  HB2)
    or (segid "   A" and resid   69 and name HG13) (segid "   A" and resid   25 and name  HB2)
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   69 and name HG11) 2.539 0.806 0.806 weight 1.000 ! spec=13C_NOESY, no=530, id=1401, vol=2.544400e+06
    or (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   69 and name   HN) 2.513 0.790 0.790 weight 1.000 ! spec=13C_NOESY, no=533, id=1404, vol=2.721602e+06
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   69 and name HG22) 2.316 0.670 0.670 weight 1.000 ! spec=13C_NOESY, no=535, id=1406, vol=4.413983e+06
    or (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   69 and name HG21)
    or (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   69 and name HG23)
assign (segid "   A" and resid   69 and name   HB) (segid "   A" and resid   74 and name   HB) 2.595 0.842 0.842 weight 1.000 ! spec=13C_NOESY, no=536, id=1407, vol=2.465666e+06
assign (segid "   A" and resid   69 and name   HB) (segid "   A" and resid   69 and name HG11) 2.332 0.680 0.680 weight 1.000 ! spec=13C_NOESY, no=537, id=1408, vol=4.438969e+06
    or (segid "   A" and resid   69 and name   HB) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   69 and name   HB) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid   69 and name   HB) (segid "   A" and resid   69 and name HG22) 2.324 0.675 0.675 weight 1.000 ! spec=13C_NOESY, no=538, id=1409, vol=4.476989e+06
    or (segid "   A" and resid   69 and name   HB) (segid "   A" and resid   69 and name HG21)
    or (segid "   A" and resid   69 and name   HB) (segid "   A" and resid   69 and name HG23)
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name HG11) 2.308 0.666 0.666 weight 1.000 ! spec=13C_NOESY, no=541, id=1412, vol=4.164993e+06
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name HG13)
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name HG12)
assign (segid "   A" and resid    2 and name HG11) (segid "   A" and resid    2 and name   HN) 2.714 0.921 0.921 weight 1.000 ! spec=13C_NOESY, no=543, id=1414, vol=1.714665e+06
    or (segid "   A" and resid    2 and name HG13) (segid "   A" and resid    2 and name   HN)
    or (segid "   A" and resid    2 and name HG12) (segid "   A" and resid    2 and name   HN)
assign (segid "   A" and resid   69 and name HG22) (segid "   A" and resid   74 and name   HB) 2.167 0.587 0.587 weight 1.000 ! spec=13C_NOESY, no=547, id=1418, vol=6.203948e+06
    or (segid "   A" and resid   69 and name HG21) (segid "   A" and resid   74 and name   HB)
    or (segid "   A" and resid   69 and name HG23) (segid "   A" and resid   74 and name   HB)
assign (segid "   A" and resid    2 and name   HB) (segid "   A" and resid    2 and name HG11) 1.969 0.485 0.485 weight 1.000 ! spec=13C_NOESY, no=549, id=1420, vol=1.040997e+07
    or (segid "   A" and resid    2 and name   HB) (segid "   A" and resid    2 and name HG13)
    or (segid "   A" and resid    2 and name   HB) (segid "   A" and resid    2 and name HG12)
assign (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   84 and name HG21) 2.047 0.524 0.524 weight 1.000 ! spec=13C_NOESY, no=552, id=1423, vol=9.277938e+06
    or (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   84 and name HG22)
assign (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   84 and name HG13) 1.983 0.492 0.492 weight 1.000 ! spec=13C_NOESY, no=553, id=1424, vol=1.125733e+07
    or (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   84 and name HG11)
    or (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   84 and name HG12)
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   84 and name   HB) 2.994 1.121 1.121 weight 1.000 ! spec=13C_NOESY, no=554, id=1425, vol=9.610254e+05
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   84 and name HG13) 2.241 0.628 0.628 weight 1.000 ! spec=13C_NOESY, no=557, id=1428, vol=5.657208e+06
    or (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   84 and name HG11)
    or (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   84 and name HG12)
assign (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   88 and name   HB) 2.570 0.825 0.825 weight 1.000 ! spec=13C_NOESY, no=558, id=1429, vol=1.670352e+06
assign (segid "   A" and resid   21 and name   HB) (segid "   A" and resid   21 and name   HN) 2.554 0.815 0.815 weight 1.000 ! spec=13C_NOESY, no=562, id=1433, vol=2.486783e+06
assign (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   22 and name HG21) 1.890 0.446 0.446 weight 1.000 ! spec=13C_NOESY, no=564, id=1435, vol=1.598049e+07
    or (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   22 and name HG23)
    or (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   22 and name HG22)
assign (segid "   A" and resid   23 and name   HB) (segid "   A" and resid   11 and name  HE2) 2.484 0.771 0.771 weight 1.000 ! spec=13C_NOESY, no=567, id=1438, vol=3.008906e+06
    or (segid "   A" and resid   23 and name   HB) (segid "   A" and resid   11 and name  HE1)
assign (segid "   A" and resid   23 and name   HB) (segid "   A" and resid   23 and name   HA) 2.965 1.099 1.099 weight 1.000 ! spec=13C_NOESY, no=568, id=1439, vol=9.180605e+05
assign (segid "   A" and resid   23 and name HG23) (segid "   A" and resid   23 and name   HB) 2.072 0.536 0.536 weight 1.000 ! spec=13C_NOESY, no=569, id=1440, vol=7.955453e+06
    or (segid "   A" and resid   23 and name HG21) (segid "   A" and resid   23 and name   HB)
    or (segid "   A" and resid   23 and name HG22) (segid "   A" and resid   23 and name   HB)
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name HG11) 2.049 0.525 0.525 weight 1.000 ! spec=13C_NOESY, no=570, id=1441, vol=1.002323e+07
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name HG12)
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name HG13)
assign (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   22 and name   HN) 2.343 0.686 0.686 weight 1.000 ! spec=13C_NOESY, no=571, id=1442, vol=4.109487e+06
assign (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   50 and name  HB3) 2.025 0.512 0.512 weight 1.000 ! spec=13C_NOESY, no=573, id=1444, vol=7.646131e+06
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   50 and name  HB2)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   50 and name  HB3)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   50 and name  HB2)
    or (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   50 and name  HB3)
    or (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   50 and name  HB2)
assign (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   77 and name   HG) 2.278 0.648 0.648 weight 1.000 ! spec=13C_NOESY, no=574, id=1445, vol=4.344798e+06
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   77 and name   HG)
    or (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   77 and name   HG)
assign (segid "   A" and resid   21 and name   HB) (segid "   A" and resid   21 and name   HA) 2.822 0.996 0.996 weight 1.000 ! spec=13C_NOESY, no=579, id=1450, vol=1.385036e+06
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name   HA) 2.584 0.834 0.834 weight 1.000 ! spec=13C_NOESY, no=582, id=1453, vol=2.306633e+06
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name HG13) 2.162 0.584 0.584 weight 1.000 ! spec=13C_NOESY, no=584, id=1455, vol=6.671675e+06
    or (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name HG11)
    or (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name HG12)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name   HA) 2.308 0.666 0.666 weight 1.000 ! spec=13C_NOESY, no=585, id=1456, vol=4.523938e+06
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   36 and name HD11) 2.923 1.068 1.068 weight 1.000 ! spec=13C_NOESY, no=587, id=1458, vol=1.247965e+06
    or (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   36 and name HD13)
    or (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   36 and name HD12)
assign (segid "   A" and resid   39 and name  HE3) (segid "   A" and resid   39 and name  HB2) 2.469 0.762 0.762 weight 1.000 ! spec=13C_NOESY, no=592, id=1463, vol=2.294003e+06
    or (segid "   A" and resid   39 and name  HE1) (segid "   A" and resid   39 and name  HB2)
    or (segid "   A" and resid   39 and name  HE2) (segid "   A" and resid   39 and name  HB2)
assign (segid "   A" and resid   39 and name  HE3) (segid "   A" and resid   40 and name   HB) 2.061 0.531 0.531 weight 1.000 ! spec=13C_NOESY, no=594, id=1465, vol=4.705786e+06
    or (segid "   A" and resid   39 and name  HE1) (segid "   A" and resid   40 and name   HB)
    or (segid "   A" and resid   39 and name  HE2) (segid "   A" and resid   40 and name   HB)
assign (segid "   A" and resid   39 and name  HE3) (segid "   A" and resid   40 and name HD13) 1.912 0.457 0.457 weight 1.000 ! spec=13C_NOESY, no=596, id=1467, vol=1.346315e+07
    or (segid "   A" and resid   39 and name  HE3) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   39 and name  HE3) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   39 and name  HE1) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   39 and name  HE1) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   39 and name  HE1) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   39 and name  HE2) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   39 and name  HE2) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   39 and name  HE2) (segid "   A" and resid   40 and name HD12)
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   35 and name   HN) 2.531 0.801 0.801 weight 1.000 ! spec=13C_NOESY, no=602, id=1473, vol=2.522653e+06
assign (segid "   A" and resid    1 and name  HE2) (segid "   A" and resid    1 and name   HA) 2.686 0.902 0.902 weight 1.000 ! spec=13C_NOESY, no=608, id=1479, vol=1.709659e+06
    or (segid "   A" and resid    1 and name  HE3) (segid "   A" and resid    1 and name   HA)
    or (segid "   A" and resid    1 and name  HE1) (segid "   A" and resid    1 and name   HA)
assign (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   72 and name   HN) 2.727 0.930 0.930 weight 1.000 ! spec=13C_NOESY, no=612, id=1483, vol=1.543138e+06
assign (segid "   A" and resid   39 and name  HE3) (segid "   A" and resid   90 and name   HN) 2.940 1.080 1.080 weight 1.000 ! spec=13C_NOESY, no=621, id=1492, vol=8.873665e+05
    or (segid "   A" and resid   39 and name  HE1) (segid "   A" and resid   90 and name   HN)
    or (segid "   A" and resid   39 and name  HE2) (segid "   A" and resid   90 and name   HN)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name  HE3) 2.425 0.735 0.735 weight 1.000 ! spec=13C_NOESY, no=623, id=1494, vol=2.905307e+06
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name  HE1)
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name  HE2)
assign (segid "   A" and resid   67 and name HD21) (segid "   A" and resid   69 and name HG11) 2.388 0.713 0.713 weight 1.000 ! spec=13C_NOESY, no=627, id=1498, vol=3.313569e+06
    or (segid "   A" and resid   67 and name HD21) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   67 and name HD21) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid   67 and name HD22) (segid "   A" and resid   69 and name HG11) 2.541 0.807 0.807 weight 1.000 ! spec=13C_NOESY, no=629, id=1500, vol=2.299014e+06
    or (segid "   A" and resid   67 and name HD22) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   67 and name HD22) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   99 and name HD11) 2.803 0.982 0.982 weight 1.000 ! spec=13C_NOESY, no=631, id=1502, vol=1.241156e+06
    or (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   99 and name HD12)
    or (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   99 and name HD13)
assign (segid "   A" and resid   99 and name HD11) (segid "   A" and resid   98 and name   HN) 2.893 1.046 1.046 weight 1.000 ! spec=13C_NOESY, no=632, id=1503, vol=1.099016e+06
    or (segid "   A" and resid   99 and name HD12) (segid "   A" and resid   98 and name   HN)
    or (segid "   A" and resid   99 and name HD13) (segid "   A" and resid   98 and name   HN)
assign (segid "   A" and resid   99 and name HD11) (segid "   A" and resid   47 and name  HE1) 2.878 1.035 1.035 weight 1.000 ! spec=13C_NOESY, no=634, id=1505, vol=1.019840e+06
    or (segid "   A" and resid   99 and name HD11) (segid "   A" and resid   47 and name  HE2)
    or (segid "   A" and resid   99 and name HD12) (segid "   A" and resid   47 and name  HE1)
    or (segid "   A" and resid   99 and name HD12) (segid "   A" and resid   47 and name  HE2)
    or (segid "   A" and resid   99 and name HD13) (segid "   A" and resid   47 and name  HE1)
    or (segid "   A" and resid   99 and name HD13) (segid "   A" and resid   47 and name  HE2)
assign (segid "   A" and resid    2 and name HG11) (segid "   A" and resid    2 and name   HA) 2.116 0.560 0.560 weight 1.000 ! spec=13C_NOESY, no=639, id=1510, vol=7.935143e+06
    or (segid "   A" and resid    2 and name HG13) (segid "   A" and resid    2 and name   HA)
    or (segid "   A" and resid    2 and name HG12) (segid "   A" and resid    2 and name   HA)
assign (segid "   A" and resid    2 and name   HA) (segid "   A" and resid   52 and name  HB2) 2.678 0.897 0.897 weight 1.000 ! spec=13C_NOESY, no=640, id=1511, vol=1.722477e+06
assign (segid "   A" and resid    2 and name   HA) (segid "   A" and resid   53 and name   HA) 3.102 1.203 1.203 weight 1.000 ! spec=13C_NOESY, no=641, id=1512, vol=7.699002e+05
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name   HA) 2.045 0.523 0.523 weight 1.000 ! spec=13C_NOESY, no=642, id=1513, vol=9.351830e+06
assign (segid "   A" and resid   69 and name HG22) (segid "   A" and resid   25 and name  HB2) 2.600 0.845 0.845 weight 1.000 ! spec=13C_NOESY, no=644, id=1515, vol=2.016260e+06
    or (segid "   A" and resid   69 and name HG21) (segid "   A" and resid   25 and name  HB2)
    or (segid "   A" and resid   69 and name HG23) (segid "   A" and resid   25 and name  HB2)
assign (segid "   A" and resid    2 and name HG11) (segid "   A" and resid   24 and name  HB1) 2.192 0.601 0.601 weight 1.000 ! spec=13C_NOESY, no=646, id=1517, vol=6.111472e+06
    or (segid "   A" and resid    2 and name HG11) (segid "   A" and resid   24 and name  HB3)
    or (segid "   A" and resid    2 and name HG11) (segid "   A" and resid   24 and name  HB2)
    or (segid "   A" and resid    2 and name HG13) (segid "   A" and resid   24 and name  HB1)
    or (segid "   A" and resid    2 and name HG13) (segid "   A" and resid   24 and name  HB3)
    or (segid "   A" and resid    2 and name HG13) (segid "   A" and resid   24 and name  HB2)
    or (segid "   A" and resid    2 and name HG12) (segid "   A" and resid   24 and name  HB1)
    or (segid "   A" and resid    2 and name HG12) (segid "   A" and resid   24 and name  HB3)
    or (segid "   A" and resid    2 and name HG12) (segid "   A" and resid   24 and name  HB2)
assign (segid "   A" and resid   88 and name HG22) (segid "   A" and resid   87 and name   HA) 2.682 0.899 0.899 weight 1.000 ! spec=13C_NOESY, no=647, id=1518, vol=1.502738e+06
    or (segid "   A" and resid   88 and name HG21) (segid "   A" and resid   87 and name   HA)
    or (segid "   A" and resid   88 and name HG23) (segid "   A" and resid   87 and name   HA)
assign (segid "   A" and resid    2 and name HG21) (segid "   A" and resid    3 and name   HN) 2.813 0.989 0.989 weight 1.000 ! spec=13C_NOESY, no=648, id=1519, vol=1.299925e+06
    or (segid "   A" and resid    2 and name HG23) (segid "   A" and resid    3 and name   HN)
    or (segid "   A" and resid    2 and name HG22) (segid "   A" and resid    3 and name   HN)
assign (segid "   A" and resid   63 and name HG11) (segid "   A" and resid    8 and name   HN) 2.662 0.886 0.886 weight 1.000 ! spec=13C_NOESY, no=650, id=1521, vol=1.856364e+06
    or (segid "   A" and resid   63 and name HG13) (segid "   A" and resid    8 and name   HN)
    or (segid "   A" and resid   63 and name HG12) (segid "   A" and resid    8 and name   HN)
assign (segid "   A" and resid    3 and name   HA) (segid "   A" and resid    3 and name HG23) 2.151 0.578 0.578 weight 1.000 ! spec=13C_NOESY, no=651, id=1522, vol=6.602902e+06
    or (segid "   A" and resid    3 and name   HA) (segid "   A" and resid    3 and name HG22)
    or (segid "   A" and resid    3 and name   HA) (segid "   A" and resid    3 and name HG21)
assign (segid "   A" and resid    3 and name   HA) (segid "   A" and resid    4 and name  HB2) 2.989 1.117 1.117 weight 1.000 ! spec=13C_NOESY, no=652, id=1523, vol=7.039742e+05
assign (segid "   A" and resid    3 and name   HA) (segid "   A" and resid    3 and name   HN) 2.591 0.839 0.839 weight 1.000 ! spec=13C_NOESY, no=654, id=1525, vol=2.218889e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name   HA) 2.018 0.509 0.509 weight 1.000 ! spec=13C_NOESY, no=655, id=1526, vol=9.542972e+06
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name   HB) 2.353 0.692 0.692 weight 1.000 ! spec=13C_NOESY, no=656, id=1527, vol=3.944359e+06
assign (segid "   A" and resid    3 and name   HB) (segid "   A" and resid   53 and name  HE2) 2.649 0.877 0.877 weight 1.000 ! spec=13C_NOESY, no=657, id=1528, vol=1.962328e+06
    or (segid "   A" and resid    3 and name   HB) (segid "   A" and resid   53 and name  HE1)
assign (segid "   A" and resid    3 and name   HB) (segid "   A" and resid   53 and name  HD2) 2.426 0.736 0.736 weight 1.000 ! spec=13C_NOESY, no=658, id=1529, vol=3.296424e+06
    or (segid "   A" and resid    3 and name   HB) (segid "   A" and resid   53 and name  HD1)
assign (segid "   A" and resid    3 and name   HB) (segid "   A" and resid   53 and name   HA) 2.939 1.079 1.079 weight 1.000 ! spec=13C_NOESY, no=659, id=1530, vol=1.008374e+06
assign (segid "   A" and resid    3 and name   HB) (segid "   A" and resid    3 and name HG23) 2.112 0.557 0.557 weight 1.000 ! spec=13C_NOESY, no=661, id=1532, vol=7.483338e+06
    or (segid "   A" and resid    3 and name   HB) (segid "   A" and resid    3 and name HG22)
    or (segid "   A" and resid    3 and name   HB) (segid "   A" and resid    3 and name HG21)
assign (segid "   A" and resid    4 and name  HB2) (segid "   A" and resid    4 and name   HA) 2.458 0.755 0.755 weight 1.000 ! spec=13C_NOESY, no=662, id=1533, vol=3.428748e+06
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name   HA) 2.091 0.546 0.546 weight 1.000 ! spec=13C_NOESY, no=663, id=1534, vol=8.166466e+06
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name   HN) 2.757 0.950 0.950 weight 1.000 ! spec=13C_NOESY, no=664, id=1535, vol=1.442730e+06
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name  HD1) 2.168 0.588 0.588 weight 1.000 ! spec=13C_NOESY, no=665, id=1536, vol=6.626976e+06
    or (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name  HD2)
assign (segid "   A" and resid    3 and name   HA) (segid "   A" and resid   53 and name   HA) 3.317 1.375 1.375 weight 1.000 ! spec=13C_NOESY, no=667, id=1538, vol=3.714402e+05
assign (segid "   A" and resid   69 and name HG22) (segid "   A" and resid   69 and name HG11) 1.992 0.496 0.496 weight 1.000 ! spec=13C_NOESY, no=668, id=1539, vol=9.844686e+06
    or (segid "   A" and resid   69 and name HG22) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   69 and name HG22) (segid "   A" and resid   69 and name HG13)
    or (segid "   A" and resid   69 and name HG21) (segid "   A" and resid   69 and name HG11)
    or (segid "   A" and resid   69 and name HG21) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   69 and name HG21) (segid "   A" and resid   69 and name HG13)
    or (segid "   A" and resid   69 and name HG23) (segid "   A" and resid   69 and name HG11)
    or (segid "   A" and resid   69 and name HG23) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   69 and name HG23) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    2 and name   HB) 2.935 1.077 1.077 weight 1.000 ! spec=13C_NOESY, no=670, id=1541, vol=1.135323e+06
assign (segid "   A" and resid    2 and name HG21) (segid "   A" and resid   52 and name  HB1) 2.489 0.775 0.775 weight 1.000 ! spec=13C_NOESY, no=672, id=1543, vol=2.553646e+06
    or (segid "   A" and resid    2 and name HG23) (segid "   A" and resid   52 and name  HB1)
    or (segid "   A" and resid    2 and name HG22) (segid "   A" and resid   52 and name  HB1)
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid   10 and name  HG1) 2.999 1.124 1.124 weight 1.000 ! spec=13C_NOESY, no=678, id=1549, vol=9.291896e+05
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    7 and name   HN) 2.690 0.904 0.904 weight 1.000 ! spec=13C_NOESY, no=686, id=1557, vol=1.792739e+06
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name   HB) 2.241 0.628 0.628 weight 1.000 ! spec=13C_NOESY, no=688, id=1559, vol=5.074397e+06
assign (segid "   A" and resid    7 and name   HB) (segid "   A" and resid    9 and name   HN) 3.021 1.141 1.141 weight 1.000 ! spec=13C_NOESY, no=689, id=1560, vol=8.874828e+05
assign (segid "   A" and resid    7 and name   HB) (segid "   A" and resid    7 and name HG22) 1.990 0.495 0.495 weight 1.000 ! spec=13C_NOESY, no=694, id=1565, vol=1.044111e+07
    or (segid "   A" and resid    7 and name   HB) (segid "   A" and resid    7 and name HG23)
    or (segid "   A" and resid    7 and name   HB) (segid "   A" and resid    7 and name HG21)
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid   11 and name   HN) 2.458 0.755 0.755 weight 1.000 ! spec=13C_NOESY, no=697, id=1568, vol=3.173915e+06
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name   HA) 2.425 0.735 0.735 weight 1.000 ! spec=13C_NOESY, no=699, id=1570, vol=3.125659e+06
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid   11 and name   HN) 3.004 1.128 1.128 weight 1.000 ! spec=13C_NOESY, no=701, id=1572, vol=7.859448e+05
    or (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid   11 and name   HN)
    or (segid "   A" and resid    8 and name  HB3) (segid "   A" and resid   11 and name   HN)
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid    5 and name  HD1) 3.047 1.160 1.160 weight 1.000 ! spec=13C_NOESY, no=703, id=1574, vol=7.862854e+05
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid    5 and name  HD2)
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name HD11) 3.124 1.220 1.220 weight 1.000 ! spec=13C_NOESY, no=706, id=1577, vol=6.076159e+05
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name HD13)
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name HD12)
assign (segid "   A" and resid   15 and name HG11) (segid "   A" and resid   12 and name   HA) 2.179 0.593 0.593 weight 1.000 ! spec=13C_NOESY, no=707, id=1578, vol=6.325720e+06
assign (segid "   A" and resid   69 and name HG22) (segid "   A" and resid   25 and name  HB1) 2.777 0.964 0.964 weight 1.000 ! spec=13C_NOESY, no=709, id=1580, vol=1.531919e+06
    or (segid "   A" and resid   69 and name HG21) (segid "   A" and resid   25 and name  HB1)
    or (segid "   A" and resid   69 and name HG23) (segid "   A" and resid   25 and name  HB1)
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   16 and name  HB3) 2.312 0.668 0.668 weight 1.000 ! spec=13C_NOESY, no=710, id=1581, vol=4.165437e+06
    or (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   16 and name  HB1)
    or (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   16 and name  HB2)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   13 and name   HA) 2.917 1.064 1.064 weight 1.000 ! spec=13C_NOESY, no=711, id=1582, vol=1.020750e+06
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name   HA) 2.197 0.604 0.604 weight 1.000 ! spec=13C_NOESY, no=712, id=1583, vol=5.766327e+06
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HB1) 2.132 0.568 0.568 weight 1.000 ! spec=13C_NOESY, no=713, id=1584, vol=6.977865e+06
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name  HB2) 2.033 0.516 0.516 weight 1.000 ! spec=13C_NOESY, no=716, id=1587, vol=8.832644e+06
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name  HB3)
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name  HB2) 2.334 0.681 0.681 weight 1.000 ! spec=13C_NOESY, no=717, id=1588, vol=3.983900e+06
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name  HB3)
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid    5 and name  HE1) 2.097 0.550 0.550 weight 1.000 ! spec=13C_NOESY, no=718, id=1589, vol=7.453984e+06
    or (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid    5 and name  HE2)
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid    5 and name  HE1)
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid    5 and name  HE2)
    or (segid "   A" and resid   14 and name  HB3) (segid "   A" and resid    5 and name  HE1)
    or (segid "   A" and resid   14 and name  HB3) (segid "   A" and resid    5 and name  HE2)
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid    5 and name   HZ) 2.146 0.576 0.576 weight 1.000 ! spec=13C_NOESY, no=719, id=1590, vol=6.222922e+06
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid    5 and name   HZ)
    or (segid "   A" and resid   14 and name  HB3) (segid "   A" and resid    5 and name   HZ)
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   14 and name  HB2) 2.430 0.738 0.738 weight 1.000 ! spec=13C_NOESY, no=720, id=1591, vol=3.004753e+06
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   14 and name  HB3)
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   53 and name  HB1) 2.725 0.928 0.928 weight 1.000 ! spec=13C_NOESY, no=721, id=1592, vol=1.687733e+06
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   53 and name  HB1)
    or (segid "   A" and resid   14 and name  HB3) (segid "   A" and resid   53 and name  HB1)
assign (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   14 and name  HB2) 2.654 0.880 0.880 weight 1.000 ! spec=13C_NOESY, no=723, id=1594, vol=1.644715e+06
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   14 and name  HB3)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   14 and name  HB2)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   14 and name  HB3)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   14 and name  HB2)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   14 and name  HB3)
assign (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   15 and name   HA) 2.065 0.533 0.533 weight 1.000 ! spec=13C_NOESY, no=724, id=1595, vol=8.232229e+06
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   15 and name   HA)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   15 and name   HA)
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   15 and name HG23) 2.895 1.047 1.047 weight 1.000 ! spec=13C_NOESY, no=725, id=1596, vol=9.028585e+05
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   15 and name HG22)
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   21 and name HG23) 2.236 0.625 0.625 weight 1.000 ! spec=13C_NOESY, no=726, id=1597, vol=6.010810e+06
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   21 and name HG21)
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   21 and name HG22)
assign (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   15 and name HG23) 2.105 0.554 0.554 weight 1.000 ! spec=13C_NOESY, no=727, id=1598, vol=7.138312e+06
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   15 and name HG22)
assign (segid "   A" and resid   15 and name HG12) (segid "   A" and resid   15 and name HG23) 1.952 0.476 0.476 weight 1.000 ! spec=13C_NOESY, no=728, id=1599, vol=1.203187e+07
    or (segid "   A" and resid   15 and name HG12) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   15 and name HG12) (segid "   A" and resid   15 and name HG22)
assign (segid "   A" and resid   15 and name   HB) (segid "   A" and resid   15 and name HG23) 2.163 0.585 0.585 weight 1.000 ! spec=13C_NOESY, no=729, id=1600, vol=6.136682e+06
    or (segid "   A" and resid   15 and name   HB) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   15 and name   HB) (segid "   A" and resid   15 and name HG22)
assign (segid "   A" and resid   15 and name HG23) (segid "   A" and resid   16 and name  HB3) 2.924 1.068 1.068 weight 1.000 ! spec=13C_NOESY, no=730, id=1601, vol=1.012108e+06
    or (segid "   A" and resid   15 and name HG23) (segid "   A" and resid   16 and name  HB1)
    or (segid "   A" and resid   15 and name HG23) (segid "   A" and resid   16 and name  HB2)
    or (segid "   A" and resid   15 and name HG21) (segid "   A" and resid   16 and name  HB3)
    or (segid "   A" and resid   15 and name HG21) (segid "   A" and resid   16 and name  HB1)
    or (segid "   A" and resid   15 and name HG21) (segid "   A" and resid   16 and name  HB2)
    or (segid "   A" and resid   15 and name HG22) (segid "   A" and resid   16 and name  HB3)
    or (segid "   A" and resid   15 and name HG22) (segid "   A" and resid   16 and name  HB1)
    or (segid "   A" and resid   15 and name HG22) (segid "   A" and resid   16 and name  HB2)
assign (segid "   A" and resid   15 and name HG23) (segid "   A" and resid   78 and name  HB1) 2.981 1.111 1.111 weight 1.000 ! spec=13C_NOESY, no=731, id=1602, vol=8.982266e+05
    or (segid "   A" and resid   15 and name HG21) (segid "   A" and resid   78 and name  HB1)
    or (segid "   A" and resid   15 and name HG22) (segid "   A" and resid   78 and name  HB1)
assign (segid "   A" and resid   15 and name HG23) (segid "   A" and resid   81 and name  HA1) 2.725 0.929 0.929 weight 1.000 ! spec=13C_NOESY, no=732, id=1603, vol=1.432772e+06
    or (segid "   A" and resid   15 and name HG21) (segid "   A" and resid   81 and name  HA1)
    or (segid "   A" and resid   15 and name HG22) (segid "   A" and resid   81 and name  HA1)
assign (segid "   A" and resid   15 and name HG23) (segid "   A" and resid   81 and name  HA2) 2.859 1.022 1.022 weight 1.000 ! spec=13C_NOESY, no=733, id=1604, vol=1.183832e+06
    or (segid "   A" and resid   15 and name HG21) (segid "   A" and resid   81 and name  HA2)
    or (segid "   A" and resid   15 and name HG22) (segid "   A" and resid   81 and name  HA2)
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name HG23) 2.638 0.870 0.870 weight 1.000 ! spec=13C_NOESY, no=734, id=1605, vol=1.932384e+06
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name HG22)
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   81 and name  HA1) 2.457 0.755 0.755 weight 1.000 ! spec=13C_NOESY, no=737, id=1608, vol=2.910198e+06
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   80 and name   HA) 2.570 0.826 0.826 weight 1.000 ! spec=13C_NOESY, no=738, id=1609, vol=1.979186e+06
assign (segid "   A" and resid   16 and name  HB3) (segid "   A" and resid   81 and name  HA1) 2.913 1.061 1.061 weight 1.000 ! spec=13C_NOESY, no=740, id=1611, vol=1.093617e+06
    or (segid "   A" and resid   16 and name  HB1) (segid "   A" and resid   81 and name  HA1)
    or (segid "   A" and resid   16 and name  HB2) (segid "   A" and resid   81 and name  HA1)
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   17 and name   HN) 2.402 0.721 0.721 weight 1.000 ! spec=13C_NOESY, no=742, id=1613, vol=3.370241e+06
assign (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   20 and name   HN) 2.763 0.955 0.955 weight 1.000 ! spec=13C_NOESY, no=744, id=1615, vol=1.521931e+06
assign (segid "   A" and resid   20 and name  HB1) (segid "   A" and resid   20 and name   HN) 2.663 0.886 0.886 weight 1.000 ! spec=13C_NOESY, no=746, id=1617, vol=1.934916e+06
assign (segid "   A" and resid   20 and name HD22) (segid "   A" and resid   77 and name   HA) 2.939 1.080 1.080 weight 1.000 ! spec=13C_NOESY, no=747, id=1618, vol=9.653332e+05
    or (segid "   A" and resid   20 and name HD21) (segid "   A" and resid   77 and name   HA)
    or (segid "   A" and resid   20 and name HD23) (segid "   A" and resid   77 and name   HA)
assign (segid "   A" and resid   20 and name HD22) (segid "   A" and resid   21 and name   HN) 2.315 0.670 0.670 weight 1.000 ! spec=13C_NOESY, no=748, id=1619, vol=4.084037e+06
    or (segid "   A" and resid   20 and name HD21) (segid "   A" and resid   21 and name   HN)
    or (segid "   A" and resid   20 and name HD23) (segid "   A" and resid   21 and name   HN)
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   20 and name HD22) 2.741 0.939 0.939 weight 1.000 ! spec=13C_NOESY, no=749, id=1620, vol=1.379668e+06
    or (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   20 and name HD21)
    or (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   20 and name HD23)
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   23 and name   HB) 3.043 1.157 1.157 weight 1.000 ! spec=13C_NOESY, no=753, id=1624, vol=8.631772e+05
assign (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   23 and name HG23) 2.435 0.741 0.741 weight 1.000 ! spec=13C_NOESY, no=754, id=1625, vol=2.936257e+06
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   23 and name HG21)
    or (segid "   A" and resid   15 and name HD11) (segid "   A" and resid   23 and name HG22)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   23 and name HG23)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   23 and name HG21)
    or (segid "   A" and resid   15 and name HD13) (segid "   A" and resid   23 and name HG22)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   23 and name HG23)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   23 and name HG21)
    or (segid "   A" and resid   15 and name HD12) (segid "   A" and resid   23 and name HG22)
assign (segid "   A" and resid   23 and name HG23) (segid "   A" and resid   53 and name  HD2) 2.774 0.962 0.962 weight 1.000 ! spec=13C_NOESY, no=755, id=1626, vol=1.187909e+06
    or (segid "   A" and resid   23 and name HG23) (segid "   A" and resid   53 and name  HD1)
    or (segid "   A" and resid   23 and name HG21) (segid "   A" and resid   53 and name  HD2)
    or (segid "   A" and resid   23 and name HG21) (segid "   A" and resid   53 and name  HD1)
    or (segid "   A" and resid   23 and name HG22) (segid "   A" and resid   53 and name  HD2)
    or (segid "   A" and resid   23 and name HG22) (segid "   A" and resid   53 and name  HD1)
assign (segid "   A" and resid   23 and name HG23) (segid "   A" and resid   11 and name  HE2) 2.384 0.710 0.710 weight 1.000 ! spec=13C_NOESY, no=756, id=1627, vol=3.437042e+06
    or (segid "   A" and resid   23 and name HG23) (segid "   A" and resid   11 and name  HE1)
    or (segid "   A" and resid   23 and name HG21) (segid "   A" and resid   11 and name  HE2)
    or (segid "   A" and resid   23 and name HG21) (segid "   A" and resid   11 and name  HE1)
    or (segid "   A" and resid   23 and name HG22) (segid "   A" and resid   11 and name  HE2)
    or (segid "   A" and resid   23 and name HG22) (segid "   A" and resid   11 and name  HE1)
assign (segid "   A" and resid   23 and name HG23) (segid "   A" and resid   24 and name   HN) 2.799 0.979 0.979 weight 1.000 ! spec=13C_NOESY, no=758, id=1629, vol=1.250776e+06
    or (segid "   A" and resid   23 and name HG21) (segid "   A" and resid   24 and name   HN)
    or (segid "   A" and resid   23 and name HG22) (segid "   A" and resid   24 and name   HN)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name HG23) 2.410 0.726 0.726 weight 1.000 ! spec=13C_NOESY, no=759, id=1630, vol=2.958314e+06
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name HG21)
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name HG22)
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   75 and name   HG) 2.591 0.839 0.839 weight 1.000 ! spec=13C_NOESY, no=762, id=1633, vol=2.267925e+06
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name  HB1) 2.687 0.902 0.902 weight 1.000 ! spec=13C_NOESY, no=763, id=1634, vol=1.605702e+06
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name  HB3)
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name  HB2)
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   25 and name   HN) 2.833 1.003 1.003 weight 1.000 ! spec=13C_NOESY, no=764, id=1635, vol=1.206622e+06
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name   HA) 2.112 0.557 0.557 weight 1.000 ! spec=13C_NOESY, no=765, id=1636, vol=7.855277e+06
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   55 and name  HB1) 2.704 0.914 0.914 weight 1.000 ! spec=13C_NOESY, no=768, id=1639, vol=1.770779e+06
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   74 and name HG23) 2.917 1.064 1.064 weight 1.000 ! spec=13C_NOESY, no=769, id=1640, vol=1.118397e+06
    or (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   74 and name HG22)
    or (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   74 and name HG21)
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   26 and name   HA) 2.776 0.964 0.964 weight 1.000 ! spec=13C_NOESY, no=771, id=1642, vol=1.342426e+06
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name   HA) 2.284 0.652 0.652 weight 1.000 ! spec=13C_NOESY, no=772, id=1643, vol=4.839583e+06
assign (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   78 and name  HD2) 2.924 1.069 1.069 weight 1.000 ! spec=13C_NOESY, no=774, id=1645, vol=1.204678e+06
    or (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   78 and name  HD1)
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   57 and name   HN) 2.951 1.088 1.088 weight 1.000 ! spec=13C_NOESY, no=776, id=1647, vol=1.050984e+06
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name   HA) 2.865 1.026 1.026 weight 1.000 ! spec=13C_NOESY, no=777, id=1648, vol=1.109473e+06
assign (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   26 and name  HD2) 3.090 1.193 1.193 weight 1.000 ! spec=13C_NOESY, no=781, id=1652, vol=7.061804e+05
    or (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   26 and name  HD1)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name   HB) 2.742 0.940 0.940 weight 1.000 ! spec=13C_NOESY, no=782, id=1653, vol=1.541415e+06
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name   HB) 2.955 1.091 1.091 weight 1.000 ! spec=13C_NOESY, no=783, id=1654, vol=9.744119e+05
assign (segid "   A" and resid   28 and name   HB) (segid "   A" and resid   28 and name   HA) 2.092 0.547 0.547 weight 1.000 ! spec=13C_NOESY, no=785, id=1656, vol=7.545955e+06
assign (segid "   A" and resid   28 and name   HB) (segid "   A" and resid   28 and name HG21) 1.964 0.482 0.482 weight 1.000 ! spec=13C_NOESY, no=786, id=1657, vol=1.105133e+07
    or (segid "   A" and resid   28 and name   HB) (segid "   A" and resid   28 and name HG22)
    or (segid "   A" and resid   28 and name   HB) (segid "   A" and resid   28 and name HG23)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name HG21) 2.495 0.778 0.778 weight 1.000 ! spec=13C_NOESY, no=787, id=1658, vol=2.572078e+06
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name HG22)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name HG23)
assign (segid "   A" and resid   28 and name HG21) (segid "   A" and resid   26 and name  HE2) 2.567 0.824 0.824 weight 1.000 ! spec=13C_NOESY, no=788, id=1659, vol=2.138694e+06
    or (segid "   A" and resid   28 and name HG21) (segid "   A" and resid   26 and name  HE1)
    or (segid "   A" and resid   28 and name HG22) (segid "   A" and resid   26 and name  HE2)
    or (segid "   A" and resid   28 and name HG22) (segid "   A" and resid   26 and name  HE1)
    or (segid "   A" and resid   28 and name HG23) (segid "   A" and resid   26 and name  HE2)
    or (segid "   A" and resid   28 and name HG23) (segid "   A" and resid   26 and name  HE1)
assign (segid "   A" and resid   28 and name HG21) (segid "   A" and resid   56 and name  HB1) 2.923 1.068 1.068 weight 1.000 ! spec=13C_NOESY, no=792, id=1663, vol=8.310525e+05
    or (segid "   A" and resid   28 and name HG22) (segid "   A" and resid   56 and name  HB1)
    or (segid "   A" and resid   28 and name HG23) (segid "   A" and resid   56 and name  HB1)
assign (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   29 and name  HB1) 2.115 0.559 0.559 weight 1.000 ! spec=13C_NOESY, no=793, id=1664, vol=7.581351e+06
assign (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   29 and name   HA) 2.519 0.793 0.793 weight 1.000 ! spec=13C_NOESY, no=794, id=1665, vol=2.674901e+06
assign (segid "   A" and resid   29 and name  HB1) (segid "   A" and resid   29 and name  HD1) 2.850 1.016 1.016 weight 1.000 ! spec=13C_NOESY, no=797, id=1668, vol=1.272124e+06
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   30 and name  HB2) 2.435 0.741 0.741 weight 1.000 ! spec=13C_NOESY, no=799, id=1670, vol=3.246689e+06
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   30 and name  HB1) 2.574 0.828 0.828 weight 1.000 ! spec=13C_NOESY, no=800, id=1671, vol=2.216054e+06
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name   HA) 2.739 0.938 0.938 weight 1.000 ! spec=13C_NOESY, no=802, id=1673, vol=1.593577e+06
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   29 and name  HZ3) 2.482 0.770 0.770 weight 1.000 ! spec=13C_NOESY, no=803, id=1674, vol=2.834763e+06
assign (segid "   A" and resid   35 and name  HE1) (segid "   A" and resid   39 and name  HB1) 2.480 0.769 0.769 weight 1.000 ! spec=13C_NOESY, no=809, id=1680, vol=5.955754e+05
    or (segid "   A" and resid   35 and name  HE3) (segid "   A" and resid   39 and name  HB1)
    or (segid "   A" and resid   35 and name  HE2) (segid "   A" and resid   39 and name  HB1)
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   39 and name  HB2) 2.791 0.974 0.974 weight 1.000 ! spec=13C_NOESY, no=812, id=1683, vol=1.324461e+06
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   36 and name   HA) 2.890 1.044 1.044 weight 1.000 ! spec=13C_NOESY, no=813, id=1684, vol=9.370268e+05
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name   HA) 2.486 0.773 0.773 weight 1.000 ! spec=13C_NOESY, no=814, id=1685, vol=2.650649e+06
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name   HA) 2.343 0.686 0.686 weight 1.000 ! spec=13C_NOESY, no=817, id=1688, vol=4.416167e+06
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   42 and name  HB1) 1.976 0.488 0.488 weight 1.000 ! spec=13C_NOESY, no=820, id=1691, vol=1.206016e+07
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name   HN) 2.492 0.776 0.776 weight 1.000 ! spec=13C_NOESY, no=823, id=1694, vol=2.757424e+06
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   40 and name   HA) 2.643 0.873 0.873 weight 1.000 ! spec=13C_NOESY, no=824, id=1695, vol=1.918603e+06
assign (segid "   A" and resid   40 and name   HB) (segid "   A" and resid   40 and name HD13) 2.011 0.505 0.505 weight 1.000 ! spec=13C_NOESY, no=825, id=1696, vol=9.090470e+06
    or (segid "   A" and resid   40 and name   HB) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   40 and name   HB) (segid "   A" and resid   40 and name HD12)
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   41 and name   HA) 2.778 0.965 0.965 weight 1.000 ! spec=13C_NOESY, no=827, id=1698, vol=1.421384e+06
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name   HA) 2.339 0.684 0.684 weight 1.000 ! spec=13C_NOESY, no=828, id=1699, vol=4.014637e+06
assign (segid "   A" and resid    2 and name HG21) (segid "   A" and resid   41 and name   HA) 2.052 0.526 0.526 weight 1.000 ! spec=13C_NOESY, no=829, id=1700, vol=8.936138e+06
    or (segid "   A" and resid    2 and name HG23) (segid "   A" and resid   41 and name   HA)
    or (segid "   A" and resid    2 and name HG22) (segid "   A" and resid   41 and name   HA)
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   46 and name   HA) 2.207 0.609 0.609 weight 1.000 ! spec=13C_NOESY, no=838, id=1709, vol=5.739295e+06
assign (segid "   A" and resid    6 and name  HB1) (segid "   A" and resid    6 and name   HN) 2.738 0.937 0.937 weight 1.000 ! spec=13C_NOESY, no=839, id=1710, vol=1.620383e+06
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   47 and name   HA) 2.888 1.043 1.043 weight 1.000 ! spec=13C_NOESY, no=843, id=1714, vol=1.146082e+06
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   47 and name   HA) 2.551 0.814 0.814 weight 1.000 ! spec=13C_NOESY, no=844, id=1715, vol=2.437219e+06
assign (segid "   A" and resid   48 and name  HB1) (segid "   A" and resid   48 and name   HA) 2.432 0.739 0.739 weight 1.000 ! spec=13C_NOESY, no=849, id=1720, vol=3.436950e+06
assign (segid "   A" and resid   48 and name  HB1) (segid "   A" and resid   44 and name  HB2) 3.027 1.145 1.145 weight 1.000 ! spec=13C_NOESY, no=850, id=1721, vol=8.380981e+05
assign (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   44 and name  HB2) 3.175 1.260 1.260 weight 1.000 ! spec=13C_NOESY, no=851, id=1722, vol=5.976552e+05
assign (segid "   A" and resid   49 and name   HA) (segid "   A" and resid   49 and name  HG1) 2.323 0.675 0.675 weight 1.000 ! spec=13C_NOESY, no=853, id=1724, vol=4.842544e+06
assign (segid "   A" and resid   49 and name  HB1) (segid "   A" and resid   49 and name   HN) 2.937 1.078 1.078 weight 1.000 ! spec=13C_NOESY, no=855, id=1726, vol=9.673669e+05
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   20 and name  HB1) 2.527 0.798 0.798 weight 1.000 ! spec=13C_NOESY, no=863, id=1734, vol=2.630198e+06
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   50 and name   HA) 2.002 0.501 0.501 weight 1.000 ! spec=13C_NOESY, no=865, id=1736, vol=1.027896e+07
assign (segid "   A" and resid   50 and name  HB3) (segid "   A" and resid   49 and name HE22) 2.270 0.644 0.644 weight 1.000 ! spec=13C_NOESY, no=868, id=1739, vol=4.525500e+06
    or (segid "   A" and resid   50 and name  HB1) (segid "   A" and resid   49 and name HE22)
    or (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   49 and name HE22)
assign (segid "   A" and resid   50 and name  HB3) (segid "   A" and resid   99 and name HG23) 2.193 0.601 0.601 weight 1.000 ! spec=13C_NOESY, no=871, id=1742, vol=5.584284e+06
    or (segid "   A" and resid   50 and name  HB3) (segid "   A" and resid   99 and name HG21)
    or (segid "   A" and resid   50 and name  HB3) (segid "   A" and resid   99 and name HG22)
    or (segid "   A" and resid   50 and name  HB1) (segid "   A" and resid   99 and name HG23)
    or (segid "   A" and resid   50 and name  HB1) (segid "   A" and resid   99 and name HG21)
    or (segid "   A" and resid   50 and name  HB1) (segid "   A" and resid   99 and name HG22)
    or (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   99 and name HG23)
    or (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   99 and name HG21)
    or (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   99 and name HG22)
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   51 and name   HA) 1.954 0.477 0.477 weight 1.000 ! spec=13C_NOESY, no=873, id=1744, vol=1.180210e+07
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   51 and name   HN) 2.458 0.755 0.755 weight 1.000 ! spec=13C_NOESY, no=874, id=1745, vol=3.168563e+06
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   50 and name  HB3) 2.954 1.091 1.091 weight 1.000 ! spec=13C_NOESY, no=878, id=1749, vol=1.042961e+06
    or (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   50 and name  HB2)
assign (segid "   A" and resid   51 and name  HB1) (segid "   A" and resid   14 and name  HB2) 2.762 0.954 0.954 weight 1.000 ! spec=13C_NOESY, no=879, id=1750, vol=1.606725e+06
    or (segid "   A" and resid   51 and name  HB1) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   51 and name  HB1) (segid "   A" and resid   14 and name  HB3)
assign (segid "   A" and resid   51 and name  HB1) (segid "   A" and resid   53 and name  HE2) 2.733 0.934 0.934 weight 1.000 ! spec=13C_NOESY, no=881, id=1752, vol=1.614867e+06
    or (segid "   A" and resid   51 and name  HB1) (segid "   A" and resid   53 and name  HE1)
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   51 and name  HB1) 2.807 0.985 0.985 weight 1.000 ! spec=13C_NOESY, no=882, id=1753, vol=1.436809e+06
assign (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   21 and name HG11) 2.931 1.074 1.074 weight 1.000 ! spec=13C_NOESY, no=883, id=1754, vol=1.007874e+06
    or (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   21 and name HG12)
    or (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   21 and name HG13)
assign (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   51 and name  HB1) 1.754 0.384 0.384 weight 1.000 ! spec=13C_NOESY, no=886, id=1757, vol=2.587359e+07
assign (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   51 and name   HN) 2.594 0.841 0.841 weight 1.000 ! spec=13C_NOESY, no=888, id=1759, vol=2.160327e+06
assign (segid "   A" and resid   52 and name   HA) (segid "   A" and resid    2 and name HG21) 2.742 0.940 0.940 weight 1.000 ! spec=13C_NOESY, no=889, id=1760, vol=1.670975e+06
    or (segid "   A" and resid   52 and name   HA) (segid "   A" and resid    2 and name HG23)
    or (segid "   A" and resid   52 and name   HA) (segid "   A" and resid    2 and name HG22)
assign (segid "   A" and resid   52 and name   HA) (segid "   A" and resid   53 and name  HD2) 3.087 1.192 1.192 weight 1.000 ! spec=13C_NOESY, no=892, id=1763, vol=7.202864e+05
    or (segid "   A" and resid   52 and name   HA) (segid "   A" and resid   53 and name  HD1)
assign (segid "   A" and resid   52 and name   HA) (segid "   A" and resid   53 and name   HN) 2.027 0.514 0.514 weight 1.000 ! spec=13C_NOESY, no=894, id=1765, vol=9.752437e+06
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name  HB1) 3.155 1.244 1.244 weight 1.000 ! spec=13C_NOESY, no=895, id=1766, vol=7.068649e+05
assign (segid "   A" and resid   52 and name  HB2) (segid "   A" and resid    2 and name HG21) 2.819 0.993 0.993 weight 1.000 ! spec=13C_NOESY, no=899, id=1770, vol=1.438570e+06
    or (segid "   A" and resid   52 and name  HB2) (segid "   A" and resid    2 and name HG23)
    or (segid "   A" and resid   52 and name  HB2) (segid "   A" and resid    2 and name HG22)
assign (segid "   A" and resid   52 and name  HB1) (segid "   A" and resid   52 and name  HB2) 2.210 0.610 0.610 weight 1.000 ! spec=13C_NOESY, no=900, id=1771, vol=6.270215e+06
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid   53 and name   HA) 2.346 0.688 0.688 weight 1.000 ! spec=13C_NOESY, no=903, id=1774, vol=3.856679e+06
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   53 and name   HA) 2.152 0.579 0.579 weight 1.000 ! spec=13C_NOESY, no=904, id=1775, vol=6.615821e+06
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name  HD2) 2.691 0.905 0.905 weight 1.000 ! spec=13C_NOESY, no=905, id=1776, vol=1.707173e+06
    or (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name  HD1)
assign (segid "   A" and resid    2 and name HG11) (segid "   A" and resid   53 and name   HA) 2.433 0.740 0.740 weight 1.000 ! spec=13C_NOESY, no=907, id=1778, vol=3.308389e+06
    or (segid "   A" and resid    2 and name HG13) (segid "   A" and resid   53 and name   HA)
    or (segid "   A" and resid    2 and name HG12) (segid "   A" and resid   53 and name   HA)
assign (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   23 and name HG23) 2.894 1.047 1.047 weight 1.000 ! spec=13C_NOESY, no=908, id=1779, vol=1.200435e+06
    or (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   23 and name HG21)
    or (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   23 and name HG22)
assign (segid "   A" and resid    2 and name HG11) (segid "   A" and resid   53 and name  HB2) 3.071 1.179 1.179 weight 1.000 ! spec=13C_NOESY, no=909, id=1780, vol=7.647475e+05
    or (segid "   A" and resid    2 and name HG13) (segid "   A" and resid   53 and name  HB2)
    or (segid "   A" and resid    2 and name HG12) (segid "   A" and resid   53 and name  HB2)
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name  HB1) 2.938 1.079 1.079 weight 1.000 ! spec=13C_NOESY, no=910, id=1781, vol=1.046280e+06
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name  HB2) 2.841 1.009 1.009 weight 1.000 ! spec=13C_NOESY, no=911, id=1782, vol=1.296966e+06
assign (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   53 and name  HD2) 2.679 0.897 0.897 weight 1.000 ! spec=13C_NOESY, no=913, id=1784, vol=1.852353e+06
    or (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   53 and name  HD1)
assign (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid    5 and name  HE1) 3.088 1.192 1.192 weight 1.000 ! spec=13C_NOESY, no=915, id=1786, vol=8.134132e+05
    or (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid    5 and name  HE2)
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   54 and name   HN) 3.002 1.127 1.127 weight 1.000 ! spec=13C_NOESY, no=916, id=1787, vol=9.610129e+05
assign (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   53 and name   HN) 3.154 1.244 1.244 weight 1.000 ! spec=13C_NOESY, no=918, id=1789, vol=7.191310e+05
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   23 and name HG23) 2.835 1.005 1.005 weight 1.000 ! spec=13C_NOESY, no=919, id=1790, vol=1.322048e+06
    or (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   23 and name HG21)
    or (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   23 and name HG22)
assign (segid "   A" and resid   55 and name HD21) (segid "   A" and resid   63 and name   HB) 2.763 0.954 0.954 weight 1.000 ! spec=13C_NOESY, no=923, id=1794, vol=1.548802e+06
    or (segid "   A" and resid   55 and name HD23) (segid "   A" and resid   63 and name   HB)
    or (segid "   A" and resid   55 and name HD22) (segid "   A" and resid   63 and name   HB)
assign (segid "   A" and resid   55 and name   HG) (segid "   A" and resid   60 and name   HN) 3.165 1.252 1.252 weight 1.000 ! spec=13C_NOESY, no=926, id=1797, vol=6.956066e+05
assign (segid "   A" and resid   55 and name HD21) (segid "   A" and resid   55 and name   HG) 1.858 0.432 0.432 weight 1.000 ! spec=13C_NOESY, no=929, id=1800, vol=1.744772e+07
    or (segid "   A" and resid   55 and name HD23) (segid "   A" and resid   55 and name   HG)
    or (segid "   A" and resid   55 and name HD22) (segid "   A" and resid   55 and name   HG)
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   56 and name   HA) 2.166 0.586 0.586 weight 1.000 ! spec=13C_NOESY, no=930, id=1801, vol=6.900411e+06
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   57 and name HG13) 2.826 0.998 0.998 weight 1.000 ! spec=13C_NOESY, no=931, id=1802, vol=1.311160e+06
    or (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   57 and name HG11)
    or (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   57 and name HG12)
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   57 and name   HA) 2.723 0.927 0.927 weight 1.000 ! spec=13C_NOESY, no=932, id=1803, vol=1.678171e+06
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   64 and name   HN) 2.957 1.093 1.093 weight 1.000 ! spec=13C_NOESY, no=933, id=1804, vol=1.057724e+06
assign (segid "   A" and resid   55 and name HD21) (segid "   A" and resid   57 and name   HA) 2.282 0.651 0.651 weight 1.000 ! spec=13C_NOESY, no=934, id=1805, vol=4.839308e+06
    or (segid "   A" and resid   55 and name HD23) (segid "   A" and resid   57 and name   HA)
    or (segid "   A" and resid   55 and name HD22) (segid "   A" and resid   57 and name   HA)
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   64 and name  HB1) 2.552 0.814 0.814 weight 1.000 ! spec=13C_NOESY, no=935, id=1806, vol=2.522587e+06
    or (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   64 and name  HB3)
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   67 and name  HB1) 1.973 0.487 0.487 weight 1.000 ! spec=13C_NOESY, no=936, id=1807, vol=1.176348e+07
assign (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   59 and name   HA) 2.370 0.702 0.702 weight 1.000 ! spec=13C_NOESY, no=937, id=1808, vol=4.409535e+06
assign (segid "   A" and resid   60 and name  HB1) (segid "   A" and resid   60 and name   HA) 2.080 0.541 0.541 weight 1.000 ! spec=13C_NOESY, no=938, id=1809, vol=8.991390e+06
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   60 and name   HA) 2.531 0.801 0.801 weight 1.000 ! spec=13C_NOESY, no=940, id=1811, vol=2.653517e+06
assign (segid "   A" and resid   60 and name  HB1) (segid "   A" and resid   63 and name   HB) 3.133 1.227 1.227 weight 1.000 ! spec=13C_NOESY, no=941, id=1812, vol=8.231816e+05
assign (segid "   A" and resid   61 and name  HA2) (segid "   A" and resid   61 and name  HA1) 2.216 0.614 0.614 weight 1.000 ! spec=13C_NOESY, no=944, id=1815, vol=6.323918e+06
assign (segid "   A" and resid   61 and name  HA2) (segid "   A" and resid   64 and name  HB1) 3.220 1.296 1.296 weight 1.000 ! spec=13C_NOESY, no=946, id=1817, vol=6.258511e+05
    or (segid "   A" and resid   61 and name  HA2) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   61 and name  HA2) (segid "   A" and resid   64 and name  HB3)
assign (segid "   A" and resid   61 and name  HA1) (segid "   A" and resid   64 and name  HB1) 3.071 1.179 1.179 weight 1.000 ! spec=13C_NOESY, no=947, id=1818, vol=7.598966e+05
    or (segid "   A" and resid   61 and name  HA1) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   61 and name  HA1) (segid "   A" and resid   64 and name  HB3)
assign (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   66 and name   HN) 2.991 1.118 1.118 weight 1.000 ! spec=13C_NOESY, no=948, id=1819, vol=8.170734e+05
assign (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid   18 and name  HB2) 1.580 0.312 0.312 weight 1.000 ! spec=13C_NOESY, no=950, id=1821, vol=4.594539e+07
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   63 and name   HA) 2.307 0.665 0.665 weight 1.000 ! spec=13C_NOESY, no=952, id=1823, vol=4.429181e+06
assign (segid "   A" and resid   63 and name   HA) (segid "   A" and resid   67 and name HD22) 3.213 1.291 1.291 weight 1.000 ! spec=13C_NOESY, no=953, id=1824, vol=5.714694e+05
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   63 and name   HA) 2.698 0.910 0.910 weight 1.000 ! spec=13C_NOESY, no=955, id=1826, vol=1.910884e+06
assign (segid "   A" and resid   63 and name   HB) (segid "   A" and resid   63 and name HG11) 2.135 0.570 0.570 weight 1.000 ! spec=13C_NOESY, no=957, id=1828, vol=7.932418e+06
    or (segid "   A" and resid   63 and name   HB) (segid "   A" and resid   63 and name HG13)
    or (segid "   A" and resid   63 and name   HB) (segid "   A" and resid   63 and name HG12)
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   67 and name  HB1) 3.059 1.169 1.169 weight 1.000 ! spec=13C_NOESY, no=959, id=1830, vol=7.918844e+05
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   64 and name   HA) 2.821 0.994 0.994 weight 1.000 ! spec=13C_NOESY, no=961, id=1832, vol=1.261810e+06
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   64 and name  HB1) 1.968 0.484 0.484 weight 1.000 ! spec=13C_NOESY, no=964, id=1835, vol=1.111169e+07
    or (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   64 and name  HB3)
assign (segid "   A" and resid   69 and name HG22) (segid "   A" and resid   64 and name  HB1) 2.454 0.753 0.753 weight 1.000 ! spec=13C_NOESY, no=971, id=1842, vol=2.741891e+06
    or (segid "   A" and resid   69 and name HG22) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   69 and name HG22) (segid "   A" and resid   64 and name  HB3)
    or (segid "   A" and resid   69 and name HG21) (segid "   A" and resid   64 and name  HB1)
    or (segid "   A" and resid   69 and name HG21) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   69 and name HG21) (segid "   A" and resid   64 and name  HB3)
    or (segid "   A" and resid   69 and name HG23) (segid "   A" and resid   64 and name  HB1)
    or (segid "   A" and resid   69 and name HG23) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   69 and name HG23) (segid "   A" and resid   64 and name  HB3)
assign (segid "   A" and resid   69 and name HG11) (segid "   A" and resid   64 and name  HB1) 2.739 0.937 0.937 weight 1.000 ! spec=13C_NOESY, no=972, id=1843, vol=1.524200e+06
    or (segid "   A" and resid   69 and name HG11) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   69 and name HG11) (segid "   A" and resid   64 and name  HB3)
    or (segid "   A" and resid   69 and name HG12) (segid "   A" and resid   64 and name  HB1)
    or (segid "   A" and resid   69 and name HG12) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   69 and name HG12) (segid "   A" and resid   64 and name  HB3)
    or (segid "   A" and resid   69 and name HG13) (segid "   A" and resid   64 and name  HB1)
    or (segid "   A" and resid   69 and name HG13) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   69 and name HG13) (segid "   A" and resid   64 and name  HB3)
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   65 and name   HA) 2.399 0.719 0.719 weight 1.000 ! spec=13C_NOESY, no=973, id=1844, vol=3.802865e+06
assign (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   66 and name  HB2) 1.882 0.443 0.443 weight 1.000 ! spec=13C_NOESY, no=975, id=1846, vol=1.488467e+07
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   82 and name  HB2) 2.408 0.725 0.725 weight 1.000 ! spec=13C_NOESY, no=977, id=1848, vol=3.950128e+06
assign (segid "   A" and resid   67 and name   HA) (segid "   A" and resid   67 and name  HB1) 2.798 0.979 0.979 weight 1.000 ! spec=13C_NOESY, no=978, id=1849, vol=1.603481e+06
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   68 and name   HA) 3.005 1.129 1.129 weight 1.000 ! spec=13C_NOESY, no=981, id=1852, vol=8.606785e+05
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   69 and name   HA) 2.452 0.752 0.752 weight 1.000 ! spec=13C_NOESY, no=984, id=1855, vol=2.901184e+06
assign (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   69 and name HG11) 2.502 0.782 0.782 weight 1.000 ! spec=13C_NOESY, no=987, id=1858, vol=2.487091e+06
    or (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid   69 and name HG11) (segid "   A" and resid   11 and name  HE2) 2.645 0.875 0.875 weight 1.000 ! spec=13C_NOESY, no=990, id=1861, vol=1.984289e+06
    or (segid "   A" and resid   69 and name HG11) (segid "   A" and resid   11 and name  HE1)
    or (segid "   A" and resid   69 and name HG12) (segid "   A" and resid   11 and name  HE2)
    or (segid "   A" and resid   69 and name HG12) (segid "   A" and resid   11 and name  HE1)
    or (segid "   A" and resid   69 and name HG13) (segid "   A" and resid   11 and name  HE2)
    or (segid "   A" and resid   69 and name HG13) (segid "   A" and resid   11 and name  HE1)
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   69 and name HG11) 2.264 0.641 0.641 weight 1.000 ! spec=13C_NOESY, no=991, id=1862, vol=4.567176e+06
    or (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   69 and name HG22) 2.977 1.108 1.108 weight 1.000 ! spec=13C_NOESY, no=992, id=1863, vol=8.842980e+05
    or (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   69 and name HG21)
    or (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   69 and name HG23)
assign (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   70 and name   HN) 2.860 1.022 1.022 weight 1.000 ! spec=13C_NOESY, no=995, id=1866, vol=1.105701e+06
assign (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   71 and name   HN) 3.115 1.213 1.213 weight 1.000 ! spec=13C_NOESY, no=996, id=1867, vol=6.711700e+05
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   71 and name  HB3) 2.059 0.530 0.530 weight 1.000 ! spec=13C_NOESY, no=1000, id=1871, vol=8.229621e+06
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   71 and name  HB1)
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   71 and name  HB2)
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name  HB2) 1.947 0.474 0.474 weight 1.000 ! spec=13C_NOESY, no=1001, id=1872, vol=8.043683e+06
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name  HB3)
assign (segid "   A" and resid  102 and name HD22) (segid "   A" and resid   85 and name  HB2) 2.466 0.760 0.760 weight 1.000 ! spec=13C_NOESY, no=1002, id=1873, vol=1.839180e+06
    or (segid "   A" and resid  102 and name HD22) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid  102 and name HD22) (segid "   A" and resid   85 and name  HB3)
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   85 and name  HB2) 2.417 0.730 0.730 weight 1.000 ! spec=13C_NOESY, no=1003, id=1874, vol=2.193948e+06
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   85 and name  HB3)
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   73 and name   HA) 2.176 0.592 0.592 weight 1.000 ! spec=13C_NOESY, no=1006, id=1877, vol=6.379532e+06
assign (segid "   A" and resid   75 and name   HN) (segid "   A" and resid   74 and name   HA) 2.015 0.507 0.507 weight 1.000 ! spec=13C_NOESY, no=1007, id=1878, vol=9.804683e+06
assign (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name HG23) 2.125 0.564 0.564 weight 1.000 ! spec=13C_NOESY, no=1008, id=1879, vol=7.660476e+06
    or (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name HG22)
    or (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name HG21)
assign (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   74 and name   HA) 2.636 0.868 0.868 weight 1.000 ! spec=13C_NOESY, no=1009, id=1880, vol=1.908886e+06
assign (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   74 and name   HA) 2.213 0.612 0.612 weight 1.000 ! spec=13C_NOESY, no=1011, id=1882, vol=5.152698e+06
assign (segid "   A" and resid   73 and name  HB1) (segid "   A" and resid   36 and name HD11) 2.195 0.602 0.602 weight 1.000 ! spec=13C_NOESY, no=1012, id=1883, vol=6.356035e+06
    or (segid "   A" and resid   73 and name  HB1) (segid "   A" and resid   36 and name HD13)
    or (segid "   A" and resid   73 and name  HB1) (segid "   A" and resid   36 and name HD12)
assign (segid "   A" and resid   74 and name   HB) (segid "   A" and resid   74 and name   HN) 2.634 0.868 0.868 weight 1.000 ! spec=13C_NOESY, no=1013, id=1884, vol=2.015698e+06
assign (segid "   A" and resid   74 and name   HB) (segid "   A" and resid   74 and name   HA) 2.649 0.877 0.877 weight 1.000 ! spec=13C_NOESY, no=1015, id=1886, vol=2.022106e+06
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   74 and name   HB) 2.559 0.819 0.819 weight 1.000 ! spec=13C_NOESY, no=1016, id=1887, vol=2.324898e+06
assign (segid "   A" and resid   74 and name   HB) (segid "   A" and resid   74 and name HG23) 2.113 0.558 0.558 weight 1.000 ! spec=13C_NOESY, no=1017, id=1888, vol=7.669680e+06
    or (segid "   A" and resid   74 and name   HB) (segid "   A" and resid   74 and name HG22)
    or (segid "   A" and resid   74 and name   HB) (segid "   A" and resid   74 and name HG21)
assign (segid "   A" and resid   74 and name   HB) (segid "   A" and resid   69 and name HG11) 2.827 0.999 0.999 weight 1.000 ! spec=13C_NOESY, no=1019, id=1890, vol=1.286431e+06
    or (segid "   A" and resid   74 and name   HB) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   74 and name   HB) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid   74 and name   HB) (segid "   A" and resid   75 and name   HN) 3.121 1.217 1.217 weight 1.000 ! spec=13C_NOESY, no=1020, id=1891, vol=7.532654e+05
assign (segid "   A" and resid   74 and name   HB) (segid "   A" and resid   25 and name  HB1) 2.737 0.936 0.936 weight 1.000 ! spec=13C_NOESY, no=1021, id=1892, vol=1.727140e+06
assign (segid "   A" and resid   75 and name   HN) (segid "   A" and resid   74 and name HG23) 2.383 0.710 0.710 weight 1.000 ! spec=13C_NOESY, no=1022, id=1893, vol=2.390742e+06
    or (segid "   A" and resid   75 and name   HN) (segid "   A" and resid   74 and name HG22)
    or (segid "   A" and resid   75 and name   HN) (segid "   A" and resid   74 and name HG21)
assign (segid "   A" and resid   74 and name HG23) (segid "   A" and resid   69 and name HG11) 2.367 0.700 0.700 weight 1.000 ! spec=13C_NOESY, no=1026, id=1897, vol=2.408690e+06
    or (segid "   A" and resid   74 and name HG23) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   74 and name HG23) (segid "   A" and resid   69 and name HG13)
    or (segid "   A" and resid   74 and name HG22) (segid "   A" and resid   69 and name HG11)
    or (segid "   A" and resid   74 and name HG22) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   74 and name HG22) (segid "   A" and resid   69 and name HG13)
    or (segid "   A" and resid   74 and name HG21) (segid "   A" and resid   69 and name HG11)
    or (segid "   A" and resid   74 and name HG21) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   74 and name HG21) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   74 and name HG23) 3.081 1.186 1.186 weight 1.000 ! spec=13C_NOESY, no=1028, id=1899, vol=4.517618e+05
    or (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   74 and name HG22)
    or (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   74 and name HG21)
assign (segid "   A" and resid   75 and name HD22) (segid "   A" and resid   24 and name   HA) 2.796 0.977 0.977 weight 1.000 ! spec=13C_NOESY, no=1031, id=1902, vol=1.378221e+06
    or (segid "   A" and resid   75 and name HD21) (segid "   A" and resid   24 and name   HA)
    or (segid "   A" and resid   75 and name HD23) (segid "   A" and resid   24 and name   HA)
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   54 and name   HA) 2.187 0.598 0.598 weight 1.000 ! spec=13C_NOESY, no=1034, id=1905, vol=6.396627e+06
    or (segid "   A" and resid   24 and name  HB3) (segid "   A" and resid   54 and name   HA)
    or (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   54 and name   HA)
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   54 and name  HB1) 2.321 0.673 0.673 weight 1.000 ! spec=13C_NOESY, no=1035, id=1906, vol=4.451371e+06
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   75 and name   HA) 2.189 0.599 0.599 weight 1.000 ! spec=13C_NOESY, no=1036, id=1907, vol=6.751800e+06
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   54 and name   HN) 2.669 0.890 0.890 weight 1.000 ! spec=13C_NOESY, no=1038, id=1909, vol=1.766063e+06
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   54 and name   HA) 2.262 0.640 0.640 weight 1.000 ! spec=13C_NOESY, no=1039, id=1910, vol=5.546311e+06
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   54 and name   HA) 2.117 0.560 0.560 weight 1.000 ! spec=13C_NOESY, no=1040, id=1911, vol=7.550678e+06
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   75 and name   HA) 2.025 0.513 0.513 weight 1.000 ! spec=13C_NOESY, no=1041, id=1912, vol=1.014736e+07
assign (segid "   A" and resid   75 and name   HN) (segid "   A" and resid   75 and name   HA) 2.426 0.736 0.736 weight 1.000 ! spec=13C_NOESY, no=1042, id=1913, vol=3.341378e+06
assign (segid "   A" and resid   75 and name   HG) (segid "   A" and resid   75 and name HD11) 1.986 0.493 0.493 weight 1.000 ! spec=13C_NOESY, no=1047, id=1918, vol=1.163981e+07
    or (segid "   A" and resid   75 and name   HG) (segid "   A" and resid   75 and name HD13)
    or (segid "   A" and resid   75 and name   HG) (segid "   A" and resid   75 and name HD12)
assign (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   76 and name HD11) 2.272 0.645 0.645 weight 1.000 ! spec=13C_NOESY, no=1048, id=1919, vol=4.577759e+06
    or (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   76 and name HD12)
    or (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   76 and name HD13)
assign (segid "   A" and resid   76 and name HD11) (segid "   A" and resid   69 and name HG11) 2.278 0.649 0.649 weight 1.000 ! spec=13C_NOESY, no=1049, id=1920, vol=4.373386e+06
    or (segid "   A" and resid   76 and name HD11) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   76 and name HD11) (segid "   A" and resid   69 and name HG13)
    or (segid "   A" and resid   76 and name HD12) (segid "   A" and resid   69 and name HG11)
    or (segid "   A" and resid   76 and name HD12) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   76 and name HD12) (segid "   A" and resid   69 and name HG13)
    or (segid "   A" and resid   76 and name HD13) (segid "   A" and resid   69 and name HG11)
    or (segid "   A" and resid   76 and name HD13) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   76 and name HD13) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name   HA) 2.299 0.661 0.661 weight 1.000 ! spec=13C_NOESY, no=1050, id=1921, vol=4.943300e+06
assign (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid   11 and name  HE2) 2.722 0.926 0.926 weight 1.000 ! spec=13C_NOESY, no=1055, id=1926, vol=1.682271e+06
    or (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid   11 and name  HE1)
assign (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid   23 and name   HB) 3.042 1.157 1.157 weight 1.000 ! spec=13C_NOESY, no=1056, id=1927, vol=8.794049e+05
assign (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name  HB1) 2.090 0.546 0.546 weight 1.000 ! spec=13C_NOESY, no=1058, id=1929, vol=8.210140e+06
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   77 and name   HA) 2.055 0.528 0.528 weight 1.000 ! spec=13C_NOESY, no=1059, id=1930, vol=9.025663e+06
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   77 and name   HA) 2.696 0.908 0.908 weight 1.000 ! spec=13C_NOESY, no=1060, id=1931, vol=1.682614e+06
assign (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   77 and name HD12) 2.399 0.719 0.719 weight 1.000 ! spec=13C_NOESY, no=1062, id=1933, vol=3.778078e+06
    or (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   77 and name HD11)
    or (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   77 and name HD13)
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   78 and name   HN) 2.708 0.917 0.917 weight 1.000 ! spec=13C_NOESY, no=1066, id=1937, vol=1.683023e+06
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   78 and name   HA) 2.314 0.669 0.669 weight 1.000 ! spec=13C_NOESY, no=1067, id=1938, vol=4.411987e+06
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name   HA) 1.992 0.496 0.496 weight 1.000 ! spec=13C_NOESY, no=1068, id=1939, vol=1.056581e+07
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   78 and name  HD2) 2.584 0.835 0.835 weight 1.000 ! spec=13C_NOESY, no=1070, id=1941, vol=2.267940e+06
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   78 and name  HD1)
assign (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   78 and name   HA) 2.210 0.610 0.610 weight 1.000 ! spec=13C_NOESY, no=1071, id=1942, vol=5.714305e+06
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   83 and name  HG1) 2.819 0.994 0.994 weight 1.000 ! spec=13C_NOESY, no=1072, id=1943, vol=1.412374e+06
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   84 and name HG21) 2.588 0.837 0.837 weight 1.000 ! spec=13C_NOESY, no=1074, id=1945, vol=2.132244e+06
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   84 and name HG22)
assign (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   21 and name HG11) 3.071 1.179 1.179 weight 1.000 ! spec=13C_NOESY, no=1075, id=1946, vol=6.908715e+05
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   21 and name HG12)
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   21 and name HG13)
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   80 and name   HA) 1.946 0.473 0.473 weight 1.000 ! spec=13C_NOESY, no=1077, id=1948, vol=1.209996e+07
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   81 and name   HN) 2.319 0.672 0.672 weight 1.000 ! spec=13C_NOESY, no=1078, id=1949, vol=4.154964e+06
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   17 and name   HN) 3.116 1.214 1.214 weight 1.000 ! spec=13C_NOESY, no=1079, id=1950, vol=7.720838e+05
assign (segid "   A" and resid   80 and name  HB1) (segid "   A" and resid   80 and name  HB2) 1.829 0.418 0.418 weight 1.000 ! spec=13C_NOESY, no=1089, id=1960, vol=1.745573e+07
assign (segid "   A" and resid   81 and name  HA1) (segid "   A" and resid   15 and name HG12) 3.176 1.260 1.260 weight 1.000 ! spec=13C_NOESY, no=1094, id=1965, vol=6.511276e+05
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   81 and name  HA1) 3.203 1.282 1.282 weight 1.000 ! spec=13C_NOESY, no=1096, id=1967, vol=5.886030e+05
assign (segid "   A" and resid   81 and name  HA2) (segid "   A" and resid   16 and name  HB3) 3.416 1.459 1.459 weight 1.000 ! spec=13C_NOESY, no=1099, id=1970, vol=4.071455e+05
    or (segid "   A" and resid   81 and name  HA2) (segid "   A" and resid   16 and name  HB1)
    or (segid "   A" and resid   81 and name  HA2) (segid "   A" and resid   16 and name  HB2)
assign (segid "   A" and resid   81 and name  HA1) (segid "   A" and resid   81 and name  HA2) 1.970 0.485 0.485 weight 1.000 ! spec=13C_NOESY, no=1100, id=1971, vol=1.185378e+07
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   81 and name  HA2) 2.547 0.811 0.811 weight 1.000 ! spec=13C_NOESY, no=1102, id=1973, vol=2.494070e+06
assign (segid "   A" and resid   83 and name  HG2) (segid "   A" and resid   83 and name   HA) 2.890 1.044 1.044 weight 1.000 ! spec=13C_NOESY, no=1109, id=1980, vol=1.203299e+06
assign (segid "   A" and resid   83 and name  HG1) (segid "   A" and resid   85 and name   HN) 2.951 1.089 1.089 weight 1.000 ! spec=13C_NOESY, no=1111, id=1982, vol=1.029178e+06
assign (segid "   A" and resid   83 and name  HG1) (segid "   A" and resid   76 and name HD23) 2.472 0.764 0.764 weight 1.000 ! spec=13C_NOESY, no=1113, id=1984, vol=3.415907e+06
    or (segid "   A" and resid   83 and name  HG1) (segid "   A" and resid   76 and name HD21)
    or (segid "   A" and resid   83 and name  HG1) (segid "   A" and resid   76 and name HD22)
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   84 and name   HA) 2.415 0.729 0.729 weight 1.000 ! spec=13C_NOESY, no=1115, id=1986, vol=3.192942e+06
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name HG13) 1.870 0.437 0.437 weight 1.000 ! spec=13C_NOESY, no=1119, id=1990, vol=1.607542e+07
    or (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name HG11)
    or (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name HG12)
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name HG21) 2.305 0.664 0.664 weight 1.000 ! spec=13C_NOESY, no=1121, id=1992, vol=4.603976e+06
    or (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name HG22)
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   84 and name HG21) 2.210 0.610 0.610 weight 1.000 ! spec=13C_NOESY, no=1124, id=1995, vol=5.243071e+06
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   84 and name HG22)
assign (segid "   A" and resid   84 and name HG21) (segid "   A" and resid   77 and name   HN) 3.010 1.133 1.133 weight 1.000 ! spec=13C_NOESY, no=1125, id=1996, vol=8.223658e+05
    or (segid "   A" and resid   84 and name HG23) (segid "   A" and resid   77 and name   HN)
    or (segid "   A" and resid   84 and name HG22) (segid "   A" and resid   77 and name   HN)
assign (segid "   A" and resid   84 and name HG21) (segid "   A" and resid   83 and name   HA) 2.847 1.013 1.013 weight 1.000 ! spec=13C_NOESY, no=1130, id=2001, vol=1.169399e+06
    or (segid "   A" and resid   84 and name HG23) (segid "   A" and resid   83 and name   HA)
    or (segid "   A" and resid   84 and name HG22) (segid "   A" and resid   83 and name   HA)
assign (segid "   A" and resid   84 and name HG21) (segid "   A" and resid   78 and name  HB1) 3.052 1.164 1.164 weight 1.000 ! spec=13C_NOESY, no=1133, id=2004, vol=7.992036e+05
    or (segid "   A" and resid   84 and name HG23) (segid "   A" and resid   78 and name  HB1)
    or (segid "   A" and resid   84 and name HG22) (segid "   A" and resid   78 and name  HB1)
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   84 and name HG21) 2.268 0.643 0.643 weight 1.000 ! spec=13C_NOESY, no=1134, id=2005, vol=4.866489e+06
    or (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   84 and name HG22)
assign (segid "   A" and resid   84 and name HG21) (segid "   A" and resid   77 and name  HB1) 1.980 0.490 0.490 weight 1.000 ! spec=13C_NOESY, no=1135, id=2006, vol=1.082628e+07
    or (segid "   A" and resid   84 and name HG23) (segid "   A" and resid   77 and name  HB1)
    or (segid "   A" and resid   84 and name HG22) (segid "   A" and resid   77 and name  HB1)
assign (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   26 and name  HE2) 3.188 1.270 1.270 weight 1.000 ! spec=13C_NOESY, no=1150, id=2021, vol=3.816306e+05
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   26 and name  HE1)
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   26 and name  HE2)
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   26 and name  HE1)
    or (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   26 and name  HE2)
    or (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   26 and name  HE1)
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   85 and name   HA) 1.849 0.428 0.428 weight 1.000 ! spec=13C_NOESY, no=1151, id=2022, vol=1.611834e+07
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   85 and name   HA) 2.343 0.686 0.686 weight 1.000 ! spec=13C_NOESY, no=1152, id=2023, vol=3.878853e+06
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   83 and name  HG2) 2.543 0.808 0.808 weight 1.000 ! spec=13C_NOESY, no=1153, id=2024, vol=2.463346e+06
assign (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   85 and name   HA) 2.994 1.120 1.120 weight 1.000 ! spec=13C_NOESY, no=1154, id=2025, vol=9.914364e+05
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   85 and name   HA)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   85 and name   HA)
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   85 and name  HB2) 3.004 1.128 1.128 weight 1.000 ! spec=13C_NOESY, no=1155, id=2026, vol=5.857576e+05
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   85 and name  HB3)
assign (segid "   A" and resid   85 and name  HB2) (segid "   A" and resid   86 and name   HA) 2.879 1.036 1.036 weight 1.000 ! spec=13C_NOESY, no=1156, id=2027, vol=7.650110e+05
    or (segid "   A" and resid   85 and name  HB1) (segid "   A" and resid   86 and name   HA)
    or (segid "   A" and resid   85 and name  HB3) (segid "   A" and resid   86 and name   HA)
assign (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   85 and name  HB2) 1.931 0.466 0.466 weight 1.000 ! spec=13C_NOESY, no=1157, id=2028, vol=8.720026e+06
    or (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   77 and name HD21) (segid "   A" and resid   85 and name  HB3)
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   85 and name  HB2)
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   77 and name HD23) (segid "   A" and resid   85 and name  HB3)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   85 and name  HB2)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   85 and name  HB3)
assign (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   26 and name  HD2) 3.163 1.250 1.250 weight 1.000 ! spec=13C_NOESY, no=1160, id=2031, vol=6.490586e+05
    or (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   26 and name  HD1)
assign (segid "   A" and resid   89 and name  HA1) (segid "   A" and resid   36 and name HD11) 3.193 1.274 1.274 weight 1.000 ! spec=13C_NOESY, no=1166, id=2037, vol=6.643129e+05
    or (segid "   A" and resid   89 and name  HA1) (segid "   A" and resid   36 and name HD13)
    or (segid "   A" and resid   89 and name  HA1) (segid "   A" and resid   36 and name HD12)
assign (segid "   A" and resid   89 and name  HA2) (segid "   A" and resid   90 and name   HN) 3.276 1.342 1.342 weight 1.000 ! spec=13C_NOESY, no=1169, id=2040, vol=5.808786e+05
assign (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   89 and name  HA2) 2.648 0.877 0.877 weight 1.000 ! spec=13C_NOESY, no=1170, id=2041, vol=2.056546e+06
assign (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   90 and name   HA) 2.099 0.551 0.551 weight 1.000 ! spec=13C_NOESY, no=1177, id=2048, vol=7.514861e+06
assign (segid "   A" and resid   90 and name   HN) (segid "   A" and resid   90 and name  HB1) 3.167 1.254 1.254 weight 1.000 ! spec=13C_NOESY, no=1178, id=2049, vol=5.897856e+05
    or (segid "   A" and resid   90 and name   HN) (segid "   A" and resid   90 and name  HB2)
    or (segid "   A" and resid   90 and name   HN) (segid "   A" and resid   90 and name  HB3)
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid   63 and name   HA) 2.834 1.004 1.004 weight 1.000 ! spec=13C_NOESY, no=1181, id=2052, vol=1.280806e+06
    or (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid   63 and name   HA)
    or (segid "   A" and resid    8 and name  HB3) (segid "   A" and resid   63 and name   HA)
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   90 and name  HB1) 2.396 0.718 0.718 weight 1.000 ! spec=13C_NOESY, no=1182, id=2053, vol=3.429893e+06
    or (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   90 and name  HB2)
    or (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   90 and name  HB3)
assign (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   91 and name   HA) 2.615 0.855 0.855 weight 1.000 ! spec=13C_NOESY, no=1185, id=2056, vol=2.100154e+06
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   35 and name  HE1) 2.935 1.077 1.077 weight 1.000 ! spec=13C_NOESY, no=1189, id=2060, vol=1.115612e+06
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   35 and name  HE3)
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   35 and name  HE2)
assign (segid "   A" and resid   91 and name  HB2) (segid "   A" and resid   91 and name  HB1) 1.867 0.436 0.436 weight 1.000 ! spec=13C_NOESY, no=1193, id=2064, vol=1.726539e+07
assign (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   95 and name   HA) 2.824 0.997 0.997 weight 1.000 ! spec=13C_NOESY, no=1196, id=2067, vol=1.177632e+06
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   95 and name   HA)
    or (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   95 and name   HA)
assign (segid "   A" and resid   98 and name  HB3) (segid "   A" and resid   95 and name   HA) 2.368 0.701 0.701 weight 1.000 ! spec=13C_NOESY, no=1197, id=2068, vol=3.895290e+06
    or (segid "   A" and resid   98 and name  HB1) (segid "   A" and resid   95 and name   HA)
    or (segid "   A" and resid   98 and name  HB2) (segid "   A" and resid   95 and name   HA)
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   95 and name   HA) 2.753 0.947 0.947 weight 1.000 ! spec=13C_NOESY, no=1198, id=2069, vol=1.777974e+06
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   95 and name   HA) 2.391 0.714 0.714 weight 1.000 ! spec=13C_NOESY, no=1199, id=2070, vol=3.618938e+06
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   96 and name   HN) 2.864 1.026 1.026 weight 1.000 ! spec=13C_NOESY, no=1200, id=2071, vol=1.327251e+06
assign (segid "   A" and resid   97 and name   HA) (segid "   A" and resid  100 and name   HN) 2.630 0.865 0.865 weight 1.000 ! spec=13C_NOESY, no=1201, id=2072, vol=1.968041e+06
assign (segid "   A" and resid  102 and name HD21) (segid "   A" and resid   98 and name   HA) 2.546 0.810 0.810 weight 1.000 ! spec=13C_NOESY, no=1203, id=2074, vol=2.470386e+06
assign (segid "   A" and resid   98 and name   HA) (segid "   A" and resid   99 and name HD11) 3.133 1.227 1.227 weight 1.000 ! spec=13C_NOESY, no=1207, id=2078, vol=6.497158e+05
    or (segid "   A" and resid   98 and name   HA) (segid "   A" and resid   99 and name HD12)
    or (segid "   A" and resid   98 and name   HA) (segid "   A" and resid   99 and name HD13)
assign (segid "   A" and resid   98 and name  HB3) (segid "   A" and resid  102 and name HD21) 2.756 0.949 0.949 weight 1.000 ! spec=13C_NOESY, no=1208, id=2079, vol=1.500702e+06
    or (segid "   A" and resid   98 and name  HB1) (segid "   A" and resid  102 and name HD21)
    or (segid "   A" and resid   98 and name  HB2) (segid "   A" and resid  102 and name HD21)
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   99 and name   HA) 2.804 0.983 0.983 weight 1.000 ! spec=13C_NOESY, no=1209, id=2080, vol=1.396977e+06
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid   99 and name   HA) 3.055 1.167 1.167 weight 1.000 ! spec=13C_NOESY, no=1210, id=2081, vol=8.569239e+05
assign (segid "   A" and resid   99 and name HG11) (segid "   A" and resid   98 and name   HN) 2.902 1.053 1.053 weight 1.000 ! spec=13C_NOESY, no=1211, id=2082, vol=1.071850e+06
assign (segid "   A" and resid  101 and name  HB1) (segid "   A" and resid  102 and name HD21) 2.443 0.746 0.746 weight 1.000 ! spec=13C_NOESY, no=1212, id=2083, vol=3.428118e+06
    or (segid "   A" and resid  101 and name  HB3) (segid "   A" and resid  102 and name HD21)
    or (segid "   A" and resid  101 and name  HB2) (segid "   A" and resid  102 and name HD21)
assign (segid "   A" and resid    6 and name  HB1) (segid "   A" and resid    7 and name   HN) 3.097 1.199 1.199 weight 1.000 ! spec=13C_NOESY, no=1219, id=2090, vol=6.475072e+05
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    5 and name  HB1) 2.937 1.078 1.078 weight 1.000 ! spec=13C_NOESY, no=1224, id=2095, vol=9.870678e+05
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name   HA) 3.121 1.217 1.217 weight 1.000 ! spec=13C_NOESY, no=1225, id=2096, vol=6.041881e+05
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    6 and name   HN) 2.607 0.849 0.849 weight 1.000 ! spec=13C_NOESY, no=1226, id=2097, vol=2.127696e+06
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name   HA) 2.307 0.665 0.665 weight 1.000 ! spec=13C_NOESY, no=1228, id=2099, vol=4.187128e+06
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   17 and name  HB1) 2.546 0.810 0.810 weight 1.000 ! spec=13C_NOESY, no=1238, id=2109, vol=2.460178e+06
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   45 and name   HN) 2.723 0.927 0.927 weight 1.000 ! spec=13C_NOESY, no=1241, id=2112, vol=1.566445e+06
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name   HA) 2.542 0.808 0.808 weight 1.000 ! spec=13C_NOESY, no=1242, id=2113, vol=2.684626e+06
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   42 and name   HA) 2.204 0.607 0.607 weight 1.000 ! spec=13C_NOESY, no=1243, id=2114, vol=5.868938e+06
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name  HB1) 1.986 0.493 0.493 weight 1.000 ! spec=13C_NOESY, no=1244, id=2115, vol=1.202849e+07
    or (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name  HB3)
    or (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name  HB2)
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   45 and name  HB1) 1.972 0.486 0.486 weight 1.000 ! spec=13C_NOESY, no=1246, id=2117, vol=1.278497e+07
assign (segid "   A" and resid   66 and name  HG1) (segid "   A" and resid   63 and name   HA) 3.049 1.162 1.162 weight 1.000 ! spec=13C_NOESY, no=1251, id=2122, vol=6.970231e+05
assign (segid "   A" and resid   66 and name  HG1) (segid "   A" and resid   66 and name   HA) 2.750 0.945 0.945 weight 1.000 ! spec=13C_NOESY, no=1252, id=2123, vol=1.503162e+06
assign (segid "   A" and resid   54 and name  HB2) (segid "   A" and resid   53 and name   HA) 2.871 1.030 1.030 weight 1.000 ! spec=13C_NOESY, no=1255, id=2126, vol=1.245134e+06
assign (segid "   A" and resid   54 and name  HB1) (segid "   A" and resid    2 and name HG11) 2.946 1.085 1.085 weight 1.000 ! spec=13C_NOESY, no=1256, id=2127, vol=9.933612e+05
    or (segid "   A" and resid   54 and name  HB1) (segid "   A" and resid    2 and name HG13)
    or (segid "   A" and resid   54 and name  HB1) (segid "   A" and resid    2 and name HG12)
assign (segid "   A" and resid   54 and name  HB2) (segid "   A" and resid   24 and name  HB1) 2.555 0.816 0.816 weight 1.000 ! spec=13C_NOESY, no=1258, id=2129, vol=2.466880e+06
    or (segid "   A" and resid   54 and name  HB2) (segid "   A" and resid   24 and name  HB3)
    or (segid "   A" and resid   54 and name  HB2) (segid "   A" and resid   24 and name  HB2)
assign (segid "   A" and resid   54 and name  HB2) (segid "   A" and resid   54 and name  HB1) 2.418 0.731 0.731 weight 1.000 ! spec=13C_NOESY, no=1259, id=2130, vol=3.275382e+06
assign (segid "   A" and resid   54 and name  HB1) (segid "   A" and resid   26 and name  HD2) 3.258 1.327 1.327 weight 1.000 ! spec=13C_NOESY, no=1260, id=2131, vol=5.502509e+05
    or (segid "   A" and resid   54 and name  HB1) (segid "   A" and resid   26 and name  HD1)
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   43 and name   HN) 2.832 1.002 1.002 weight 1.000 ! spec=13C_NOESY, no=1262, id=2133, vol=1.264768e+06
assign (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   96 and name  HB1) 2.380 0.708 0.708 weight 1.000 ! spec=13C_NOESY, no=1263, id=2134, vol=3.920253e+06
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   96 and name  HB2) 2.215 0.613 0.613 weight 1.000 ! spec=13C_NOESY, no=1266, id=2137, vol=6.172892e+06
assign (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   19 and name   HN) 3.011 1.133 1.133 weight 1.000 ! spec=13C_NOESY, no=1272, id=2143, vol=8.334192e+05
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   79 and name   HA) 2.057 0.529 0.529 weight 1.000 ! spec=13C_NOESY, no=1273, id=2144, vol=9.084218e+06
assign (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   21 and name   HN) 2.855 1.019 1.019 weight 1.000 ! spec=13C_NOESY, no=1274, id=2145, vol=1.155447e+06
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   86 and name  HB1) 2.951 1.089 1.089 weight 1.000 ! spec=13C_NOESY, no=1277, id=2148, vol=1.035557e+06
assign (segid "   A" and resid   82 and name  HB1) (segid "   A" and resid   82 and name   HA) 2.554 0.815 0.815 weight 1.000 ! spec=13C_NOESY, no=1281, id=2152, vol=2.482100e+06
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   82 and name  HB2) 2.711 0.919 0.919 weight 1.000 ! spec=13C_NOESY, no=1285, id=2156, vol=1.815835e+06
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   82 and name  HB1) 2.869 1.029 1.029 weight 1.000 ! spec=13C_NOESY, no=1286, id=2157, vol=1.314046e+06
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   86 and name   HN) 2.585 0.835 0.835 weight 1.000 ! spec=13C_NOESY, no=1289, id=2160, vol=2.251458e+06
assign (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   86 and name   HA) 1.974 0.487 0.487 weight 1.000 ! spec=13C_NOESY, no=1290, id=2161, vol=1.110697e+07
assign (segid "   A" and resid   86 and name  HB2) (segid "   A" and resid   86 and name   HA) 2.632 0.866 0.866 weight 1.000 ! spec=13C_NOESY, no=1291, id=2162, vol=2.282113e+06
assign (segid "   A" and resid   86 and name  HB2) (segid "   A" and resid   86 and name   HN) 2.859 1.022 1.022 weight 1.000 ! spec=13C_NOESY, no=1292, id=2163, vol=1.261665e+06
assign (segid "   A" and resid    2 and name   HB) (segid "   A" and resid   41 and name   HA) 3.049 1.162 1.162 weight 1.000 ! spec=13C_NOESY, no=1296, id=2167, vol=9.552170e+05
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid    8 and name  HB2) 2.192 0.601 0.601 weight 1.000 ! spec=13C_NOESY, no=1299, id=2170, vol=6.270676e+06
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid    8 and name  HB1)
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid    8 and name  HB3)
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   95 and name HG21) 2.694 0.907 0.907 weight 1.000 ! spec=13C_NOESY, no=1304, id=2175, vol=1.574821e+06
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   95 and name HG22)
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   95 and name HG23)
assign (segid "   A" and resid   99 and name HG23) (segid "   A" and resid   99 and name HD11) 2.102 0.552 0.552 weight 1.000 ! spec=13C_NOESY, no=1309, id=2180, vol=7.223570e+06
    or (segid "   A" and resid   99 and name HG23) (segid "   A" and resid   99 and name HD12)
    or (segid "   A" and resid   99 and name HG23) (segid "   A" and resid   99 and name HD13)
    or (segid "   A" and resid   99 and name HG21) (segid "   A" and resid   99 and name HD11)
    or (segid "   A" and resid   99 and name HG21) (segid "   A" and resid   99 and name HD12)
    or (segid "   A" and resid   99 and name HG21) (segid "   A" and resid   99 and name HD13)
    or (segid "   A" and resid   99 and name HG22) (segid "   A" and resid   99 and name HD11)
    or (segid "   A" and resid   99 and name HG22) (segid "   A" and resid   99 and name HD12)
    or (segid "   A" and resid   99 and name HG22) (segid "   A" and resid   99 and name HD13)
assign (segid "   A" and resid   99 and name HG23) (segid "   A" and resid   99 and name   HB) 2.217 0.615 0.615 weight 1.000 ! spec=13C_NOESY, no=1310, id=2181, vol=5.430324e+06
    or (segid "   A" and resid   99 and name HG21) (segid "   A" and resid   99 and name   HB)
    or (segid "   A" and resid   99 and name HG22) (segid "   A" and resid   99 and name   HB)
assign (segid "   A" and resid   92 and name  HD1) (segid "   A" and resid   91 and name HD22) 2.717 0.923 0.923 weight 1.000 ! spec=13C_NOESY, no=1316, id=2187, vol=1.716320e+06
assign (segid "   A" and resid   92 and name  HD2) (segid "   A" and resid   91 and name HD22) 2.796 0.977 0.977 weight 1.000 ! spec=13C_NOESY, no=1317, id=2188, vol=1.383695e+06
assign (segid "   A" and resid   92 and name  HD1) (segid "   A" and resid   91 and name HD21) 2.858 1.021 1.021 weight 1.000 ! spec=13C_NOESY, no=1318, id=2189, vol=1.294572e+06
assign (segid "   A" and resid   92 and name  HD1) (segid "   A" and resid   35 and name  HE1) 2.169 0.588 0.588 weight 1.000 ! spec=13C_NOESY, no=1322, id=2193, vol=7.103411e+06
    or (segid "   A" and resid   92 and name  HD1) (segid "   A" and resid   35 and name  HE3)
    or (segid "   A" and resid   92 and name  HD1) (segid "   A" and resid   35 and name  HE2)
assign (segid "   A" and resid   92 and name  HD2) (segid "   A" and resid   90 and name  HB1) 2.362 0.697 0.697 weight 1.000 ! spec=13C_NOESY, no=1324, id=2195, vol=3.878777e+06
    or (segid "   A" and resid   92 and name  HD2) (segid "   A" and resid   90 and name  HB2)
    or (segid "   A" and resid   92 and name  HD2) (segid "   A" and resid   90 and name  HB3)
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   35 and name   HA) 2.784 0.969 0.969 weight 1.000 ! spec=13C_NOESY, no=1326, id=2197, vol=1.399928e+06
assign (segid "   A" and resid    1 and name  HG2) (segid "   A" and resid    2 and name   HA) 3.075 1.182 1.182 weight 1.000 ! spec=13C_NOESY, no=1327, id=2198, vol=8.044874e+05
assign (segid "   A" and resid   33 and name  HB2) (segid "   A" and resid   33 and name   HA) 2.893 1.046 1.046 weight 1.000 ! spec=13C_NOESY, no=1328, id=2199, vol=1.189650e+06
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   74 and name HG23) 2.517 0.792 0.792 weight 1.000 ! spec=13C_NOESY, no=1331, id=2202, vol=2.631868e+06
    or (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   74 and name HG22)
    or (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   74 and name HG21)
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   82 and name  HG1) 2.934 1.076 1.076 weight 1.000 ! spec=13C_NOESY, no=1346, id=2217, vol=9.844192e+05
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name   HA) 2.924 1.069 1.069 weight 1.000 ! spec=13C_NOESY, no=1348, id=2219, vol=9.652582e+05
assign (segid "   A" and resid   92 and name  HD2) (segid "   A" and resid   35 and name  HE1) 2.335 0.681 0.681 weight 1.000 ! spec=13C_NOESY, no=1350, id=2221, vol=4.295189e+06
    or (segid "   A" and resid   92 and name  HD2) (segid "   A" and resid   35 and name  HE3)
    or (segid "   A" and resid   92 and name  HD2) (segid "   A" and resid   35 and name  HE2)
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name HG23) 2.426 0.736 0.736 weight 1.000 ! spec=15N_Noesy, no=1, id=0, vol=7.730311e+05
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name HG22)
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name HG21)
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HB2) 2.161 0.584 0.584 weight 1.000 ! spec=15N_Noesy, no=2, id=1, vol=1.907704e+06
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HB1)
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HB3)
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   99 and name   HB) 2.321 0.674 0.674 weight 1.000 ! spec=15N_Noesy, no=6, id=5, vol=1.310190e+06
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   61 and name  HA1) 2.399 0.719 0.719 weight 1.000 ! spec=15N_Noesy, no=7, id=6, vol=1.489833e+06
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   61 and name  HA2) 2.621 0.859 0.859 weight 1.000 ! spec=15N_Noesy, no=8, id=7, vol=9.617554e+05
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   81 and name  HA1) 2.352 0.692 0.692 weight 1.000 ! spec=15N_Noesy, no=9, id=8, vol=1.449324e+06
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name  HB1) 2.854 1.018 1.018 weight 1.000 ! spec=15N_Noesy, no=14, id=13, vol=3.908363e+05
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name  HB2) 2.485 0.772 0.772 weight 1.000 ! spec=15N_Noesy, no=15, id=14, vol=1.023670e+06
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name  HB1) 3.033 1.150 1.150 weight 1.000 ! spec=15N_Noesy, no=17, id=16, vol=3.321986e+05
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name  HB2) 2.684 0.901 0.901 weight 1.000 ! spec=15N_Noesy, no=18, id=17, vol=7.234558e+05
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   75 and name   HA) 2.916 1.063 1.063 weight 1.000 ! spec=15N_Noesy, no=20, id=19, vol=2.966626e+05
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   74 and name   HN) 3.041 1.156 1.156 weight 1.000 ! spec=15N_Noesy, no=22, id=21, vol=2.010207e+05
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   40 and name HD13) 3.103 1.203 1.203 weight 1.000 ! spec=15N_Noesy, no=24, id=23, vol=3.876637e+05
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   40 and name HD12)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   69 and name HG22) 3.342 1.396 1.396 weight 1.000 ! spec=15N_Noesy, no=25, id=24, vol=1.022789e+05
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   69 and name HG21)
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   69 and name HG23)
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   43 and name   HA) 2.686 0.902 0.902 weight 1.000 ! spec=15N_Noesy, no=28, id=27, vol=7.661848e+05
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name  HB2) 3.014 1.136 1.136 weight 1.000 ! spec=15N_Noesy, no=31, id=30, vol=2.747654e+05
    or (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name  HB1)
    or (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name  HB3)
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid   10 and name   HN) 3.187 1.270 1.270 weight 1.000 ! spec=15N_Noesy, no=33, id=32, vol=2.462741e+05
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   44 and name  HB2) 2.635 0.868 0.868 weight 1.000 ! spec=15N_Noesy, no=36, id=35, vol=1.016406e+06
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   45 and name   HN) 2.568 0.824 0.824 weight 1.000 ! spec=15N_Noesy, no=38, id=37, vol=6.195439e+05
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid    2 and name HG21) 3.115 1.213 1.213 weight 1.000 ! spec=15N_Noesy, no=39, id=38, vol=1.707673e+05
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid    2 and name HG23)
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid    2 and name HG22)
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name  HB2) 2.900 1.051 1.051 weight 1.000 ! spec=15N_Noesy, no=41, id=40, vol=3.690611e+05
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name   HA) 2.763 0.954 0.954 weight 1.000 ! spec=15N_Noesy, no=43, id=42, vol=5.595609e+05
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    4 and name  HB2) 3.148 1.239 1.239 weight 1.000 ! spec=15N_Noesy, no=45, id=44, vol=2.628282e+05
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    4 and name  HB1) 3.387 1.434 1.434 weight 1.000 ! spec=15N_Noesy, no=46, id=45, vol=1.496505e+05
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    4 and name   HA) 2.370 0.702 0.702 weight 1.000 ! spec=15N_Noesy, no=47, id=46, vol=1.052470e+06
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name  HB2) 2.365 0.699 0.699 weight 1.000 ! spec=15N_Noesy, no=56, id=55, vol=1.823538e+06
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   44 and name   HA) 3.443 1.482 1.482 weight 1.000 ! spec=15N_Noesy, no=57, id=56, vol=1.630835e+05
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   65 and name  HB1) 2.310 0.667 0.667 weight 1.000 ! spec=15N_Noesy, no=59, id=58, vol=1.891564e+06
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   97 and name   HA) 2.400 0.720 0.720 weight 1.000 ! spec=15N_Noesy, no=63, id=62, vol=9.881305e+05
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name  HB1) 2.315 0.670 0.670 weight 1.000 ! spec=15N_Noesy, no=66, id=65, vol=2.124955e+06
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   46 and name   HN) 2.238 0.626 0.626 weight 1.000 ! spec=15N_Noesy, no=74, id=73, vol=1.713226e+06
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   73 and name  HB1) 2.291 0.656 0.656 weight 1.000 ! spec=15N_Noesy, no=82, id=81, vol=1.512579e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name  HB1) 2.131 0.568 0.568 weight 1.000 ! spec=15N_Noesy, no=86, id=85, vol=2.770042e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name   HA) 2.484 0.771 0.771 weight 1.000 ! spec=15N_Noesy, no=88, id=87, vol=5.998890e+05
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   55 and name   HA) 2.929 1.073 1.073 weight 1.000 ! spec=15N_Noesy, no=91, id=90, vol=3.326939e+05
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   77 and name HD12) 2.539 0.806 0.806 weight 1.000 ! spec=15N_Noesy, no=92, id=91, vol=8.888680e+05
    or (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   77 and name HD11)
    or (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   77 and name HD13)
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   55 and name HD21) 2.780 0.966 0.966 weight 1.000 ! spec=15N_Noesy, no=93, id=92, vol=5.056621e+05
    or (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   55 and name HD23)
    or (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   55 and name HD22)
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   60 and name   HA) 2.503 0.783 0.783 weight 1.000 ! spec=15N_Noesy, no=95, id=94, vol=9.994934e+05
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   60 and name  HB2) 2.455 0.754 0.754 weight 1.000 ! spec=15N_Noesy, no=98, id=97, vol=1.397078e+06
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   55 and name HD21) 2.788 0.972 0.972 weight 1.000 ! spec=15N_Noesy, no=99, id=98, vol=4.797226e+05
    or (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   55 and name HD23)
    or (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   55 and name HD22)
assign (segid "   A" and resid   75 and name   HN) (segid "   A" and resid   75 and name  HB2) 2.600 0.845 0.845 weight 1.000 ! spec=15N_Noesy, no=101, id=100, vol=1.126636e+06
assign (segid "   A" and resid   75 and name   HN) (segid "   A" and resid   88 and name   HA) 3.422 1.464 1.464 weight 1.000 ! spec=15N_Noesy, no=105, id=104, vol=2.064991e+05
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   76 and name  HB1) 2.878 1.035 1.035 weight 1.000 ! spec=15N_Noesy, no=107, id=106, vol=5.704853e+05
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   75 and name  HB1) 2.558 0.818 0.818 weight 1.000 ! spec=15N_Noesy, no=110, id=109, vol=9.330918e+05
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   77 and name  HB2) 2.313 0.669 0.669 weight 1.000 ! spec=15N_Noesy, no=112, id=111, vol=1.781842e+06
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   26 and name  HD2) 2.931 1.074 1.074 weight 1.000 ! spec=15N_Noesy, no=115, id=114, vol=1.899009e+05
    or (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   26 and name  HD1)
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   25 and name   HA) 2.987 1.115 1.115 weight 1.000 ! spec=15N_Noesy, no=117, id=116, vol=2.726688e+05
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   72 and name  HE1) 3.067 1.176 1.176 weight 1.000 ! spec=15N_Noesy, no=121, id=120, vol=3.576652e+05
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   72 and name  HE2)
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   72 and name  HE3)
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   54 and name  HB1) 2.981 1.111 1.111 weight 1.000 ! spec=15N_Noesy, no=122, id=121, vol=2.943340e+05
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   76 and name  HB1) 3.287 1.351 1.351 weight 1.000 ! spec=15N_Noesy, no=123, id=122, vol=2.410680e+05
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name   HA) 2.607 0.849 0.849 weight 1.000 ! spec=15N_Noesy, no=127, id=126, vol=7.098404e+05
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name HG11) 2.365 0.699 0.699 weight 1.000 ! spec=15N_Noesy, no=129, id=128, vol=1.595074e+06
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   73 and name  HG2) 2.713 0.920 0.920 weight 1.000 ! spec=15N_Noesy, no=131, id=130, vol=6.316805e+05
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name HD11) 2.587 0.837 0.837 weight 1.000 ! spec=15N_Noesy, no=134, id=133, vol=7.866729e+05
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name HD13)
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name HD12)
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name HD13) 2.998 1.123 1.123 weight 1.000 ! spec=15N_Noesy, no=137, id=136, vol=4.780121e+05
    or (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name HD12)
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   95 and name   HB) 2.317 0.671 0.671 weight 1.000 ! spec=15N_Noesy, no=139, id=138, vol=2.610578e+06
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   93 and name   HA) 2.995 1.121 1.121 weight 1.000 ! spec=15N_Noesy, no=143, id=142, vol=4.647382e+05
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   94 and name  HB3) 2.704 0.914 0.914 weight 1.000 ! spec=15N_Noesy, no=144, id=143, vol=7.832598e+05
    or (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   94 and name  HB1)
    or (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   94 and name  HB2)
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   99 and name   HB) 2.197 0.603 0.603 weight 1.000 ! spec=15N_Noesy, no=146, id=145, vol=1.963404e+06
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   98 and name   HA) 3.066 1.175 1.175 weight 1.000 ! spec=15N_Noesy, no=151, id=150, vol=2.922527e+05
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    2 and name HG21) 3.039 1.155 1.155 weight 1.000 ! spec=15N_Noesy, no=153, id=152, vol=3.449601e+05
    or (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    2 and name HG23)
    or (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    2 and name HG22)
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name   HA) 2.057 0.529 0.529 weight 1.000 ! spec=15N_Noesy, no=157, id=156, vol=2.884565e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   78 and name  HB2) 3.132 1.226 1.226 weight 1.000 ! spec=15N_Noesy, no=158, id=157, vol=2.489046e+05
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name   HB) 2.507 0.786 0.786 weight 1.000 ! spec=15N_Noesy, no=159, id=158, vol=7.275688e+05
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name   HA) 2.954 1.090 1.090 weight 1.000 ! spec=15N_Noesy, no=160, id=159, vol=2.103064e+06
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   58 and name  HB2) 2.367 0.700 0.700 weight 1.000 ! spec=15N_Noesy, no=161, id=160, vol=1.307424e+06
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   63 and name   HB) 2.234 0.624 0.624 weight 1.000 ! spec=15N_Noesy, no=162, id=161, vol=1.508487e+06
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   68 and name   HA) 2.357 0.694 0.694 weight 1.000 ! spec=15N_Noesy, no=165, id=164, vol=1.216883e+06
assign (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   87 and name   HB) 3.635 1.651 1.651 weight 1.000 ! spec=15N_Noesy, no=169, id=168, vol=2.419375e+02
assign (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   87 and name   HA) 2.101 0.552 0.552 weight 1.000 ! spec=15N_Noesy, no=170, id=169, vol=2.208589e+06
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name   HA) 2.143 0.574 0.574 weight 1.000 ! spec=15N_Noesy, no=178, id=177, vol=2.219050e+06
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   75 and name   HA) 3.409 1.453 1.453 weight 1.000 ! spec=15N_Noesy, no=180, id=179, vol=8.955838e+04
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   77 and name   HA) 2.895 1.047 1.047 weight 1.000 ! spec=15N_Noesy, no=181, id=180, vol=2.584199e+05
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   77 and name HD12) 2.544 0.809 0.809 weight 1.000 ! spec=15N_Noesy, no=185, id=184, vol=9.769531e+05
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   77 and name HD11)
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   77 and name HD13)
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name HG21) 2.336 0.682 0.682 weight 1.000 ! spec=15N_Noesy, no=188, id=187, vol=1.585821e+06
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name HG23)
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name HG22)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name  HB1) 2.789 0.972 0.972 weight 1.000 ! spec=15N_Noesy, no=192, id=191, vol=4.970616e+05
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   36 and name HD11) 3.311 1.370 1.370 weight 1.000 ! spec=15N_Noesy, no=194, id=193, vol=1.979931e+05
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   36 and name HD13)
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   36 and name HD12)
assign (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   71 and name   HA) 2.194 0.602 0.602 weight 1.000 ! spec=15N_Noesy, no=195, id=194, vol=2.619464e+06
assign (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   72 and name  HB1) 2.659 0.884 0.884 weight 1.000 ! spec=15N_Noesy, no=196, id=195, vol=9.206052e+05
assign (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   71 and name  HB3) 2.439 0.744 0.744 weight 1.000 ! spec=15N_Noesy, no=197, id=196, vol=7.320141e+05
    or (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   71 and name  HB1)
    or (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   71 and name  HB2)
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   48 and name   HA) 2.732 0.933 0.933 weight 1.000 ! spec=15N_Noesy, no=200, id=199, vol=3.740615e+05
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name HG23) 2.940 1.081 1.081 weight 1.000 ! spec=15N_Noesy, no=204, id=203, vol=2.674567e+05
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name HG22)
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name HG21)
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid   53 and name  HB2) 3.672 1.685 1.685 weight 1.000 ! spec=15N_Noesy, no=205, id=204, vol=9.926284e+04
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    1 and name  HG2) 3.562 1.586 1.586 weight 1.000 ! spec=15N_Noesy, no=206, id=205, vol=1.189307e+05
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid   54 and name   HN) 3.255 1.324 1.324 weight 1.000 ! spec=15N_Noesy, no=210, id=209, vol=2.315381e+05
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    4 and name   HN) 3.402 1.446 1.446 weight 1.000 ! spec=15N_Noesy, no=211, id=210, vol=7.192565e+04
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   54 and name   HN) 3.436 1.476 1.476 weight 1.000 ! spec=15N_Noesy, no=212, id=211, vol=7.044181e+04
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name   HB) 3.697 1.708 1.708 weight 1.000 ! spec=15N_Noesy, no=215, id=214, vol=9.624149e+04
assign (segid "   A" and resid    4 and name HE22) (segid "   A" and resid   54 and name  HB1) 3.866 1.868 1.868 weight 1.000 ! spec=15N_Noesy, no=216, id=215, vol=6.767897e+04
assign (segid "   A" and resid    4 and name HE22) (segid "   A" and resid    4 and name  HB2) 3.311 1.370 1.370 weight 1.000 ! spec=15N_Noesy, no=217, id=216, vol=2.048277e+05
assign (segid "   A" and resid    4 and name HE22) (segid "   A" and resid    4 and name   HA) 2.283 0.652 0.652 weight 1.000 ! spec=15N_Noesy, no=219, id=218, vol=1.198125e+06
assign (segid "   A" and resid    4 and name HE22) (segid "   A" and resid    4 and name HE21) 1.794 0.402 0.402 weight 1.000 ! spec=15N_Noesy, no=221, id=220, vol=5.254153e+06
assign (segid "   A" and resid    4 and name HE21) (segid "   A" and resid    4 and name   HA) 2.304 0.664 0.664 weight 1.000 ! spec=15N_Noesy, no=222, id=221, vol=1.138978e+06
assign (segid "   A" and resid    4 and name HE21) (segid "   A" and resid    4 and name  HB2) 3.066 1.175 1.175 weight 1.000 ! spec=15N_Noesy, no=224, id=223, vol=3.311603e+05
assign (segid "   A" and resid    4 and name HE21) (segid "   A" and resid   54 and name  HB1) 3.582 1.604 1.604 weight 1.000 ! spec=15N_Noesy, no=225, id=224, vol=1.309160e+05
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   55 and name HD12) 3.247 1.318 1.318 weight 1.000 ! spec=15N_Noesy, no=227, id=226, vol=1.770211e+05
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   55 and name HD11)
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   55 and name HD13)
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   55 and name  HB2) 3.051 1.164 1.164 weight 1.000 ! spec=15N_Noesy, no=229, id=228, vol=2.958713e+05
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   55 and name   HA) 3.265 1.333 1.333 weight 1.000 ! spec=15N_Noesy, no=230, id=229, vol=1.831754e+05
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name  HD1) 2.969 1.102 1.102 weight 1.000 ! spec=15N_Noesy, no=231, id=230, vol=3.297867e+05
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name  HD2)
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name  HD1) 3.180 1.264 1.264 weight 1.000 ! spec=15N_Noesy, no=233, id=232, vol=2.593583e+05
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name  HD2)
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name  HB1) 2.986 1.115 1.115 weight 1.000 ! spec=15N_Noesy, no=235, id=234, vol=2.961031e+05
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name  HB2) 3.322 1.380 1.380 weight 1.000 ! spec=15N_Noesy, no=236, id=235, vol=2.118692e+05
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    7 and name HG22) 3.458 1.495 1.495 weight 1.000 ! spec=15N_Noesy, no=240, id=239, vol=1.071362e+05
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    7 and name HG23)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    7 and name HG21)
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid   55 and name HD12) 3.459 1.495 1.495 weight 1.000 ! spec=15N_Noesy, no=241, id=240, vol=8.549111e+04
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid   55 and name HD11)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid   55 and name HD13)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   55 and name HD12) 2.891 1.044 1.044 weight 1.000 ! spec=15N_Noesy, no=242, id=241, vol=3.574741e+05
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   55 and name HD11)
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   55 and name HD13)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name HG22) 2.834 1.004 1.004 weight 1.000 ! spec=15N_Noesy, no=243, id=242, vol=5.104049e+05
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name HG23)
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name HG21)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   10 and name  HB2) 2.668 0.890 0.890 weight 1.000 ! spec=15N_Noesy, no=246, id=245, vol=8.432240e+05
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   10 and name  HG2) 2.992 1.119 1.119 weight 1.000 ! spec=15N_Noesy, no=247, id=246, vol=4.081004e+05
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    5 and name  HB1) 3.002 1.127 1.127 weight 1.000 ! spec=15N_Noesy, no=248, id=247, vol=2.876708e+05
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    5 and name  HD1) 3.529 1.557 1.557 weight 1.000 ! spec=15N_Noesy, no=250, id=249, vol=1.664660e+05
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    5 and name  HD2)
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    7 and name   HN) 2.185 0.597 0.597 weight 1.000 ! spec=15N_Noesy, no=251, id=250, vol=2.016284e+06
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name   HN) 3.417 1.459 1.459 weight 1.000 ! spec=15N_Noesy, no=252, id=251, vol=1.559987e+05
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    8 and name  HB2) 3.497 1.528 1.528 weight 1.000 ! spec=15N_Noesy, no=257, id=256, vol=1.040960e+05
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    8 and name  HB1)
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    8 and name  HB3)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    7 and name HG22) 3.433 1.473 1.473 weight 1.000 ! spec=15N_Noesy, no=258, id=257, vol=1.637788e+05
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    7 and name HG23)
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    7 and name HG21)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name   HA) 3.388 1.435 1.435 weight 1.000 ! spec=15N_Noesy, no=261, id=260, vol=1.417235e+05
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   11 and name   HN) 2.592 0.840 0.840 weight 1.000 ! spec=15N_Noesy, no=262, id=261, vol=8.529379e+05
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   12 and name   HN) 2.411 0.727 0.727 weight 1.000 ! spec=15N_Noesy, no=264, id=263, vol=1.706223e+06
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    5 and name  HD1) 3.279 1.344 1.344 weight 1.000 ! spec=15N_Noesy, no=265, id=264, vol=2.235258e+05
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    5 and name  HD2)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name  HB2) 2.676 0.895 0.895 weight 1.000 ! spec=15N_Noesy, no=270, id=269, vol=8.040291e+05
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   63 and name HG11) 3.348 1.401 1.401 weight 1.000 ! spec=15N_Noesy, no=271, id=270, vol=1.544897e+05
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   63 and name HG13)
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   63 and name HG12)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   14 and name  HB2) 3.587 1.608 1.608 weight 1.000 ! spec=15N_Noesy, no=272, id=271, vol=7.140834e+04
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   14 and name  HB3)
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name  HB2) 2.391 0.715 0.715 weight 1.000 ! spec=15N_Noesy, no=273, id=272, vol=1.595417e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   11 and name  HB2) 2.560 0.819 0.819 weight 1.000 ! spec=15N_Noesy, no=274, id=273, vol=1.221714e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid    9 and name   HA) 3.100 1.201 1.201 weight 1.000 ! spec=15N_Noesy, no=276, id=275, vol=3.103268e+05
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name  HB2) 2.458 0.755 0.755 weight 1.000 ! spec=15N_Noesy, no=280, id=279, vol=1.576891e+06
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name HD11) 3.445 1.483 1.483 weight 1.000 ! spec=15N_Noesy, no=286, id=285, vol=8.520591e+04
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name HD13)
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name HD12)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name HG11) 3.605 1.625 1.625 weight 1.000 ! spec=15N_Noesy, no=287, id=286, vol=7.666814e+04
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   11 and name   HA) 2.978 1.109 1.109 weight 1.000 ! spec=15N_Noesy, no=289, id=288, vol=1.887690e+05
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name  HB1) 2.400 0.720 0.720 weight 1.000 ! spec=15N_Noesy, no=291, id=290, vol=9.879463e+05
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name   HN) 2.447 0.749 0.749 weight 1.000 ! spec=15N_Noesy, no=293, id=292, vol=9.431441e+05
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   16 and name   HN) 2.572 0.827 0.827 weight 1.000 ! spec=15N_Noesy, no=295, id=294, vol=9.685058e+05
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name HD11) 3.157 1.246 1.246 weight 1.000 ! spec=15N_Noesy, no=297, id=296, vol=1.459208e+05
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name HD13)
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name HD12)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name  HB3) 2.120 0.562 0.562 weight 1.000 ! spec=15N_Noesy, no=299, id=298, vol=2.269639e+06
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name  HB1)
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name  HB2)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name   HA) 2.837 1.006 1.006 weight 1.000 ! spec=15N_Noesy, no=300, id=299, vol=3.035392e+05
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   16 and name   HN) 3.020 1.140 1.140 weight 1.000 ! spec=15N_Noesy, no=303, id=302, vol=2.623864e+05
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name HE22) 3.258 1.327 1.327 weight 1.000 ! spec=15N_Noesy, no=305, id=304, vol=1.314248e+05
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   17 and name   HN) 2.598 0.844 0.844 weight 1.000 ! spec=15N_Noesy, no=306, id=305, vol=8.074531e+05
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   15 and name   HA) 2.982 1.112 1.112 weight 1.000 ! spec=15N_Noesy, no=308, id=307, vol=2.278027e+05
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name  HB1) 2.491 0.776 0.776 weight 1.000 ! spec=15N_Noesy, no=310, id=309, vol=1.154519e+06
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name  HB2) 2.383 0.710 0.710 weight 1.000 ! spec=15N_Noesy, no=311, id=310, vol=1.217670e+06
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name  HB3) 2.713 0.920 0.920 weight 1.000 ! spec=15N_Noesy, no=312, id=311, vol=6.245321e+05
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name  HB1)
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name  HB2)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   19 and name  HG2) 3.622 1.640 1.640 weight 1.000 ! spec=15N_Noesy, no=315, id=314, vol=1.465186e+05
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name  HB1) 2.833 1.003 1.003 weight 1.000 ! spec=15N_Noesy, no=317, id=316, vol=5.836825e+05
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HB2) 2.758 0.951 0.951 weight 1.000 ! spec=15N_Noesy, no=318, id=317, vol=9.360382e+05
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HB1) 2.872 1.031 1.031 weight 1.000 ! spec=15N_Noesy, no=319, id=318, vol=5.820999e+05
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   18 and name   HN) 3.666 1.680 1.680 weight 1.000 ! spec=15N_Noesy, no=323, id=322, vol=7.894506e+04
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   80 and name   HN) 2.668 0.890 0.890 weight 1.000 ! spec=15N_Noesy, no=324, id=323, vol=4.966916e+05
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   19 and name   HN) 2.815 0.990 0.990 weight 1.000 ! spec=15N_Noesy, no=325, id=324, vol=3.477830e+05
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   17 and name  HB1) 2.984 1.113 1.113 weight 1.000 ! spec=15N_Noesy, no=330, id=329, vol=2.221358e+05
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HG2) 2.304 0.664 0.664 weight 1.000 ! spec=15N_Noesy, no=332, id=331, vol=1.336274e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name   HA) 2.204 0.607 0.607 weight 1.000 ! spec=15N_Noesy, no=336, id=335, vol=1.685605e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   50 and name   HA) 3.220 1.296 1.296 weight 1.000 ! spec=15N_Noesy, no=337, id=336, vol=1.526125e+05
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   78 and name   HN) 2.811 0.988 0.988 weight 1.000 ! spec=15N_Noesy, no=338, id=337, vol=4.777489e+05
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name   HN) 3.409 1.453 1.453 weight 1.000 ! spec=15N_Noesy, no=339, id=338, vol=5.573334e+04
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name HD11) 2.568 0.824 0.824 weight 1.000 ! spec=15N_Noesy, no=341, id=340, vol=9.003740e+05
    or (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name HD13)
    or (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name HD12)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   78 and name  HD2) 3.596 1.617 1.617 weight 1.000 ! spec=15N_Noesy, no=343, id=342, vol=5.966273e+04
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   78 and name  HD1)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   76 and name  HB2) 3.434 1.474 1.474 weight 1.000 ! spec=15N_Noesy, no=345, id=344, vol=4.720744e+04
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   40 and name HD13) 3.088 1.192 1.192 weight 1.000 ! spec=15N_Noesy, no=347, id=346, vol=5.999102e+05
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   40 and name HD12)
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   23 and name   HB) 3.571 1.594 1.594 weight 1.000 ! spec=15N_Noesy, no=348, id=347, vol=9.798462e+04
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   23 and name   HA) 2.296 0.659 0.659 weight 1.000 ! spec=15N_Noesy, no=349, id=348, vol=2.218694e+06
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   54 and name   HN) 3.861 1.863 1.863 weight 1.000 ! spec=15N_Noesy, no=352, id=351, vol=2.765846e+04
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name   HN) 3.464 1.500 1.500 weight 1.000 ! spec=15N_Noesy, no=353, id=352, vol=1.330753e+05
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   11 and name  HE2) 3.692 1.703 1.703 weight 1.000 ! spec=15N_Noesy, no=354, id=353, vol=3.501590e+04
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   11 and name  HE1)
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   57 and name HG13) 2.937 1.078 1.078 weight 1.000 ! spec=15N_Noesy, no=355, id=354, vol=3.785989e+05
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   57 and name HG11)
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   57 and name HG12)
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   26 and name  HB2) 2.841 1.009 1.009 weight 1.000 ! spec=15N_Noesy, no=357, id=356, vol=4.377346e+05
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name  HB2) 3.649 1.664 1.664 weight 1.000 ! spec=15N_Noesy, no=358, id=357, vol=8.622823e+04
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   56 and name   HA) 3.142 1.234 1.234 weight 1.000 ! spec=15N_Noesy, no=359, id=358, vol=1.376952e+05
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name   HN) 3.388 1.435 1.435 weight 1.000 ! spec=15N_Noesy, no=363, id=362, vol=1.231344e+05
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name  HB1) 2.384 0.710 0.710 weight 1.000 ! spec=15N_Noesy, no=366, id=365, vol=1.336440e+06
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name  HB3) 2.818 0.992 0.992 weight 1.000 ! spec=15N_Noesy, no=370, id=369, vol=4.221228e+05
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   58 and name  HB1) 3.639 1.655 1.655 weight 1.000 ! spec=15N_Noesy, no=372, id=371, vol=6.920554e+04
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name   HA) 3.232 1.306 1.306 weight 1.000 ! spec=15N_Noesy, no=379, id=378, vol=2.237943e+05
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name  HB1) 2.981 1.111 1.111 weight 1.000 ! spec=15N_Noesy, no=380, id=379, vol=2.169695e+05
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name HG21) 3.579 1.601 1.601 weight 1.000 ! spec=15N_Noesy, no=381, id=380, vol=1.901896e+05
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name HG22)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name HG23)
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   27 and name  HB3) 2.737 0.936 0.936 weight 1.000 ! spec=15N_Noesy, no=382, id=381, vol=4.897618e+05
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   27 and name  HB3) 3.022 1.141 1.141 weight 1.000 ! spec=15N_Noesy, no=383, id=382, vol=2.821758e+05
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name  HB2) 2.865 1.026 1.026 weight 1.000 ! spec=15N_Noesy, no=384, id=383, vol=5.172565e+05
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name  HB1) 2.818 0.993 0.993 weight 1.000 ! spec=15N_Noesy, no=385, id=384, vol=5.815405e+05
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   27 and name   HN) 3.540 1.566 1.566 weight 1.000 ! spec=15N_Noesy, no=387, id=386, vol=8.752929e+04
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name   HB) 3.102 1.203 1.203 weight 1.000 ! spec=15N_Noesy, no=396, id=395, vol=3.393786e+05
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   37 and name  HB1) 3.493 1.525 1.525 weight 1.000 ! spec=15N_Noesy, no=398, id=397, vol=1.809654e+05
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   37 and name  HB3)
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   37 and name  HB2)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   40 and name   HN) 2.507 0.786 0.786 weight 1.000 ! spec=15N_Noesy, no=403, id=402, vol=1.167319e+06
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   41 and name   HN) 2.585 0.835 0.835 weight 1.000 ! spec=15N_Noesy, no=404, id=403, vol=8.724150e+05
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   38 and name   HA) 3.386 1.433 1.433 weight 1.000 ! spec=15N_Noesy, no=406, id=405, vol=8.929442e+04
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid    2 and name HG21) 3.106 1.206 1.206 weight 1.000 ! spec=15N_Noesy, no=407, id=406, vol=1.906501e+05
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid    2 and name HG23)
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid    2 and name HG22)
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name   HB) 2.300 0.661 0.661 weight 1.000 ! spec=15N_Noesy, no=410, id=409, vol=2.081510e+06
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   42 and name  HB1) 2.059 0.530 0.530 weight 1.000 ! spec=15N_Noesy, no=416, id=415, vol=2.509349e+06
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   42 and name  HB1) 2.416 0.730 0.730 weight 1.000 ! spec=15N_Noesy, no=418, id=417, vol=1.178356e+06
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   43 and name  HD1) 2.976 1.107 1.107 weight 1.000 ! spec=15N_Noesy, no=421, id=420, vol=3.494856e+05
    or (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   43 and name  HD2)
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   43 and name   HN) 2.612 0.853 0.853 weight 1.000 ! spec=15N_Noesy, no=422, id=421, vol=1.001271e+06
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   44 and name   HN) 2.548 0.812 0.812 weight 1.000 ! spec=15N_Noesy, no=423, id=422, vol=7.408306e+05
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   46 and name  HB2) 2.945 1.084 1.084 weight 1.000 ! spec=15N_Noesy, no=430, id=429, vol=4.845897e+05
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   47 and name  HB1) 2.512 0.788 0.788 weight 1.000 ! spec=15N_Noesy, no=431, id=430, vol=1.150515e+06
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   46 and name   HA) 3.025 1.143 1.143 weight 1.000 ! spec=15N_Noesy, no=434, id=433, vol=3.356022e+05
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   45 and name   HN) 3.074 1.181 1.181 weight 1.000 ! spec=15N_Noesy, no=437, id=436, vol=2.834589e+05
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   47 and name   HN) 3.352 1.405 1.405 weight 1.000 ! spec=15N_Noesy, no=438, id=437, vol=1.401343e+05
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   15 and name HG12) 3.723 1.733 1.733 weight 1.000 ! spec=15N_Noesy, no=440, id=439, vol=6.022786e+04
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   12 and name  HB2) 3.809 1.813 1.813 weight 1.000 ! spec=15N_Noesy, no=442, id=441, vol=8.921889e+04
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   81 and name  HA1) 3.787 1.792 1.792 weight 1.000 ! spec=15N_Noesy, no=443, id=442, vol=6.672937e+04
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   29 and name   HN) 2.743 0.940 0.940 weight 1.000 ! spec=15N_Noesy, no=447, id=446, vol=3.971191e+05
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   28 and name   HA) 3.732 1.741 1.741 weight 1.000 ! spec=15N_Noesy, no=448, id=447, vol=3.623326e+04
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   26 and name  HD2) 3.560 1.584 1.584 weight 1.000 ! spec=15N_Noesy, no=450, id=449, vol=8.820645e+04
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   26 and name  HD1)
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   39 and name   HN) 3.152 1.242 1.242 weight 1.000 ! spec=15N_Noesy, no=451, id=450, vol=3.151340e+05
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   39 and name   HA) 3.173 1.259 1.259 weight 1.000 ! spec=15N_Noesy, no=453, id=452, vol=5.501327e+05
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   44 and name   HA) 2.482 0.770 0.770 weight 1.000 ! spec=15N_Noesy, no=455, id=454, vol=1.582905e+06
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   43 and name  HD1) 3.242 1.314 1.314 weight 1.000 ! spec=15N_Noesy, no=456, id=455, vol=2.680845e+05
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   43 and name  HD2)
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   43 and name   HA) 3.353 1.405 1.405 weight 1.000 ! spec=15N_Noesy, no=457, id=456, vol=2.312910e+05
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   50 and name  HB3) 3.252 1.322 1.322 weight 1.000 ! spec=15N_Noesy, no=463, id=462, vol=1.284770e+05
    or (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   50 and name  HB2)
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   50 and name   HN) 2.320 0.673 0.673 weight 1.000 ! spec=15N_Noesy, no=464, id=463, vol=1.078492e+06
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   50 and name   HA) 2.530 0.800 0.800 weight 1.000 ! spec=15N_Noesy, no=466, id=465, vol=6.813816e+05
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   48 and name   HA) 3.026 1.144 1.144 weight 1.000 ! spec=15N_Noesy, no=467, id=466, vol=2.269875e+05
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   44 and name   HA) 3.046 1.160 1.160 weight 1.000 ! spec=15N_Noesy, no=469, id=468, vol=3.014351e+05
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name  HG1) 3.372 1.421 1.421 weight 1.000 ! spec=15N_Noesy, no=470, id=469, vol=1.295152e+05
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   50 and name  HB3) 2.190 0.600 0.600 weight 1.000 ! spec=15N_Noesy, no=472, id=471, vol=1.554009e+06
    or (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   50 and name  HB2)
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   20 and name HD11) 3.462 1.498 1.498 weight 1.000 ! spec=15N_Noesy, no=473, id=472, vol=1.068402e+05
    or (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   20 and name HD13)
    or (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   20 and name HD12)
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   50 and name  HB3) 2.321 0.673 0.673 weight 1.000 ! spec=15N_Noesy, no=474, id=473, vol=1.360519e+06
    or (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   50 and name  HB2)
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   19 and name  HB1) 3.467 1.502 1.502 weight 1.000 ! spec=15N_Noesy, no=475, id=474, vol=1.530649e+05
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   22 and name   HN) 3.078 1.184 1.184 weight 1.000 ! spec=15N_Noesy, no=479, id=478, vol=2.897108e+05
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   53 and name   HN) 3.389 1.436 1.436 weight 1.000 ! spec=15N_Noesy, no=480, id=479, vol=1.259875e+05
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name  HB2) 2.596 0.843 0.843 weight 1.000 ! spec=15N_Noesy, no=483, id=482, vol=7.724373e+05
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid    2 and name HG11) 3.440 1.479 1.479 weight 1.000 ! spec=15N_Noesy, no=485, id=484, vol=1.493378e+05
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid    2 and name HG13)
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid    2 and name HG12)
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid    2 and name HG11) 3.033 1.150 1.150 weight 1.000 ! spec=15N_Noesy, no=487, id=486, vol=3.506510e+05
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid    2 and name HG13)
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid    2 and name HG12)
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   24 and name  HB1) 3.165 1.252 1.252 weight 1.000 ! spec=15N_Noesy, no=488, id=487, vol=3.108445e+05
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   24 and name  HB3)
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   24 and name  HB2)
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   53 and name  HB1) 2.763 0.954 0.954 weight 1.000 ! spec=15N_Noesy, no=489, id=488, vol=6.448818e+05
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name  HB1) 3.038 1.153 1.153 weight 1.000 ! spec=15N_Noesy, no=490, id=489, vol=2.575477e+05
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name  HB2) 3.450 1.488 1.488 weight 1.000 ! spec=15N_Noesy, no=491, id=490, vol=1.205176e+05
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   23 and name   HA) 2.923 1.068 1.068 weight 1.000 ! spec=15N_Noesy, no=492, id=491, vol=4.418845e+05
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   53 and name   HA) 2.905 1.055 1.055 weight 1.000 ! spec=15N_Noesy, no=493, id=492, vol=3.714380e+05
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   54 and name   HN) 3.652 1.667 1.667 weight 1.000 ! spec=15N_Noesy, no=494, id=493, vol=3.748183e+04
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   22 and name   HN) 3.033 1.150 1.150 weight 1.000 ! spec=15N_Noesy, no=495, id=494, vol=3.286828e+05
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   53 and name  HD2) 3.282 1.346 1.346 weight 1.000 ! spec=15N_Noesy, no=497, id=496, vol=1.189236e+05
    or (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   53 and name  HD1)
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid    4 and name   HA) 2.706 0.915 0.915 weight 1.000 ! spec=15N_Noesy, no=499, id=498, vol=6.357079e+05
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid    5 and name  HB2) 3.570 1.593 1.593 weight 1.000 ! spec=15N_Noesy, no=500, id=499, vol=1.557667e+05
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   53 and name  HB2) 2.547 0.811 0.811 weight 1.000 ! spec=15N_Noesy, no=501, id=500, vol=1.152584e+06
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   54 and name  HB1) 2.995 1.121 1.121 weight 1.000 ! spec=15N_Noesy, no=503, id=502, vol=3.141120e+05
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid    2 and name HG11) 2.739 0.938 0.938 weight 1.000 ! spec=15N_Noesy, no=506, id=505, vol=5.164763e+05
    or (segid "   A" and resid   54 and name   HN) (segid "   A" and resid    2 and name HG13)
    or (segid "   A" and resid   54 and name   HN) (segid "   A" and resid    2 and name HG12)
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   60 and name   HN) 3.373 1.422 1.422 weight 1.000 ! spec=15N_Noesy, no=507, id=506, vol=1.679542e+05
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   56 and name   HA) 2.986 1.114 1.114 weight 1.000 ! spec=15N_Noesy, no=509, id=508, vol=2.832468e+05
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   55 and name   HA) 2.257 0.637 0.637 weight 1.000 ! spec=15N_Noesy, no=510, id=509, vol=1.549857e+06
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   56 and name  HB1) 2.604 0.848 0.848 weight 1.000 ! spec=15N_Noesy, no=512, id=511, vol=8.234865e+05
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   55 and name   HG) 2.880 1.037 1.037 weight 1.000 ! spec=15N_Noesy, no=513, id=512, vol=3.705153e+05
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   55 and name HD21) 2.933 1.076 1.076 weight 1.000 ! spec=15N_Noesy, no=514, id=513, vol=3.142010e+05
    or (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   55 and name HD23)
    or (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   55 and name HD22)
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   58 and name   HA) 2.585 0.835 0.835 weight 1.000 ! spec=15N_Noesy, no=518, id=517, vol=6.878477e+05
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   56 and name   HA) 3.345 1.399 1.399 weight 1.000 ! spec=15N_Noesy, no=519, id=518, vol=1.223849e+05
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   57 and name   HA) 3.287 1.351 1.351 weight 1.000 ! spec=15N_Noesy, no=520, id=519, vol=1.234593e+05
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   56 and name  HB1) 3.305 1.365 1.365 weight 1.000 ! spec=15N_Noesy, no=521, id=520, vol=2.805090e+05
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   59 and name   HN) 2.262 0.640 0.640 weight 1.000 ! spec=15N_Noesy, no=524, id=523, vol=1.821020e+06
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   82 and name   HA) 2.474 0.765 0.765 weight 1.000 ! spec=15N_Noesy, no=525, id=524, vol=7.463981e+05
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   57 and name   HA) 3.346 1.399 1.399 weight 1.000 ! spec=15N_Noesy, no=526, id=525, vol=1.919772e+05
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   58 and name   HN) 3.235 1.308 1.308 weight 1.000 ! spec=15N_Noesy, no=529, id=528, vol=1.683898e+05
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   61 and name   HN) 2.809 0.986 0.986 weight 1.000 ! spec=15N_Noesy, no=530, id=529, vol=3.132215e+05
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   59 and name   HA) 3.126 1.222 1.222 weight 1.000 ! spec=15N_Noesy, no=531, id=530, vol=1.987145e+05
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   63 and name HG11) 3.684 1.697 1.697 weight 1.000 ! spec=15N_Noesy, no=537, id=536, vol=1.445660e+05
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   63 and name HG13)
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   63 and name HG12)
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   63 and name   HN) 3.289 1.352 1.352 weight 1.000 ! spec=15N_Noesy, no=538, id=537, vol=1.712832e+05
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   61 and name   HN) 2.814 0.990 0.990 weight 1.000 ! spec=15N_Noesy, no=540, id=539, vol=3.758911e+05
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   63 and name   HN) 2.759 0.951 0.951 weight 1.000 ! spec=15N_Noesy, no=541, id=540, vol=6.257554e+05
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   61 and name  HA1) 3.177 1.262 1.262 weight 1.000 ! spec=15N_Noesy, no=544, id=543, vol=2.044896e+05
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   61 and name  HA2) 3.297 1.358 1.358 weight 1.000 ! spec=15N_Noesy, no=545, id=544, vol=1.732168e+05
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name  HB1) 2.806 0.985 0.985 weight 1.000 ! spec=15N_Noesy, no=546, id=545, vol=7.891887e+05
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   63 and name   HB) 3.675 1.688 1.688 weight 1.000 ! spec=15N_Noesy, no=547, id=546, vol=6.706258e+04
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   60 and name  HB1) 3.442 1.481 1.481 weight 1.000 ! spec=15N_Noesy, no=548, id=547, vol=9.800877e+04
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   63 and name HG11) 3.373 1.423 1.423 weight 1.000 ! spec=15N_Noesy, no=549, id=548, vol=1.749242e+05
    or (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   63 and name HG13)
    or (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   63 and name HG12)
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   63 and name HG11) 2.148 0.577 0.577 weight 1.000 ! spec=15N_Noesy, no=551, id=550, vol=1.921745e+06
    or (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   63 and name HG13)
    or (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   63 and name HG12)
assign (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   94 and name  HB3) 2.053 0.527 0.527 weight 1.000 ! spec=15N_Noesy, no=552, id=551, vol=3.180818e+06
    or (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   94 and name  HB1)
    or (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   94 and name  HB2)
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   62 and name  HB1) 3.134 1.228 1.228 weight 1.000 ! spec=15N_Noesy, no=553, id=552, vol=3.390213e+05
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   61 and name  HA2) 3.405 1.449 1.449 weight 1.000 ! spec=15N_Noesy, no=554, id=553, vol=1.090164e+05
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   65 and name   HN) 2.507 0.786 0.786 weight 1.000 ! spec=15N_Noesy, no=556, id=555, vol=8.223276e+05
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   66 and name   HN) 3.433 1.473 1.473 weight 1.000 ! spec=15N_Noesy, no=557, id=556, vol=1.177794e+05
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   63 and name   HA) 3.181 1.265 1.265 weight 1.000 ! spec=15N_Noesy, no=559, id=558, vol=1.924341e+05
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   63 and name   HB) 2.452 0.751 0.751 weight 1.000 ! spec=15N_Noesy, no=560, id=559, vol=9.612603e+05
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   63 and name HG11) 2.941 1.081 1.081 weight 1.000 ! spec=15N_Noesy, no=562, id=561, vol=4.645078e+05
    or (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   63 and name HG13)
    or (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   63 and name HG12)
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   69 and name HG11) 2.940 1.080 1.080 weight 1.000 ! spec=15N_Noesy, no=563, id=562, vol=2.949150e+05
    or (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   63 and name   HB) 3.288 1.352 1.352 weight 1.000 ! spec=15N_Noesy, no=568, id=567, vol=2.715974e+05
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   64 and name  HB1) 2.437 0.742 0.742 weight 1.000 ! spec=15N_Noesy, no=569, id=568, vol=8.142328e+05
    or (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   64 and name  HB2)
    or (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   64 and name  HB3)
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   69 and name HG11) 3.633 1.650 1.650 weight 1.000 ! spec=15N_Noesy, no=570, id=569, vol=1.565268e+04
    or (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   66 and name   HN) 2.520 0.794 0.794 weight 1.000 ! spec=15N_Noesy, no=571, id=570, vol=9.122385e+05
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   65 and name  HB1) 2.381 0.709 0.709 weight 1.000 ! spec=15N_Noesy, no=575, id=574, vol=1.617121e+06
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   66 and name  HB1) 2.217 0.614 0.614 weight 1.000 ! spec=15N_Noesy, no=576, id=575, vol=2.550627e+06
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   69 and name HG11) 3.560 1.584 1.584 weight 1.000 ! spec=15N_Noesy, no=578, id=577, vol=1.122713e+05
    or (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   69 and name HG11) 2.999 1.125 1.125 weight 1.000 ! spec=15N_Noesy, no=579, id=578, vol=1.643356e+05
    or (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   69 and name HG12)
    or (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   69 and name HG13)
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   67 and name  HB1) 2.729 0.931 0.931 weight 1.000 ! spec=15N_Noesy, no=583, id=582, vol=4.919378e+05
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   67 and name HD22) 2.961 1.096 1.096 weight 1.000 ! spec=15N_Noesy, no=587, id=586, vol=2.229185e+05
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   67 and name   HN) 2.478 0.768 0.768 weight 1.000 ! spec=15N_Noesy, no=588, id=587, vol=9.551683e+05
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   68 and name   HN) 2.334 0.681 0.681 weight 1.000 ! spec=15N_Noesy, no=589, id=588, vol=1.507950e+06
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   67 and name HD21) 2.559 0.819 0.819 weight 1.000 ! spec=15N_Noesy, no=590, id=589, vol=1.016307e+06
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   65 and name   HN) 3.574 1.596 1.596 weight 1.000 ! spec=15N_Noesy, no=591, id=590, vol=1.052885e+05
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   69 and name HG22) 2.959 1.094 1.094 weight 1.000 ! spec=15N_Noesy, no=597, id=596, vol=2.699581e+05
    or (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   69 and name HG21)
    or (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   69 and name HG23)
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name   HA) 2.817 0.992 0.992 weight 1.000 ! spec=15N_Noesy, no=600, id=599, vol=8.913831e+05
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   67 and name   HN) 3.128 1.223 1.223 weight 1.000 ! spec=15N_Noesy, no=601, id=600, vol=1.703069e+05
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   69 and name HG22) 3.557 1.582 1.582 weight 1.000 ! spec=15N_Noesy, no=605, id=604, vol=8.798809e+04
    or (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   69 and name HG21)
    or (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   69 and name HG23)
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   69 and name HG22) 3.014 1.135 1.135 weight 1.000 ! spec=15N_Noesy, no=606, id=605, vol=3.246935e+05
    or (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   69 and name HG21)
    or (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   69 and name HG23)
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   71 and name  HB3) 2.539 0.806 0.806 weight 1.000 ! spec=15N_Noesy, no=607, id=606, vol=7.144519e+05
    or (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   71 and name  HB1)
    or (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   71 and name  HB2)
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   69 and name   HA) 3.263 1.331 1.331 weight 1.000 ! spec=15N_Noesy, no=608, id=607, vol=3.721269e+05
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   71 and name   HN) 2.798 0.979 0.979 weight 1.000 ! spec=15N_Noesy, no=610, id=609, vol=5.442436e+05
assign (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   71 and name   HN) 3.619 1.637 1.637 weight 1.000 ! spec=15N_Noesy, no=611, id=610, vol=6.975094e+04
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   25 and name  HB2) 3.044 1.158 1.158 weight 1.000 ! spec=15N_Noesy, no=614, id=613, vol=3.853927e+05
assign (segid "   A" and resid   75 and name   HN) (segid "   A" and resid   74 and name   HN) 3.569 1.593 1.593 weight 1.000 ! spec=15N_Noesy, no=617, id=616, vol=6.370062e+04
assign (segid "   A" and resid   75 and name   HN) (segid "   A" and resid   87 and name   HA) 3.542 1.568 1.568 weight 1.000 ! spec=15N_Noesy, no=618, id=617, vol=1.044953e+05
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   77 and name HD12) 3.182 1.266 1.266 weight 1.000 ! spec=15N_Noesy, no=619, id=618, vol=2.848663e+05
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   77 and name HD11)
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   77 and name HD13)
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   76 and name  HB2) 3.134 1.228 1.228 weight 1.000 ! spec=15N_Noesy, no=620, id=619, vol=4.589511e+05
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   11 and name  HE2) 3.492 1.524 1.524 weight 1.000 ! spec=15N_Noesy, no=623, id=622, vol=1.607434e+05
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   11 and name  HE1)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   76 and name   HN) 2.689 0.904 0.904 weight 1.000 ! spec=15N_Noesy, no=625, id=624, vol=7.905363e+05
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   85 and name   HA) 3.349 1.402 1.402 weight 1.000 ! spec=15N_Noesy, no=626, id=625, vol=1.657278e+05
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   77 and name  HB1) 2.964 1.098 1.098 weight 1.000 ! spec=15N_Noesy, no=629, id=628, vol=5.350169e+05
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   77 and name   HG) 3.188 1.270 1.270 weight 1.000 ! spec=15N_Noesy, no=630, id=629, vol=2.464395e+05
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   78 and name  HB2) 2.626 0.862 0.862 weight 1.000 ! spec=15N_Noesy, no=632, id=631, vol=8.641933e+05
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   20 and name   HA) 3.207 1.286 1.286 weight 1.000 ! spec=15N_Noesy, no=634, id=633, vol=1.938599e+05
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   78 and name  HD2) 2.698 0.910 0.910 weight 1.000 ! spec=15N_Noesy, no=636, id=635, vol=5.982859e+05
    or (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   78 and name  HD1)
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   85 and name   HN) 3.745 1.753 1.753 weight 1.000 ! spec=15N_Noesy, no=637, id=636, vol=2.641152e+04
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   77 and name   HN) 3.738 1.747 1.747 weight 1.000 ! spec=15N_Noesy, no=638, id=637, vol=1.092944e+04
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name  HD2) 3.307 1.367 1.367 weight 1.000 ! spec=15N_Noesy, no=643, id=642, vol=1.631604e+05
    or (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name  HD1)
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   79 and name   HA) 2.638 0.870 0.870 weight 1.000 ! spec=15N_Noesy, no=645, id=644, vol=5.167609e+05
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   83 and name   HA) 3.130 1.225 1.225 weight 1.000 ! spec=15N_Noesy, no=646, id=645, vol=1.662398e+05
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   79 and name  HB1) 2.578 0.831 0.831 weight 1.000 ! spec=15N_Noesy, no=648, id=647, vol=1.007417e+06
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   84 and name HG21) 2.852 1.017 1.017 weight 1.000 ! spec=15N_Noesy, no=651, id=650, vol=2.714985e+05
    or (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   84 and name HG22)
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   79 and name   HN) 3.700 1.712 1.712 weight 1.000 ! spec=15N_Noesy, no=652, id=651, vol=8.448091e+04
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   82 and name   HA) 1.985 0.493 0.493 weight 1.000 ! spec=15N_Noesy, no=657, id=656, vol=3.233211e+06
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   80 and name  HB2) 3.143 1.235 1.235 weight 1.000 ! spec=15N_Noesy, no=659, id=658, vol=1.232979e+05
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   80 and name  HB1) 2.927 1.071 1.071 weight 1.000 ! spec=15N_Noesy, no=660, id=659, vol=3.038454e+05
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   79 and name  HB1) 2.987 1.115 1.115 weight 1.000 ! spec=15N_Noesy, no=661, id=660, vol=5.748911e+05
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   82 and name   HN) 2.598 0.844 0.844 weight 1.000 ! spec=15N_Noesy, no=664, id=663, vol=5.983440e+05
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   81 and name   HN) 3.501 1.532 1.532 weight 1.000 ! spec=15N_Noesy, no=665, id=664, vol=2.014899e+04
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   80 and name  HB2) 3.530 1.558 1.558 weight 1.000 ! spec=15N_Noesy, no=667, id=666, vol=2.392182e+04
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   78 and name  HB2) 3.431 1.472 1.472 weight 1.000 ! spec=15N_Noesy, no=668, id=667, vol=2.117965e+05
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   16 and name  HB3) 3.400 1.445 1.445 weight 1.000 ! spec=15N_Noesy, no=670, id=669, vol=9.204093e+04
    or (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   16 and name  HB1)
    or (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   16 and name  HB2)
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   15 and name HG12) 3.836 1.839 1.839 weight 1.000 ! spec=15N_Noesy, no=672, id=671, vol=3.981916e+04
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   82 and name  HB1) 2.309 0.666 0.666 weight 1.000 ! spec=15N_Noesy, no=673, id=672, vol=1.823007e+06
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   81 and name  HA2) 2.986 1.115 1.115 weight 1.000 ! spec=15N_Noesy, no=675, id=674, vol=2.743279e+05
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   78 and name   HA) 3.459 1.495 1.495 weight 1.000 ! spec=15N_Noesy, no=677, id=676, vol=3.173907e+04
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   82 and name   HN) 2.398 0.719 0.719 weight 1.000 ! spec=15N_Noesy, no=679, id=678, vol=1.788834e+06
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   28 and name   HN) 3.339 1.393 1.393 weight 1.000 ! spec=15N_Noesy, no=680, id=679, vol=3.519460e+04
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   84 and name   HN) 3.258 1.327 1.327 weight 1.000 ! spec=15N_Noesy, no=681, id=680, vol=1.575228e+05
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   82 and name   HN) 3.341 1.396 1.396 weight 1.000 ! spec=15N_Noesy, no=682, id=681, vol=1.017201e+05
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   78 and name  HD2) 3.187 1.269 1.269 weight 1.000 ! spec=15N_Noesy, no=684, id=683, vol=2.420003e+05
    or (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   78 and name  HD1)
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   84 and name   HN) 3.175 1.260 1.260 weight 1.000 ! spec=15N_Noesy, no=685, id=684, vol=1.738795e+05
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   77 and name   HN) 3.588 1.609 1.609 weight 1.000 ! spec=15N_Noesy, no=686, id=685, vol=4.714205e+04
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   78 and name  HD2) 3.506 1.537 1.537 weight 1.000 ! spec=15N_Noesy, no=687, id=686, vol=6.721513e+04
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   78 and name  HD1)
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   84 and name HG21) 2.438 0.743 0.743 weight 1.000 ! spec=15N_Noesy, no=695, id=694, vol=9.647663e+05
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   84 and name HG22)
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   76 and name HD23) 3.014 1.135 1.135 weight 1.000 ! spec=15N_Noesy, no=696, id=695, vol=3.630500e+05
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   76 and name HD21)
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   76 and name HD22)
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   83 and name  HG2) 2.445 0.747 0.747 weight 1.000 ! spec=15N_Noesy, no=698, id=697, vol=1.447943e+06
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   84 and name   HB) 3.214 1.292 1.292 weight 1.000 ! spec=15N_Noesy, no=699, id=698, vol=1.826454e+05
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   76 and name   HA) 3.524 1.553 1.553 weight 1.000 ! spec=15N_Noesy, no=702, id=701, vol=1.258675e+05
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   78 and name   HA) 3.300 1.361 1.361 weight 1.000 ! spec=15N_Noesy, no=703, id=702, vol=1.770423e+05
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   85 and name   HN) 2.691 0.905 0.905 weight 1.000 ! spec=15N_Noesy, no=704, id=703, vol=4.739210e+05
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   85 and name   HN) 2.109 0.556 0.556 weight 1.000 ! spec=15N_Noesy, no=705, id=704, vol=2.235062e+06
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   87 and name   HN) 3.134 1.228 1.228 weight 1.000 ! spec=15N_Noesy, no=706, id=705, vol=1.042296e+05
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   85 and name   HN) 3.128 1.223 1.223 weight 1.000 ! spec=15N_Noesy, no=707, id=706, vol=2.135062e+05
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   85 and name  HB2) 2.466 0.760 0.760 weight 1.000 ! spec=15N_Noesy, no=715, id=714, vol=1.559953e+06
    or (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   85 and name  HB3)
assign (segid "   A" and resid   75 and name   HN) (segid "   A" and resid   87 and name   HN) 2.682 0.899 0.899 weight 1.000 ! spec=15N_Noesy, no=716, id=715, vol=6.378131e+05
assign (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   75 and name  HB2) 2.638 0.870 0.870 weight 1.000 ! spec=15N_Noesy, no=717, id=716, vol=9.314996e+05
assign (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   74 and name HG23) 2.468 0.761 0.761 weight 1.000 ! spec=15N_Noesy, no=718, id=717, vol=1.254732e+06
    or (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   74 and name HG22)
    or (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   74 and name HG21)
assign (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   75 and name   HA) 3.576 1.598 1.598 weight 1.000 ! spec=15N_Noesy, no=720, id=719, vol=7.098305e+04
assign (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   75 and name   HN) 3.662 1.677 1.677 weight 1.000 ! spec=15N_Noesy, no=722, id=721, vol=1.404751e+05
assign (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   89 and name   HN) 3.338 1.393 1.393 weight 1.000 ! spec=15N_Noesy, no=723, id=722, vol=3.806187e+04
assign (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   75 and name HD11) 2.539 0.806 0.806 weight 1.000 ! spec=15N_Noesy, no=727, id=726, vol=9.962488e+05
    or (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   75 and name HD13)
    or (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   75 and name HD12)
assign (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   90 and name  HB1) 3.414 1.457 1.457 weight 1.000 ! spec=15N_Noesy, no=728, id=727, vol=1.212916e+05
    or (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   90 and name  HB2)
    or (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   90 and name  HB3)
assign (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   89 and name  HA1) 2.527 0.798 0.798 weight 1.000 ! spec=15N_Noesy, no=730, id=729, vol=9.832783e+05
assign (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   87 and name   HA) 3.080 1.186 1.186 weight 1.000 ! spec=15N_Noesy, no=733, id=732, vol=2.254512e+05
assign (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   75 and name   HN) 3.433 1.474 1.474 weight 1.000 ! spec=15N_Noesy, no=735, id=734, vol=8.007066e+04
assign (segid "   A" and resid   90 and name   HN) (segid "   A" and resid   89 and name  HA1) 3.790 1.795 1.795 weight 1.000 ! spec=15N_Noesy, no=737, id=736, vol=7.727694e+04
assign (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   91 and name  HB1) 2.416 0.730 0.730 weight 1.000 ! spec=15N_Noesy, no=741, id=740, vol=9.072977e+05
assign (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   35 and name  HE1) 3.370 1.420 1.420 weight 1.000 ! spec=15N_Noesy, no=743, id=742, vol=2.588254e+05
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   35 and name  HE3)
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   35 and name  HE2)
assign (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   90 and name  HB1) 2.920 1.066 1.066 weight 1.000 ! spec=15N_Noesy, no=744, id=743, vol=3.650188e+05
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   90 and name  HB2)
    or (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   90 and name  HB3)
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   94 and name   HN) 2.272 0.645 0.645 weight 1.000 ! spec=15N_Noesy, no=747, id=746, vol=1.295299e+06
assign (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   91 and name  HB1) 3.085 1.189 1.189 weight 1.000 ! spec=15N_Noesy, no=749, id=748, vol=1.944103e+05
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   93 and name   HA) 2.955 1.092 1.092 weight 1.000 ! spec=15N_Noesy, no=756, id=755, vol=4.439657e+05
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   96 and name   HN) 2.411 0.726 0.726 weight 1.000 ! spec=15N_Noesy, no=758, id=757, vol=1.796505e+06
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   96 and name  HB2) 2.258 0.638 0.638 weight 1.000 ! spec=15N_Noesy, no=759, id=758, vol=1.756804e+06
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   94 and name   HA) 2.660 0.885 0.885 weight 1.000 ! spec=15N_Noesy, no=761, id=760, vol=6.957844e+05
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   96 and name   HN) 2.436 0.742 0.742 weight 1.000 ! spec=15N_Noesy, no=763, id=762, vol=9.762637e+05
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   98 and name   HN) 2.303 0.663 0.663 weight 1.000 ! spec=15N_Noesy, no=764, id=763, vol=2.725849e+06
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   95 and name HG21) 3.029 1.147 1.147 weight 1.000 ! spec=15N_Noesy, no=770, id=769, vol=3.380952e+05
    or (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   95 and name HG22)
    or (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   95 and name HG23)
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid  102 and name HD22) 3.433 1.474 1.474 weight 1.000 ! spec=15N_Noesy, no=771, id=770, vol=1.957576e+05
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   98 and name   HN) 2.409 0.725 0.725 weight 1.000 ! spec=15N_Noesy, no=772, id=771, vol=1.149855e+06
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   99 and name HD11) 2.982 1.111 1.111 weight 1.000 ! spec=15N_Noesy, no=774, id=773, vol=3.267491e+05
    or (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   99 and name HD12)
    or (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   99 and name HD13)
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid  100 and name   HN) 2.406 0.723 0.723 weight 1.000 ! spec=15N_Noesy, no=779, id=778, vol=1.823408e+06
assign (segid "   A" and resid  101 and name   HN) (segid "   A" and resid  100 and name   HN) 2.495 0.778 0.778 weight 1.000 ! spec=15N_Noesy, no=780, id=779, vol=1.028533e+06
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   34 and name   HN) 2.968 1.101 1.101 weight 1.000 ! spec=15N_Noesy, no=781, id=780, vol=5.409400e+05
assign (segid "   A" and resid  101 and name   HN) (segid "   A" and resid  102 and name   HN) 2.380 0.708 0.708 weight 1.000 ! spec=15N_Noesy, no=782, id=781, vol=1.192227e+06
assign (segid "   A" and resid  101 and name   HN) (segid "   A" and resid  102 and name  HB2) 3.366 1.416 1.416 weight 1.000 ! spec=15N_Noesy, no=785, id=784, vol=1.209936e+05
assign (segid "   A" and resid  101 and name   HN) (segid "   A" and resid  101 and name  HB1) 1.993 0.496 0.496 weight 1.000 ! spec=15N_Noesy, no=787, id=786, vol=3.414199e+06
    or (segid "   A" and resid  101 and name   HN) (segid "   A" and resid  101 and name  HB3)
    or (segid "   A" and resid  101 and name   HN) (segid "   A" and resid  101 and name  HB2)
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  102 and name   HN) 2.056 0.528 0.528 weight 1.000 ! spec=15N_Noesy, no=788, id=787, vol=2.493118e+06
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  102 and name  HB2) 3.373 1.422 1.422 weight 1.000 ! spec=15N_Noesy, no=792, id=791, vol=8.131355e+04
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  102 and name  HB1) 3.007 1.130 1.130 weight 1.000 ! spec=15N_Noesy, no=793, id=792, vol=3.050627e+05
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid   20 and name HD22) 3.638 1.654 1.654 weight 1.000 ! spec=15N_Noesy, no=795, id=794, vol=3.864603e+04
    or (segid "   A" and resid  103 and name   HN) (segid "   A" and resid   20 and name HD21)
    or (segid "   A" and resid  103 and name   HN) (segid "   A" and resid   20 and name HD23)
assign (segid "   A" and resid   97 and name HE21) (segid "   A" and resid  101 and name  HB1) 3.316 1.374 1.374 weight 1.000 ! spec=15N_Noesy, no=799, id=798, vol=1.596556e+05
    or (segid "   A" and resid   97 and name HE21) (segid "   A" and resid  101 and name  HB3)
    or (segid "   A" and resid   97 and name HE21) (segid "   A" and resid  101 and name  HB2)
assign (segid "   A" and resid   80 and name HD22) (segid "   A" and resid   80 and name  HB1) 2.803 0.982 0.982 weight 1.000 ! spec=15N_Noesy, no=800, id=799, vol=4.519402e+05
assign (segid "   A" and resid   80 and name HD22) (segid "   A" and resid   80 and name  HB2) 2.933 1.076 1.076 weight 1.000 ! spec=15N_Noesy, no=801, id=800, vol=3.074541e+05
assign (segid "   A" and resid   80 and name HD22) (segid "   A" and resid   80 and name HD21) 1.585 0.314 0.314 weight 1.000 ! spec=15N_Noesy, no=803, id=802, vol=1.104550e+07
assign (segid "   A" and resid  102 and name HD22) (segid "   A" and resid   99 and name HG23) 3.155 1.244 1.244 weight 1.000 ! spec=15N_Noesy, no=808, id=807, vol=3.330815e+05
    or (segid "   A" and resid  102 and name HD22) (segid "   A" and resid   99 and name HG21)
    or (segid "   A" and resid  102 and name HD22) (segid "   A" and resid   99 and name HG22)
assign (segid "   A" and resid  102 and name HD22) (segid "   A" and resid  102 and name HD21) 1.883 0.443 0.443 weight 1.000 ! spec=15N_Noesy, no=813, id=812, vol=4.142355e+06
assign (segid "   A" and resid   67 and name HD22) (segid "   A" and resid   11 and name  HE2) 2.821 0.995 0.995 weight 1.000 ! spec=15N_Noesy, no=815, id=814, vol=5.837950e+05
    or (segid "   A" and resid   67 and name HD22) (segid "   A" and resid   11 and name  HE1)
assign (segid "   A" and resid   67 and name HD22) (segid "   A" and resid   67 and name  HB2) 3.045 1.159 1.159 weight 1.000 ! spec=15N_Noesy, no=816, id=815, vol=2.046740e+05
assign (segid "   A" and resid  102 and name HD21) (segid "   A" and resid   99 and name   HN) 3.290 1.353 1.353 weight 1.000 ! spec=15N_Noesy, no=819, id=818, vol=2.103556e+05
assign (segid "   A" and resid  102 and name HD21) (segid "   A" and resid  102 and name   HA) 3.438 1.478 1.478 weight 1.000 ! spec=15N_Noesy, no=822, id=821, vol=8.578608e+04
assign (segid "   A" and resid  102 and name HD21) (segid "   A" and resid   85 and name  HB2) 2.624 0.861 0.861 weight 1.000 ! spec=15N_Noesy, no=825, id=824, vol=7.932415e+05
    or (segid "   A" and resid  102 and name HD21) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid  102 and name HD21) (segid "   A" and resid   85 and name  HB3)
assign (segid "   A" and resid   67 and name HD21) (segid "   A" and resid   67 and name  HB2) 2.668 0.890 0.890 weight 1.000 ! spec=15N_Noesy, no=828, id=827, vol=6.004350e+05
assign (segid "   A" and resid   67 and name HD21) (segid "   A" and resid   67 and name  HB1) 3.087 1.192 1.192 weight 1.000 ! spec=15N_Noesy, no=829, id=828, vol=2.459616e+05
assign (segid "   A" and resid   67 and name HD22) (segid "   A" and resid   67 and name HD21) 1.975 0.487 0.487 weight 1.000 ! spec=15N_Noesy, no=830, id=829, vol=3.354506e+06
assign (segid "   A" and resid   67 and name HD21) (segid "   A" and resid   11 and name  HE2) 2.776 0.963 0.963 weight 1.000 ! spec=15N_Noesy, no=831, id=830, vol=7.394540e+05
    or (segid "   A" and resid   67 and name HD21) (segid "   A" and resid   11 and name  HE1)
assign (segid "   A" and resid   97 and name HE21) (segid "   A" and resid   97 and name HE22) 1.711 0.366 0.366 weight 1.000 ! spec=15N_Noesy, no=843, id=842, vol=7.429823e+06
assign (segid "   A" and resid   80 and name HD21) (segid "   A" and resid   79 and name  HB1) 3.481 1.515 1.515 weight 1.000 ! spec=15N_Noesy, no=845, id=844, vol=6.312464e+04
assign (segid "   A" and resid   80 and name HD21) (segid "   A" and resid   80 and name  HB1) 2.985 1.114 1.114 weight 1.000 ! spec=15N_Noesy, no=846, id=845, vol=2.370587e+05
assign (segid "   A" and resid   80 and name HD21) (segid "   A" and resid   80 and name  HB2) 3.203 1.282 1.282 weight 1.000 ! spec=15N_Noesy, no=847, id=846, vol=7.268757e+04
assign (segid "   A" and resid   91 and name HD22) (segid "   A" and resid   91 and name HD21) 2.243 0.629 0.629 weight 1.000 ! spec=15N_Noesy, no=850, id=849, vol=1.837156e+06
assign (segid "   A" and resid   17 and name HE22) (segid "   A" and resid   14 and name  HB2) 2.635 0.868 0.868 weight 1.000 ! spec=15N_Noesy, no=851, id=850, vol=6.928949e+05
    or (segid "   A" and resid   17 and name HE22) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   17 and name HE22) (segid "   A" and resid   14 and name  HB3)
assign (segid "   A" and resid   17 and name HE22) (segid "   A" and resid   17 and name  HB2) 3.043 1.157 1.157 weight 1.000 ! spec=15N_Noesy, no=852, id=851, vol=2.530441e+05
assign (segid "   A" and resid   49 and name HE21) (segid "   A" and resid   49 and name  HB2) 3.253 1.322 1.322 weight 1.000 ! spec=15N_Noesy, no=853, id=852, vol=5.246505e+05
assign (segid "   A" and resid   17 and name HE22) (segid "   A" and resid   14 and name   HA) 2.889 1.043 1.043 weight 1.000 ! spec=15N_Noesy, no=855, id=854, vol=4.284367e+05
assign (segid "   A" and resid   91 and name HD22) (segid "   A" and resid   94 and name  HB3) 3.400 1.445 1.445 weight 1.000 ! spec=15N_Noesy, no=861, id=860, vol=1.837967e+05
    or (segid "   A" and resid   91 and name HD22) (segid "   A" and resid   94 and name  HB1)
    or (segid "   A" and resid   91 and name HD22) (segid "   A" and resid   94 and name  HB2)
assign (segid "   A" and resid   91 and name HD22) (segid "   A" and resid   91 and name  HB1) 3.175 1.260 1.260 weight 1.000 ! spec=15N_Noesy, no=863, id=862, vol=2.245504e+05
assign (segid "   A" and resid   97 and name HE22) (segid "   A" and resid  101 and name  HB1) 3.553 1.578 1.578 weight 1.000 ! spec=15N_Noesy, no=866, id=865, vol=1.662870e+05
    or (segid "   A" and resid   97 and name HE22) (segid "   A" and resid  101 and name  HB3)
    or (segid "   A" and resid   97 and name HE22) (segid "   A" and resid  101 and name  HB2)
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   41 and name   HA) 3.175 1.260 1.260 weight 1.000 ! spec=15N_Noesy, no=867, id=866, vol=2.104344e+05
assign (segid "   A" and resid   67 and name HD21) (segid "   A" and resid   66 and name  HB1) 3.424 1.466 1.466 weight 1.000 ! spec=15N_Noesy, no=869, id=868, vol=1.863264e+05
assign (segid "   A" and resid   67 and name HD21) (segid "   A" and resid   63 and name   HA) 3.509 1.539 1.539 weight 1.000 ! spec=15N_Noesy, no=870, id=869, vol=7.511899e+04

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1H       MET   1  -5.682  -6.962  10.659
    2    H2   MET   1           2H       MET   1  -6.555  -5.694   9.966
    3    H3   MET   1           3H       MET   1  -6.691  -6.006  11.621
    4    HA   MET   1           HA       MET   1  -5.305  -4.079  11.176
    5    HB2  MET   1           1HB      MET   1  -4.856  -5.246  13.210
    6    HB3  MET   1           2HB      MET   1  -4.013  -6.534  12.368
    7    HG2  MET   1           1HG      MET   1  -2.452  -5.115  13.547
    8    HG3  MET   1           2HG      MET   1  -2.205  -4.997  11.808
    9    HE1  MET   1           3HE      MET   1  -4.266  -1.744  14.355
   10    HE2  MET   1           1HE      MET   1  -3.618  -3.246  15.011
   11    HE3  MET   1           2HE      MET   1  -5.039  -3.279  13.967
   12    H    VAL   2           H        VAL   2  -3.855  -3.097   9.959
   13    HA   VAL   2           HA       VAL   2  -2.443  -4.675   7.932
   14    HB   VAL   2           HB       VAL   2  -3.251  -1.768   8.031
   15   HG11  VAL   2          1HG1      VAL   2  -1.049  -1.948   6.986
   16   HG12  VAL   2          2HG1      VAL   2  -2.287  -1.555   5.793
   17   HG13  VAL   2          3HG1      VAL   2  -1.661  -3.199   5.906
   18   HG21  VAL   2          3HG2      VAL   2  -5.009  -3.380   7.528
   19   HG22  VAL   2          1HG2      VAL   2  -4.040  -4.014   6.197
   20   HG23  VAL   2          2HG2      VAL   2  -4.638  -2.357   6.135
   21    H    THR   3           H        THR   3  -0.298  -4.809   7.968
   22    HA   THR   3           HA       THR   3   0.960  -4.156  10.446
   23    HB   THR   3           HB       THR   3   2.242  -5.368   7.995
   24    HG1  THR   3           1HG      THR   3   1.514  -7.345   8.798
   25   HG21  THR   3          3HG2      THR   3   2.868  -5.643  10.941
   26   HG22  THR   3          1HG2      THR   3   3.800  -4.702   9.777
   27   HG23  THR   3          2HG2      THR   3   3.711  -6.457   9.623
   28    H    GLN   4           H        GLN   4   2.735  -2.936  10.860
   29    HA   GLN   4           HA       GLN   4   2.988  -0.570   9.185
   30    HB2  GLN   4           1HB      GLN   4   2.527  -0.423  11.625
   31    HB3  GLN   4           2HB      GLN   4   4.089  -1.160  11.937
   32    HG2  GLN   4           1HG      GLN   4   4.123   1.277  12.210
   33    HG3  GLN   4           2HG      GLN   4   5.237   0.714  10.967
   34   HE21  GLN   4          1HE2      GLN   4   1.794   0.920  10.481
   35   HE22  GLN   4          2HE2      GLN   4   1.843   2.223   9.347
   36    H    PHE   5           H        PHE   5   4.823   0.038   8.155
   37    HA   PHE   5           HA       PHE   5   7.061  -1.802   8.026
   38    HB2  PHE   5           1HB      PHE   5   6.362   0.758   6.627
   39    HB3  PHE   5           2HB      PHE   5   7.987   0.093   6.526
   40    HD1  PHE   5           2HD      PHE   5   7.071  -2.858   6.466
   41    HD2  PHE   5           1HD      PHE   5   5.828   0.612   4.345
   42    HE1  PHE   5           2HE      PHE   5   6.369  -4.267   4.581
   43    HE2  PHE   5           1HE      PHE   5   5.122  -0.792   2.457
   44    HZ   PHE   5           HZ       PHE   5   5.393  -3.233   2.572
   45    H    LYS   6           H        LYS   6   9.303  -0.811   8.095
   46    HA   LYS   6           HA       LYS   6   9.482   1.130  10.289
   47    HB2  LYS   6           1HB      LYS   6  11.501  -1.042   9.727
   48    HB3  LYS   6           2HB      LYS   6  11.439   0.020  11.127
   49    HG2  LYS   6           1HG      LYS   6   9.333  -1.024  11.808
   50    HG3  LYS   6           2HG      LYS   6   9.441  -2.104  10.416
   51    HD2  LYS   6           1HD      LYS   6  11.491  -3.063  11.284
   52    HD3  LYS   6           2HD      LYS   6  11.482  -1.926  12.631
   53    HE2  LYS   6           1HE      LYS   6   9.382  -4.022  12.086
   54    HE3  LYS   6           2HE      LYS   6  10.661  -4.142  13.292
   55    HZ1  LYS   6           3HZ      LYS   6   8.561  -3.444  14.267
   56    HZ2  LYS   6           1HZ      LYS   6   8.517  -2.088  13.260
   57    HZ3  LYS   6           2HZ      LYS   6   9.729  -2.233  14.430
   58    H    THR   7           H        THR   7  10.957  -0.115   7.355
   59    HA   THR   7           HA       THR   7  11.907   2.565   6.717
   60    HB   THR   7           HB       THR   7  14.139   1.779   6.003
   61    HG1  THR   7           1HG      THR   7  13.404  -0.629   7.356
   62   HG21  THR   7          3HG2      THR   7  13.564   1.313   8.926
   63   HG22  THR   7          1HG2      THR   7  13.960   2.855   8.170
   64   HG23  THR   7          2HG2      THR   7  15.163   1.567   8.228
   65    H    ALA   8           H        ALA   8  13.082   2.367   4.420
   66    HA   ALA   8           HA       ALA   8  11.202   1.410   2.563
   67    HB1  ALA   8           1HB      ALA   8  12.997   1.771   0.884
   68    HB2  ALA   8           2HB      ALA   8  14.096   2.146   2.209
   69    HB3  ALA   8           3HB      ALA   8  12.683   3.161   1.916
   70    H    SER   9           H        SER   9  13.946  -0.092   4.107
   71    HA   SER   9           HA       SER   9  14.293  -2.295   2.412
   72    HB2  SER   9           1HB      SER   9  14.644  -2.125   5.413
   73    HB3  SER   9           2HB      SER   9  15.270  -3.418   4.390
   74    HG   SER   9           HG       SER   9  16.134  -0.784   4.679
   75    H    GLU  10           H        GLU  10  12.210  -1.881   5.267
   76    HA   GLU  10           HA       GLU  10  10.892  -4.305   5.188
   77    HB2  GLU  10           1HB      GLU  10  10.151  -1.563   6.117
   78    HB3  GLU  10           2HB      GLU  10   8.971  -2.862   6.174
   79    HG2  GLU  10           1HG      GLU  10  10.120  -2.592   8.287
   80    HG3  GLU  10           2HG      GLU  10  10.428  -4.168   7.574
   81    H    PHE  11           H        PHE  11  10.169  -1.288   3.406
   82    HA   PHE  11           HA       PHE  11   7.775  -2.191   2.231
   83    HB2  PHE  11           1HB      PHE  11   8.624   0.192   2.221
   84    HB3  PHE  11           2HB      PHE  11   9.770  -0.283   0.976
   85    HD1  PHE  11           2HD      PHE  11   8.739  -1.314  -1.185
   86    HD2  PHE  11           1HD      PHE  11   6.538   1.031   1.608
   87    HE1  PHE  11           2HE      PHE  11   7.074  -0.804  -2.923
   88    HE2  PHE  11           1HE      PHE  11   4.869   1.561  -0.155
   89    HZ   PHE  11           HZ       PHE  11   5.147   0.624  -2.407
   90    H    ASP  12           H        ASP  12  11.076  -2.158   1.005
   91    HA   ASP  12           HA       ASP  12  10.645  -3.457  -1.440
   92    HB2  ASP  12           1HB      ASP  12  12.698  -2.211  -0.815
   93    HB3  ASP  12           2HB      ASP  12  13.130  -3.504   0.295
   94    H    SER  13           H        SER  13  11.366  -4.795   1.767
   95    HA   SER  13           HA       SER  13  11.786  -7.450   0.970
   96    HB2  SER  13           1HB      SER  13  12.350  -6.578   3.220
   97    HB3  SER  13           2HB      SER  13  10.629  -6.469   3.591
   98    HG   SER  13           HG       SER  13  12.011  -8.856   2.894
   99    H    ALA  14           H        ALA  14   8.820  -5.808   2.041
  100    HA   ALA  14           HA       ALA  14   7.123  -8.020   1.763
  101    HB1  ALA  14           1HB      ALA  14   6.362  -5.115   1.487
  102    HB2  ALA  14           2HB      ALA  14   6.560  -5.956   3.023
  103    HB3  ALA  14           3HB      ALA  14   5.294  -6.457   1.903
  104    H    ILE  15           H        ILE  15   8.324  -5.650  -0.482
  105    HA   ILE  15           HA       ILE  15   6.583  -6.141  -2.642
  106    HB   ILE  15           HB       ILE  15   9.452  -5.257  -2.736
  107   HG12  ILE  15          1HG1      ILE  15   8.430  -3.612  -1.453
  108   HG13  ILE  15          2HG1      ILE  15   8.311  -2.992  -3.095
  109   HG21  ILE  15          1HG2      ILE  15   7.357  -4.645  -4.765
  110   HG22  ILE  15          2HG2      ILE  15   8.369  -6.081  -4.872
  111   HG23  ILE  15          3HG2      ILE  15   9.107  -4.478  -4.895
  112   HD11  ILE  15          3HD1      ILE  15   6.103  -4.418  -1.628
  113   HD12  ILE  15          1HD1      ILE  15   6.004  -3.676  -3.225
  114   HD13  ILE  15          2HD1      ILE  15   6.252  -2.669  -1.800
  115    H    ALA  16           H        ALA  16   9.594  -7.651  -1.621
  116    HA   ALA  16           HA       ALA  16   9.981  -9.075  -4.066
  117    HB1  ALA  16           1HB      ALA  16  11.299  -9.495  -1.394
  118    HB2  ALA  16           2HB      ALA  16  11.850  -8.382  -2.646
  119    HB3  ALA  16           3HB      ALA  16  11.861 -10.119  -2.945
  120    H    GLN  17           H        GLN  17   7.709  -9.541  -1.832
  121    HA   GLN  17           HA       GLN  17   7.825 -12.352  -1.420
  122    HB2  GLN  17           1HB      GLN  17   5.667 -10.278  -1.101
  123    HB3  GLN  17           2HB      GLN  17   5.446 -11.963  -0.693
  124    HG2  GLN  17           1HG      GLN  17   7.204 -11.842   0.957
  125    HG3  GLN  17           2HG      GLN  17   7.519 -10.166   0.516
  126   HE21  GLN  17          1HE2      GLN  17   4.730  -9.453   0.238
  127   HE22  GLN  17          2HE2      GLN  17   4.078  -9.392   1.837
  128    H    ASP  18           H        ASP  18   6.829 -13.972  -2.557
  129    HA   ASP  18           HA       ASP  18   5.976 -13.374  -5.253
  130    HB2  ASP  18           1HB      ASP  18   6.459 -15.901  -3.709
  131    HB3  ASP  18           2HB      ASP  18   5.563 -15.958  -5.222
  132    H    LYS  19           H        LYS  19   4.315 -12.210  -3.398
  133    HA   LYS  19           HA       LYS  19   1.772 -13.345  -4.145
  134    HB2  LYS  19           1HB      LYS  19   0.927 -13.322  -1.783
  135    HB3  LYS  19           2HB      LYS  19   2.097 -14.589  -2.118
  136    HG2  LYS  19           1HG      LYS  19   3.633 -12.466  -1.221
  137    HG3  LYS  19           2HG      LYS  19   2.200 -12.438  -0.192
  138    HD2  LYS  19           1HD      LYS  19   2.529 -14.854   0.252
  139    HD3  LYS  19           2HD      LYS  19   4.018 -14.794  -0.690
  140    HE2  LYS  19           1HE      LYS  19   4.665 -14.629   1.571
  141    HE3  LYS  19           2HE      LYS  19   4.809 -13.006   0.903
  142    HZ1  LYS  19           3HZ      LYS  19   3.766 -13.027   3.096
  143    HZ2  LYS  19           1HZ      LYS  19   2.511 -13.990   2.501
  144    HZ3  LYS  19           2HZ      LYS  19   2.714 -12.411   1.919
  145    H    LEU  20           H        LEU  20  -0.014 -11.833  -3.404
  146    HA   LEU  20           HA       LEU  20   0.748  -9.288  -4.399
  147    HB2  LEU  20           1HB      LEU  20  -1.482 -10.536  -4.696
  148    HB3  LEU  20           2HB      LEU  20  -1.902  -9.906  -3.118
  149    HG   LEU  20           HG       LEU  20  -2.803  -8.602  -5.067
  150   HD11  LEU  20          1HD1      LEU  20  -0.954  -7.100  -3.223
  151   HD12  LEU  20          2HD1      LEU  20  -2.606  -7.592  -2.852
  152   HD13  LEU  20          3HD1      LEU  20  -2.302  -6.414  -4.130
  153   HD21  LEU  20          3HD2      LEU  20   0.077  -7.788  -5.400
  154   HD22  LEU  20          1HD2      LEU  20  -1.307  -7.144  -6.279
  155   HD23  LEU  20          2HD2      LEU  20  -0.827  -8.826  -6.503
  156    H    VAL  21           H        VAL  21   1.785  -7.853  -3.238
  157    HA   VAL  21           HA       VAL  21   0.893  -7.389  -0.478
  158    HB   VAL  21           HB       VAL  21   3.250  -7.876  -0.540
  159   HG11  VAL  21          1HG1      VAL  21   4.843  -6.512  -1.816
  160   HG12  VAL  21          2HG1      VAL  21   3.495  -5.661  -2.573
  161   HG13  VAL  21          3HG1      VAL  21   3.728  -7.385  -2.866
  162   HG21  VAL  21          3HG2      VAL  21   4.174  -5.798   0.407
  163   HG22  VAL  21          1HG2      VAL  21   2.573  -6.178   1.039
  164   HG23  VAL  21          2HG2      VAL  21   2.762  -4.923  -0.185
  165    H    VAL  22           H        VAL  22  -0.455  -5.733  -0.257
  166    HA   VAL  22           HA       VAL  22  -0.177  -3.467  -2.087
  167    HB   VAL  22           HB       VAL  22  -2.328  -4.151  -2.413
  168   HG11  VAL  22          1HG1      VAL  22  -2.490  -5.955  -0.950
  169   HG12  VAL  22          2HG1      VAL  22  -3.865  -4.902  -0.617
  170   HG13  VAL  22          3HG1      VAL  22  -2.475  -4.902   0.469
  171   HG21  VAL  22          3HG2      VAL  22  -2.603  -2.267  -0.084
  172   HG22  VAL  22          1HG2      VAL  22  -3.866  -2.624  -1.262
  173   HG23  VAL  22          2HG2      VAL  22  -2.388  -1.810  -1.774
  174    H    VAL  23           H        VAL  23   0.646  -1.718  -1.309
  175    HA   VAL  23           HA       VAL  23   0.937  -1.520   1.600
  176    HB   VAL  23           HB       VAL  23   2.526  -0.130  -0.558
  177   HG11  VAL  23          1HG1      VAL  23   2.403   1.200   1.472
  178   HG12  VAL  23          2HG1      VAL  23   4.016   0.510   1.298
  179   HG13  VAL  23          3HG1      VAL  23   2.874  -0.197   2.440
  180   HG21  VAL  23          3HG2      VAL  23   3.174  -2.477   1.218
  181   HG22  VAL  23          1HG2      VAL  23   4.347  -1.635   0.204
  182   HG23  VAL  23          2HG2      VAL  23   2.998  -2.495  -0.539
  183    H    ALA  24           H        ALA  24  -0.043  -0.080   2.676
  184    HA   ALA  24           HA       ALA  24  -1.612   2.016   1.382
  185    HB1  ALA  24           1HB      ALA  24  -2.267   0.505   3.411
  186    HB2  ALA  24           2HB      ALA  24  -2.695   2.214   3.444
  187    HB3  ALA  24           3HB      ALA  24  -1.302   1.638   4.351
  188    H    PHE  25           H        PHE  25  -0.164   3.606   0.708
  189    HA   PHE  25           HA       PHE  25   1.771   4.568   2.700
  190    HB2  PHE  25           1HB      PHE  25   2.204   3.788   0.118
  191    HB3  PHE  25           2HB      PHE  25   2.048   5.534  -0.057
  192    HD1  PHE  25           1HD      PHE  25   3.596   7.034   1.046
  193    HD2  PHE  25           2HD      PHE  25   4.035   2.818   1.295
  194    HE1  PHE  25           1HE      PHE  25   5.898   7.323   1.850
  195    HE2  PHE  25           2HE      PHE  25   6.341   3.099   2.092
  196    HZ   PHE  25           HZ       PHE  25   7.274   5.361   2.367
  197    H    TYR  26           H        TYR  26   1.084   6.279   3.774
  198    HA   TYR  26           HA       TYR  26  -0.131   8.502   2.332
  199    HB2  TYR  26           1HB      TYR  26  -1.949   8.668   4.069
  200    HB3  TYR  26           2HB      TYR  26  -2.098   7.296   2.979
  201    HD1  TYR  26           2HD      TYR  26  -1.513   5.015   3.792
  202    HD2  TYR  26           1HD      TYR  26  -1.702   8.352   6.418
  203    HE1  TYR  26           2HE      TYR  26  -1.662   3.491   5.703
  204    HE2  TYR  26           1HE      TYR  26  -1.848   6.835   8.343
  205    HH   TYR  26           HH       TYR  26  -1.034   3.666   8.218
  206    H    ALA  27           H        ALA  27  -0.767  10.141   4.402
  207    HA   ALA  27           HA       ALA  27   1.608  10.230   6.119
  208    HB1  ALA  27           1HB      ALA  27   0.565  12.620   4.609
  209    HB2  ALA  27           2HB      ALA  27   1.962  11.669   4.116
  210    HB3  ALA  27           3HB      ALA  27   1.992  12.551   5.643
  211    H    THR  28           H        THR  28   1.224  10.943   8.142
  212    HA   THR  28           HA       THR  28  -1.378  10.813   9.139
  213    HB   THR  28           HB       THR  28  -0.145  11.991  11.181
  214    HG1  THR  28           1HG      THR  28   2.157  11.116  10.865
  215   HG21  THR  28          3HG2      THR  28  -0.965   9.696  11.173
  216   HG22  THR  28          1HG2      THR  28   0.654   9.767  11.867
  217   HG23  THR  28          2HG2      THR  28   0.425   9.186  10.217
  218    H    TRP  29           H        TRP  29   0.386  13.552   7.924
  219    HA   TRP  29           HA       TRP  29  -1.417  15.439   9.191
  220    HB2  TRP  29           1HB      TRP  29  -0.072  17.175   8.084
  221    HB3  TRP  29           2HB      TRP  29   0.930  16.065   9.006
  222    HD1  TRP  29           HD       TRP  29   2.837  14.829   7.724
  223    HE1  TRP  29           1HE      TRP  29   3.684  14.869   5.292
  224    HE3  TRP  29           3HE      TRP  29  -1.002  17.419   5.561
  225    HZ2  TRP  29           2HZ      TRP  29   2.830  15.859   2.794
  226    HZ3  TRP  29           3HZ      TRP  29  -0.916  17.865   3.149
  227    HH2  TRP  29           HH       TRP  29   0.967  17.104   1.791
  228    H    CYS  30           H        CYS  30  -1.492  13.524   6.474
  229    HA   CYS  30           HA       CYS  30  -2.616  15.412   4.618
  230    HB2  CYS  30           1HB      CYS  30  -1.313  13.554   3.773
  231    HB3  CYS  30           2HB      CYS  30  -2.386  12.397   4.546
  232    HG   CYS  30           HG       CYS  30  -3.208  14.441   1.922
  233    H    GLY  31           H        GLY  31  -4.776  15.168   3.675
  234    HA2  GLY  31           1HA      GLY  31  -6.756  15.051   5.725
  235    HA3  GLY  31           2HA      GLY  31  -7.046  15.324   4.017
  236    HA   PRO  32           HA       PRO  32  -8.869  11.412   3.638
  237    HB2  PRO  32           1HB      PRO  32  -7.597  10.764   1.104
  238    HB3  PRO  32           2HB      PRO  32  -9.251  11.289   1.418
  239    HG2  PRO  32           1HG      PRO  32  -7.429  12.842   0.144
  240    HG3  PRO  32           2HG      PRO  32  -8.745  13.505   1.130
  241    HD2  PRO  32           1HD      PRO  32  -5.860  13.113   1.837
  242    HD3  PRO  32           2HD      PRO  32  -6.929  14.488   2.189
  243    H    CYS  33           H        CYS  33  -5.795  11.410   4.491
  244    HA   CYS  33           HA       CYS  33  -4.746   8.906   3.781
  245    HB2  CYS  33           1HB      CYS  33  -3.340   9.142   5.789
  246    HB3  CYS  33           2HB      CYS  33  -3.397  10.639   4.869
  247    HG   CYS  33           HG       CYS  33  -4.429  12.156   6.712
  248    H    LYS  34           H        LYS  34  -7.013   9.919   6.211
  249    HA   LYS  34           HA       LYS  34  -7.080   7.495   7.676
  250    HB2  LYS  34           1HB      LYS  34  -9.131   9.704   7.502
  251    HB3  LYS  34           2HB      LYS  34  -9.117   8.413   8.695
  252    HG2  LYS  34           1HG      LYS  34  -7.029   9.224   9.604
  253    HG3  LYS  34           2HG      LYS  34  -6.946  10.472   8.361
  254    HD2  LYS  34           1HD      LYS  34  -7.750  11.449  10.410
  255    HD3  LYS  34           2HD      LYS  34  -9.061  11.419   9.231
  256    HE2  LYS  34           1HE      LYS  34  -9.921  10.749  11.373
  257    HE3  LYS  34           2HE      LYS  34  -9.914   9.353  10.300
  258    HZ1  LYS  34           3HZ      LYS  34  -7.839   9.934  12.343
  259    HZ2  LYS  34           1HZ      LYS  34  -7.917   8.557  11.362
  260    HZ3  LYS  34           2HZ      LYS  34  -9.104   8.831  12.534
  261    H    MET  35           H        MET  35  -8.215   8.199   4.557
  262    HA   MET  35           HA       MET  35 -10.487   6.391   4.780
  263    HB2  MET  35           1HB      MET  35 -10.420   8.356   3.147
  264    HB3  MET  35           2HB      MET  35  -9.280   7.390   2.201
  265    HG2  MET  35           1HG      MET  35 -10.933   5.610   2.013
  266    HG3  MET  35           2HG      MET  35 -12.071   6.555   2.966
  267    HE1  MET  35           3HE      MET  35 -13.824   6.027   0.823
  268    HE2  MET  35           1HE      MET  35 -12.437   5.147   0.175
  269    HE3  MET  35           2HE      MET  35 -13.292   6.312  -0.837
  270    H    ILE  36           H        ILE  36  -7.143   6.363   3.902
  271    HA   ILE  36           HA       ILE  36  -7.247   3.805   2.623
  272    HB   ILE  36           HB       ILE  36  -5.159   5.784   3.224
  273   HG12  ILE  36          1HG1      ILE  36  -4.514   5.292   0.941
  274   HG13  ILE  36          2HG1      ILE  36  -5.560   3.879   0.923
  275   HG21  ILE  36          1HG2      ILE  36  -4.475   2.868   2.969
  276   HG22  ILE  36          2HG2      ILE  36  -4.138   3.917   4.347
  277   HG23  ILE  36          3HG2      ILE  36  -3.322   4.191   2.807
  278   HD11  ILE  36          3HD1      ILE  36  -6.628   5.666  -0.255
  279   HD12  ILE  36          1HD1      ILE  36  -6.424   6.746   1.126
  280   HD13  ILE  36          2HD1      ILE  36  -7.500   5.358   1.253
  281    H    ALA  37           H        ALA  37  -6.778   5.015   5.826
  282    HA   ALA  37           HA       ALA  37  -5.702   2.800   7.077
  283    HB1  ALA  37           1HB      ALA  37  -7.100   3.571   9.088
  284    HB2  ALA  37           2HB      ALA  37  -7.634   4.886   8.037
  285    HB3  ALA  37           3HB      ALA  37  -5.924   4.692   8.408
  286    HA   PRO  38           HA       PRO  38  -9.795   0.616   7.712
  287    HB2  PRO  38           1HB      PRO  38 -12.192   1.630   7.123
  288    HB3  PRO  38           2HB      PRO  38 -11.307   2.142   8.566
  289    HG2  PRO  38           1HG      PRO  38 -11.588   3.518   5.929
  290    HG3  PRO  38           2HG      PRO  38 -11.632   4.205   7.563
  291    HD2  PRO  38           1HD      PRO  38  -9.421   4.228   5.906
  292    HD3  PRO  38           2HD      PRO  38  -9.368   4.374   7.671
  293    H    MET  39           H        MET  39  -9.845   2.336   4.576
  294    HA   MET  39           HA       MET  39 -11.522   0.407   3.303
  295    HB2  MET  39           1HB      MET  39 -11.401   2.517   2.206
  296    HB3  MET  39           2HB      MET  39  -9.653   2.537   2.295
  297    HG2  MET  39           1HG      MET  39 -10.011   0.334   0.801
  298    HG3  MET  39           2HG      MET  39 -11.436   1.265   0.341
  299    HE1  MET  39           3HE      MET  39  -8.077   2.494   1.608
  300    HE2  MET  39           1HE      MET  39  -7.300   3.230   0.201
  301    HE3  MET  39           2HE      MET  39  -7.323   1.474   0.388
  302    H    ILE  40           H        ILE  40  -8.048   0.847   3.584
  303    HA   ILE  40           HA       ILE  40  -7.402  -1.365   1.906
  304    HB   ILE  40           HB       ILE  40  -6.033   0.761   3.167
  305   HG12  ILE  40          1HG1      ILE  40  -4.794  -1.306   1.371
  306   HG13  ILE  40          2HG1      ILE  40  -6.018  -0.189   0.776
  307   HG21  ILE  40          1HG2      ILE  40  -5.343  -0.768   4.924
  308   HG22  ILE  40          2HG2      ILE  40  -3.968  -0.341   3.907
  309   HG23  ILE  40          3HG2      ILE  40  -4.748  -1.911   3.721
  310   HD11  ILE  40          3HD1      ILE  40  -4.653   1.662   1.113
  311   HD12  ILE  40          1HD1      ILE  40  -3.591   0.436   0.421
  312   HD13  ILE  40          2HD1      ILE  40  -3.546   0.767   2.152
  313    H    GLU  41           H        GLU  41  -7.664  -0.833   5.387
  314    HA   GLU  41           HA       GLU  41  -6.891  -3.401   6.211
  315    HB2  GLU  41           1HB      GLU  41  -7.341  -1.474   7.737
  316    HB3  GLU  41           2HB      GLU  41  -9.062  -1.679   7.442
  317    HG2  GLU  41           1HG      GLU  41  -8.864  -3.994   8.347
  318    HG3  GLU  41           2HG      GLU  41  -7.201  -3.619   8.791
  319    H    LYS  42           H        LYS  42  -9.972  -2.158   5.011
  320    HA   LYS  42           HA       LYS  42 -11.520  -4.471   5.428
  321    HB2  LYS  42           1HB      LYS  42 -11.805  -2.094   3.633
  322    HB3  LYS  42           2HB      LYS  42 -12.914  -3.453   3.496
  323    HG2  LYS  42           1HG      LYS  42 -13.483  -3.176   5.884
  324    HG3  LYS  42           2HG      LYS  42 -12.445  -1.749   5.930
  325    HD2  LYS  42           1HD      LYS  42 -13.821  -0.666   4.247
  326    HD3  LYS  42           2HD      LYS  42 -14.828  -2.109   4.116
  327    HE2  LYS  42           1HE      LYS  42 -15.945  -0.480   5.490
  328    HE3  LYS  42           2HE      LYS  42 -15.454  -1.845   6.490
  329    HZ1  LYS  42           3HZ      LYS  42 -14.988   0.237   7.591
  330    HZ2  LYS  42           1HZ      LYS  42 -14.052   0.763   6.287
  331    HZ3  LYS  42           2HZ      LYS  42 -13.538  -0.548   7.222
  332    H    PHE  43           H        PHE  43  -9.371  -3.548   2.801
  333    HA   PHE  43           HA       PHE  43 -10.148  -5.412   0.878
  334    HB2  PHE  43           1HB      PHE  43  -7.332  -4.493   1.521
  335    HB3  PHE  43           2HB      PHE  43  -7.796  -5.374   0.063
  336    HD1  PHE  43           1HD      PHE  43 -10.548  -3.689   0.072
  337    HD2  PHE  43           2HD      PHE  43  -6.397  -2.771   0.043
  338    HE1  PHE  43           1HE      PHE  43 -11.030  -1.570  -1.074
  339    HE2  PHE  43           2HE      PHE  43  -6.873  -0.647  -1.098
  340    HZ   PHE  43           HZ       PHE  43  -9.191  -0.045  -1.654
  341    H    SER  44           H        SER  44  -7.487  -5.855   3.266
  342    HA   SER  44           HA       SER  44  -7.364  -8.653   2.679
  343    HB2  SER  44           1HB      SER  44  -6.135  -7.274   5.062
  344    HB3  SER  44           2HB      SER  44  -5.618  -8.761   4.260
  345    HG   SER  44           HG       SER  44  -4.360  -7.474   3.174
  346    H    GLU  45           H        GLU  45  -9.283  -6.734   4.743
  347    HA   GLU  45           HA       GLU  45 -10.057  -8.597   6.690
  348    HB2  GLU  45           1HB      GLU  45 -10.723  -6.216   6.692
  349    HB3  GLU  45           2HB      GLU  45 -11.731  -6.505   5.283
  350    HG2  GLU  45           1HG      GLU  45 -13.091  -8.066   6.629
  351    HG3  GLU  45           2HG      GLU  45 -12.120  -7.641   8.039
  352    H    GLN  46           H        GLN  46 -10.924  -8.174   3.323
  353    HA   GLN  46           HA       GLN  46 -12.796 -10.375   3.351
  354    HB2  GLN  46           1HB      GLN  46 -11.693  -8.648   1.131
  355    HB3  GLN  46           2HB      GLN  46 -12.820  -9.968   0.859
  356    HG2  GLN  46           1HG      GLN  46 -13.529  -7.824   2.796
  357    HG3  GLN  46           2HG      GLN  46 -13.656  -7.509   1.067
  358   HE21  GLN  46          1HE2      GLN  46 -14.216 -10.679   2.446
  359   HE22  GLN  46          2HE2      GLN  46 -15.920 -10.706   2.166
  360    H    TYR  47           H        TYR  47  -9.604  -9.629   2.013
  361    HA   TYR  47           HA       TYR  47  -9.142 -12.512   1.732
  362    HB2  TYR  47           1HB      TYR  47  -7.691 -11.753  -0.296
  363    HB3  TYR  47           2HB      TYR  47  -9.430 -11.936  -0.464
  364    HD1  TYR  47           2HD      TYR  47  -6.733  -9.413  -0.035
  365    HD2  TYR  47           1HD      TYR  47 -10.800 -10.141  -1.058
  366    HE1  TYR  47           2HE      TYR  47  -6.940  -7.099  -0.871
  367    HE2  TYR  47           1HE      TYR  47 -11.013  -7.835  -1.874
  368    HH   TYR  47           HH       TYR  47  -8.379  -5.831  -2.434
  369    HA   PRO  48           HA       PRO  48  -5.687 -10.851   4.255
  370    HB2  PRO  48           1HB      PRO  48  -5.467 -13.003   5.859
  371    HB3  PRO  48           2HB      PRO  48  -6.649 -11.726   6.150
  372    HG2  PRO  48           1HG      PRO  48  -7.037 -14.394   4.846
  373    HG3  PRO  48           2HG      PRO  48  -8.057 -13.579   6.045
  374    HD2  PRO  48           1HD      PRO  48  -8.629 -13.568   3.398
  375    HD3  PRO  48           2HD      PRO  48  -9.041 -12.216   4.469
  376    H    GLN  49           H        GLN  49  -6.123 -13.290   2.013
  377    HA   GLN  49           HA       GLN  49  -3.641 -14.597   2.114
  378    HB2  GLN  49           1HB      GLN  49  -4.095 -15.219  -0.246
  379    HB3  GLN  49           2HB      GLN  49  -5.403 -15.599   0.861
  380    HG2  GLN  49           1HG      GLN  49  -6.561 -14.668  -0.829
  381    HG3  GLN  49           2HG      GLN  49  -6.218 -13.264   0.177
  382   HE21  GLN  49          1HE2      GLN  49  -6.464 -11.873  -1.599
  383   HE22  GLN  49          2HE2      GLN  49  -5.242 -11.739  -2.812
  384    H    ALA  50           H        ALA  50  -4.456 -11.451   1.298
  385    HA   ALA  50           HA       ALA  50  -2.007 -11.036  -0.268
  386    HB1  ALA  50           1HB      ALA  50  -4.311  -9.177   0.333
  387    HB2  ALA  50           2HB      ALA  50  -4.007 -10.007  -1.195
  388    HB3  ALA  50           3HB      ALA  50  -2.896  -8.755  -0.630
  389    H    ASP  51           H        ASP  51  -0.575  -9.277   0.397
  390    HA   ASP  51           HA       ASP  51  -0.360  -9.348   3.289
  391    HB2  ASP  51           1HB      ASP  51   1.618  -8.656   1.138
  392    HB3  ASP  51           2HB      ASP  51   1.915  -8.263   2.823
  393    H    PHE  52           H        PHE  52  -0.709  -7.782   4.565
  394    HA   PHE  52           HA       PHE  52  -1.588  -5.230   3.435
  395    HB2  PHE  52           1HB      PHE  52  -2.486  -5.121   5.944
  396    HB3  PHE  52           2HB      PHE  52  -3.373  -5.967   4.684
  397    HD1  PHE  52           2HD      PHE  52  -1.080  -6.424   7.552
  398    HD2  PHE  52           1HD      PHE  52  -3.703  -8.308   4.783
  399    HE1  PHE  52           2HE      PHE  52  -0.976  -8.498   8.868
  400    HE2  PHE  52           1HE      PHE  52  -3.603 -10.385   6.095
  401    HZ   PHE  52           HZ       PHE  52  -2.237 -10.482   8.141
  402    H    TYR  53           H        TYR  53  -0.062  -3.690   3.498
  403    HA   TYR  53           HA       TYR  53   1.255  -3.253   6.080
  404    HB2  TYR  53           1HB      TYR  53   2.694  -3.276   3.414
  405    HB3  TYR  53           2HB      TYR  53   3.377  -2.670   4.915
  406    HD1  TYR  53           1HD      TYR  53   3.833  -4.274   6.782
  407    HD2  TYR  53           2HD      TYR  53   2.691  -5.582   2.903
  408    HE1  TYR  53           1HE      TYR  53   4.716  -6.513   7.283
  409    HE2  TYR  53           2HE      TYR  53   3.566  -7.827   3.387
  410    HH   TYR  53           HH       TYR  53   4.450  -8.809   6.544
  411    H    LYS  54           H        LYS  54   1.957  -1.118   6.464
  412    HA   LYS  54           HA       LYS  54   1.060   0.926   4.607
  413    HB2  LYS  54           1HB      LYS  54  -0.495   1.943   6.109
  414    HB3  LYS  54           2HB      LYS  54  -0.909   0.240   5.957
  415    HG2  LYS  54           1HG      LYS  54   0.214  -0.175   8.126
  416    HG3  LYS  54           2HG      LYS  54   0.451   1.567   8.289
  417    HD2  LYS  54           1HD      LYS  54  -1.989   1.893   8.108
  418    HD3  LYS  54           2HD      LYS  54  -2.199   0.146   8.013
  419    HE2  LYS  54           1HE      LYS  54  -2.651   0.725  10.251
  420    HE3  LYS  54           2HE      LYS  54  -1.040   0.018  10.255
  421    HZ1  LYS  54           3HZ      LYS  54  -1.667   2.920  10.315
  422    HZ2  LYS  54           1HZ      LYS  54  -0.110   2.262  10.284
  423    HZ3  LYS  54           2HZ      LYS  54  -1.114   1.997  11.616
  424    H    LEU  55           H        LEU  55   1.833   3.062   5.133
  425    HA   LEU  55           HA       LEU  55   3.643   3.413   7.340
  426    HB2  LEU  55           1HB      LEU  55   5.021   2.111   5.787
  427    HB3  LEU  55           2HB      LEU  55   4.673   3.246   4.501
  428    HG   LEU  55           HG       LEU  55   6.115   4.168   6.981
  429   HD11  LEU  55          1HD1      LEU  55   8.214   3.767   5.618
  430   HD12  LEU  55          2HD1      LEU  55   7.240   2.708   4.595
  431   HD13  LEU  55          3HD1      LEU  55   7.459   2.330   6.303
  432   HD21  LEU  55          3HD2      LEU  55   6.849   5.915   5.619
  433   HD22  LEU  55          1HD2      LEU  55   5.150   5.697   5.196
  434   HD23  LEU  55          2HD2      LEU  55   6.412   5.061   4.139
  435    H    ASP  56           H        ASP  56   4.129   5.588   7.677
  436    HA   ASP  56           HA       ASP  56   2.545   7.481   6.112
  437    HB2  ASP  56           1HB      ASP  56   3.806   7.609   8.850
  438    HB3  ASP  56           2HB      ASP  56   3.080   9.001   8.067
  439    H    VAL  57           H        VAL  57   3.511   8.826   4.704
  440    HA   VAL  57           HA       VAL  57   6.322   8.867   4.311
  441    HB   VAL  57           HB       VAL  57   5.967  10.174   2.490
  442   HG11  VAL  57          1HG1      VAL  57   4.313   8.366   2.360
  443   HG12  VAL  57          2HG1      VAL  57   3.828   9.801   1.461
  444   HG13  VAL  57          3HG1      VAL  57   3.096   9.453   3.028
  445   HG21  VAL  57          3HG2      VAL  57   3.882  11.716   4.018
  446   HG22  VAL  57          1HG2      VAL  57   4.335  12.032   2.343
  447   HG23  VAL  57          2HG2      VAL  57   5.522  12.230   3.631
  448    H    ASP  58           H        ASP  58   4.182  10.627   6.339
  449    HA   ASP  58           HA       ASP  58   5.683  12.906   6.947
  450    HB2  ASP  58           1HB      ASP  58   3.387  12.651   7.722
  451    HB3  ASP  58           2HB      ASP  58   3.837  11.257   8.697
  452    H    GLU  59           H        GLU  59   5.866   9.593   8.055
  453    HA   GLU  59           HA       GLU  59   7.998  10.209   9.926
  454    HB2  GLU  59           1HB      GLU  59   6.238   8.516  10.445
  455    HB3  GLU  59           2HB      GLU  59   6.864   7.518   9.140
  456    HG2  GLU  59           1HG      GLU  59   7.702   6.705  11.231
  457    HG3  GLU  59           2HG      GLU  59   9.032   7.405  10.311
  458    H    LEU  60           H        LEU  60   7.587   8.458   6.837
  459    HA   LEU  60           HA       LEU  60  10.520   8.538   6.563
  460    HB2  LEU  60           1HB      LEU  60   8.732   6.211   5.882
  461    HB3  LEU  60           2HB      LEU  60  10.456   6.291   5.581
  462    HG   LEU  60           HG       LEU  60   9.277   6.495   8.346
  463   HD11  LEU  60          1HD1      LEU  60  10.279   4.064   6.882
  464   HD12  LEU  60          2HD1      LEU  60   8.638   4.355   7.459
  465   HD13  LEU  60          3HD1      LEU  60   9.953   4.139   8.612
  466   HD21  LEU  60          3HD2      LEU  60  11.530   7.392   8.083
  467   HD22  LEU  60          1HD2      LEU  60  12.057   5.874   7.358
  468   HD23  LEU  60          2HD2      LEU  60  11.543   5.914   9.044
  469    H    GLY  61           H        GLY  61  10.473  10.260   5.154
  470    HA2  GLY  61           1HA      GLY  61   8.767  10.306   2.844
  471    HA3  GLY  61           2HA      GLY  61  10.023  11.466   3.239
  472    H    ASP  62           H        ASP  62  12.143   9.453   3.434
  473    HA   ASP  62           HA       ASP  62  12.877   9.390   0.682
  474    HB2  ASP  62           1HB      ASP  62  14.123   8.089   3.099
  475    HB3  ASP  62           2HB      ASP  62  14.814   7.981   1.486
  476    H    VAL  63           H        VAL  63  11.456   7.136   2.874
  477    HA   VAL  63           HA       VAL  63  11.548   4.841   1.249
  478    HB   VAL  63           HB       VAL  63   9.422   5.687   3.209
  479   HG11  VAL  63          1HG1      VAL  63  10.004   3.006   1.957
  480   HG12  VAL  63          2HG1      VAL  63   8.544   3.975   1.775
  481   HG13  VAL  63          3HG1      VAL  63   8.928   3.245   3.331
  482   HG21  VAL  63          3HG2      VAL  63  11.717   5.490   4.149
  483   HG22  VAL  63          1HG2      VAL  63  11.747   3.809   3.614
  484   HG23  VAL  63          2HG2      VAL  63  10.577   4.326   4.827
  485    H    ALA  64           H        ALA  64   9.026   7.351   1.618
  486    HA   ALA  64           HA       ALA  64   7.230   6.603  -0.286
  487    HB1  ALA  64           1HB      ALA  64   7.096   8.628   1.168
  488    HB2  ALA  64           2HB      ALA  64   6.602   8.896  -0.502
  489    HB3  ALA  64           3HB      ALA  64   8.189   9.436   0.047
  490    H    GLN  65           H        GLN  65  10.305   8.224  -0.812
  491    HA   GLN  65           HA       GLN  65   9.869   8.650  -3.615
  492    HB2  GLN  65           1HB      GLN  65  12.468   8.674  -2.068
  493    HB3  GLN  65           2HB      GLN  65  12.221   9.330  -3.679
  494    HG2  GLN  65           1HG      GLN  65  10.936  10.310  -1.140
  495    HG3  GLN  65           2HG      GLN  65  12.255  11.089  -2.012
  496   HE21  GLN  65          1HE2      GLN  65  11.093  10.481  -4.632
  497   HE22  GLN  65          2HE2      GLN  65   9.769  11.574  -4.821
  498    H    LYS  66           H        LYS  66  11.415   6.177  -1.682
  499    HA   LYS  66           HA       LYS  66  12.697   4.748  -3.685
  500    HB2  LYS  66           1HB      LYS  66  13.368   3.990  -1.660
  501    HB3  LYS  66           2HB      LYS  66  11.829   4.373  -0.901
  502    HG2  LYS  66           1HG      LYS  66  11.992   2.092  -0.697
  503    HG3  LYS  66           2HG      LYS  66  10.941   2.320  -2.087
  504    HD2  LYS  66           1HD      LYS  66  12.809   1.896  -3.594
  505    HD3  LYS  66           2HD      LYS  66  13.896   1.717  -2.215
  506    HE2  LYS  66           1HE      LYS  66  12.567  -0.197  -1.437
  507    HE3  LYS  66           2HE      LYS  66  11.516  -0.031  -2.842
  508    HZ1  LYS  66           3HZ      LYS  66  13.392  -0.497  -4.270
  509    HZ2  LYS  66           1HZ      LYS  66  13.198  -1.754  -3.151
  510    HZ3  LYS  66           2HZ      LYS  66  14.426  -0.607  -2.938
  511    H    ASN  67           H        ASN  67   9.331   5.039  -2.907
  512    HA   ASN  67           HA       ASN  67   8.682   2.533  -4.281
  513    HB2  ASN  67           1HB      ASN  67   6.803   4.234  -2.690
  514    HB3  ASN  67           2HB      ASN  67   6.672   2.535  -3.082
  515   HD21  ASN  67          1HD2      ASN  67   6.857   4.291  -0.614
  516   HD22  ASN  67          2HD2      ASN  67   7.933   3.426   0.400
  517    H    GLU  68           H        GLU  68   8.752   5.850  -4.694
  518    HA   GLU  68           HA       GLU  68   8.142   7.156  -6.452
  519    HB2  GLU  68           1HB      GLU  68   6.459   4.836  -7.399
  520    HB3  GLU  68           2HB      GLU  68   6.747   6.330  -8.288
  521    HG2  GLU  68           1HG      GLU  68   9.152   5.768  -8.380
  522    HG3  GLU  68           2HG      GLU  68   8.789   4.234  -7.587
  523    H    VAL  69           H        VAL  69   6.707   6.790  -3.876
  524    HA   VAL  69           HA       VAL  69   4.068   7.722  -4.739
  525    HB   VAL  69           HB       VAL  69   3.598   5.989  -3.295
  526   HG11  VAL  69          1HG1      VAL  69   6.014   5.819  -2.480
  527   HG12  VAL  69          2HG1      VAL  69   4.729   5.307  -1.387
  528   HG13  VAL  69          3HG1      VAL  69   5.508   6.880  -1.168
  529   HG21  VAL  69          3HG2      VAL  69   2.715   6.975  -1.232
  530   HG22  VAL  69          1HG2      VAL  69   2.364   7.970  -2.644
  531   HG23  VAL  69          2HG2      VAL  69   3.656   8.433  -1.536
  532    H    SER  70           H        SER  70   3.957   9.782  -4.968
  533    HA   SER  70           HA       SER  70   5.155  11.534  -2.937
  534    HB2  SER  70           1HB      SER  70   6.080  11.921  -5.175
  535    HB3  SER  70           2HB      SER  70   4.456  12.134  -5.824
  536    HG   SER  70           HG       SER  70   5.907  13.814  -4.077
  537    H    ALA  71           H        ALA  71   2.309  10.746  -4.806
  538    HA   ALA  71           HA       ALA  71   0.686  12.803  -3.618
  539    HB1  ALA  71           1HB      ALA  71  -0.080  10.392  -5.265
  540    HB2  ALA  71           2HB      ALA  71   0.193  12.025  -5.872
  541    HB3  ALA  71           3HB      ALA  71  -1.166  11.699  -4.799
  542    H    MET  72           H        MET  72  -1.256  12.262  -2.346
  543    HA   MET  72           HA       MET  72  -1.149   9.781  -0.864
  544    HB2  MET  72           1HB      MET  72  -1.044  10.968   1.334
  545    HB3  MET  72           2HB      MET  72   0.443  11.053   0.400
  546    HG2  MET  72           1HG      MET  72  -0.225  13.310  -0.366
  547    HG3  MET  72           2HG      MET  72  -1.623  13.217   0.703
  548    HE1  MET  72           3HE      MET  72   2.768  13.356   2.091
  549    HE2  MET  72           1HE      MET  72   2.235  13.312   0.412
  550    HE3  MET  72           2HE      MET  72   2.071  11.878   1.429
  551    HA   PRO  73           HA       PRO  73  -2.051   8.857   0.653
  552    HB2  PRO  73           1HB      PRO  73  -4.038   7.080   0.941
  553    HB3  PRO  73           2HB      PRO  73  -3.773   8.393   2.086
  554    HG2  PRO  73           1HG      PRO  73  -5.818   8.138  -0.068
  555    HG3  PRO  73           2HG      PRO  73  -5.965   8.882   1.544
  556    HD2  PRO  73           1HD      PRO  73  -5.560  10.249  -0.857
  557    HD3  PRO  73           2HD      PRO  73  -5.248  10.900   0.762
  558    H    THR  74           H        THR  74  -1.269   6.935  -0.182
  559    HA   THR  74           HA       THR  74  -2.059   6.306  -2.956
  560    HB   THR  74           HB       THR  74   0.677   6.591  -1.716
  561    HG1  THR  74           1HG      THR  74   0.307   8.405  -2.775
  562   HG21  THR  74          3HG2      THR  74   0.128   5.220  -4.356
  563   HG22  THR  74          1HG2      THR  74   0.625   4.401  -2.872
  564   HG23  THR  74          2HG2      THR  74   1.710   5.559  -3.639
  565    H    LEU  75           H        LEU  75  -2.096   4.225  -3.573
  566    HA   LEU  75           HA       LEU  75  -1.539   2.164  -1.535
  567    HB2  LEU  75           1HB      LEU  75  -3.497   2.013  -3.817
  568    HB3  LEU  75           2HB      LEU  75  -3.275   0.828  -2.546
  569    HG   LEU  75           HG       LEU  75  -3.957   2.968  -1.061
  570   HD11  LEU  75          1HD1      LEU  75  -5.551   3.285  -3.616
  571   HD12  LEU  75          2HD1      LEU  75  -4.273   4.382  -3.085
  572   HD13  LEU  75          3HD1      LEU  75  -5.740   4.205  -2.123
  573   HD21  LEU  75          3HD2      LEU  75  -5.013   0.920  -0.777
  574   HD22  LEU  75          1HD2      LEU  75  -5.628   0.904  -2.426
  575   HD23  LEU  75          2HD2      LEU  75  -6.307   2.022  -1.250
  576    H    LEU  76           H        LEU  76   0.119   0.853  -2.144
  577    HA   LEU  76           HA       LEU  76   0.651   0.622  -5.031
  578    HB2  LEU  76           1HB      LEU  76   2.435   1.300  -2.799
  579    HB3  LEU  76           2HB      LEU  76   3.068   0.104  -3.905
  580    HG   LEU  76           HG       LEU  76   2.098   2.851  -4.707
  581   HD11  LEU  76          1HD1      LEU  76   4.503   3.314  -5.114
  582   HD12  LEU  76          2HD1      LEU  76   4.891   1.767  -4.348
  583   HD13  LEU  76          3HD1      LEU  76   4.122   3.044  -3.406
  584   HD21  LEU  76          3HD2      LEU  76   3.519   0.707  -6.285
  585   HD22  LEU  76          1HD2      LEU  76   3.128   2.326  -6.863
  586   HD23  LEU  76          2HD2      LEU  76   1.836   1.191  -6.479
  587    H    LEU  77           H        LEU  77   0.087  -1.334  -5.670
  588    HA   LEU  77           HA       LEU  77   0.565  -3.664  -3.983
  589    HB2  LEU  77           1HB      LEU  77  -0.738  -3.367  -6.692
  590    HB3  LEU  77           2HB      LEU  77  -0.515  -4.895  -5.879
  591    HG   LEU  77           HG       LEU  77  -2.121  -4.291  -4.168
  592   HD11  LEU  77          1HD1      LEU  77  -3.377  -2.198  -4.265
  593   HD12  LEU  77          2HD1      LEU  77  -2.370  -1.641  -5.600
  594   HD13  LEU  77          3HD1      LEU  77  -1.660  -1.885  -4.002
  595   HD21  LEU  77          3HD2      LEU  77  -2.970  -5.297  -6.163
  596   HD22  LEU  77          1HD2      LEU  77  -3.016  -3.739  -6.988
  597   HD23  LEU  77          2HD2      LEU  77  -4.101  -4.053  -5.637
  598    H    PHE  78           H        PHE  78   2.209  -5.060  -4.347
  599    HA   PHE  78           HA       PHE  78   3.670  -4.880  -6.898
  600    HB2  PHE  78           1HB      PHE  78   4.799  -4.846  -4.109
  601    HB3  PHE  78           2HB      PHE  78   5.753  -5.413  -5.472
  602    HD1  PHE  78           2HD      PHE  78   3.987  -2.467  -4.088
  603    HD2  PHE  78           1HD      PHE  78   6.796  -3.908  -6.935
  604    HE1  PHE  78           2HE      PHE  78   4.695  -0.163  -4.571
  605    HE2  PHE  78           1HE      PHE  78   7.500  -1.604  -7.413
  606    HZ   PHE  78           HZ       PHE  78   6.443   0.273  -6.231
  607    H    LYS  79           H        LYS  79   4.687  -6.883  -7.586
  608    HA   LYS  79           HA       LYS  79   4.379  -9.126  -5.694
  609    HB2  LYS  79           1HB      LYS  79   2.649  -9.177  -7.637
  610    HB3  LYS  79           2HB      LYS  79   4.045  -9.605  -8.640
  611    HG2  LYS  79           1HG      LYS  79   4.484 -11.542  -7.262
  612    HG3  LYS  79           2HG      LYS  79   3.140 -11.122  -6.200
  613    HD2  LYS  79           1HD      LYS  79   2.856 -11.719  -9.141
  614    HD3  LYS  79           2HD      LYS  79   2.626 -12.912  -7.862
  615    HE2  LYS  79           1HE      LYS  79   0.861 -11.441  -6.902
  616    HE3  LYS  79           2HE      LYS  79   1.037 -10.389  -8.306
  617    HZ1  LYS  79           3HZ      LYS  79  -0.802 -11.922  -8.586
  618    HZ2  LYS  79           1HZ      LYS  79   0.233 -13.246  -8.373
  619    HZ3  LYS  79           2HZ      LYS  79   0.411 -12.245  -9.724
  620    H    ASN  80           H        ASN  80   6.329  -9.902  -5.254
  621    HA   ASN  80           HA       ASN  80   8.371 -10.850  -5.568
  622    HB2  ASN  80           1HB      ASN  80   7.100 -12.182  -7.170
  623    HB3  ASN  80           2HB      ASN  80   7.393 -10.985  -8.413
  624   HD21  ASN  80          1HD2      ASN  80   8.331 -12.348  -9.772
  625   HD22  ASN  80          2HD2      ASN  80   9.898 -13.053  -9.520
  626    H    GLY  81           H        GLY  81   8.278  -8.042  -5.533
  627    HA2  GLY  81           1HA      GLY  81  10.050  -6.520  -5.573
  628    HA3  GLY  81           2HA      GLY  81  10.884  -7.560  -6.726
  629    H    LYS  82           H        LYS  82   7.896  -7.280  -8.018
  630    HA   LYS  82           HA       LYS  82   8.550  -4.737  -9.346
  631    HB2  LYS  82           1HB      LYS  82   7.766  -5.558 -11.442
  632    HB3  LYS  82           2HB      LYS  82   8.895  -6.751 -10.824
  633    HG2  LYS  82           1HG      LYS  82   7.120  -8.213 -10.192
  634    HG3  LYS  82           2HG      LYS  82   5.910  -6.982 -10.557
  635    HD2  LYS  82           1HD      LYS  82   6.469  -7.071 -12.905
  636    HD3  LYS  82           2HD      LYS  82   7.787  -8.197 -12.581
  637    HE2  LYS  82           1HE      LYS  82   4.881  -8.753 -12.012
  638    HE3  LYS  82           2HE      LYS  82   5.736  -9.285 -13.461
  639    HZ1  LYS  82           3HZ      LYS  82   5.633 -11.022 -11.780
  640    HZ2  LYS  82           1HZ      LYS  82   6.448 -10.032 -10.678
  641    HZ3  LYS  82           2HZ      LYS  82   7.233 -10.560 -12.077
  642    H    GLU  83           H        GLU  83   6.588  -3.672 -10.237
  643    HA   GLU  83           HA       GLU  83   4.651  -3.440  -8.194
  644    HB2  GLU  83           1HB      GLU  83   5.480  -1.698  -9.887
  645    HB3  GLU  83           2HB      GLU  83   4.375  -2.444 -11.027
  646    HG2  GLU  83           1HG      GLU  83   2.477  -1.845  -9.687
  647    HG3  GLU  83           2HG      GLU  83   3.537  -1.284  -8.383
  648    H    VAL  84           H        VAL  84   2.251  -3.498  -8.787
  649    HA   VAL  84           HA       VAL  84   1.526  -5.069 -11.092
  650    HB   VAL  84           HB       VAL  84  -0.352  -6.163  -9.645
  651   HG11  VAL  84          1HG1      VAL  84   1.380  -7.354 -10.975
  652   HG12  VAL  84          2HG1      VAL  84   0.887  -8.199  -9.508
  653   HG13  VAL  84          3HG1      VAL  84   2.425  -7.326  -9.550
  654   HG21  VAL  84          3HG2      VAL  84   0.294  -5.089  -7.574
  655   HG22  VAL  84          1HG2      VAL  84   1.871  -5.868  -7.653
  656   HG23  VAL  84          2HG2      VAL  84   0.416  -6.844  -7.445
  657    H    ALA  85           H        ALA  85   0.785  -2.859  -8.515
  658    HA   ALA  85           HA       ALA  85  -0.997  -1.486 -10.298
  659    HB1  ALA  85           1HB      ALA  85  -2.931  -1.451  -8.942
  660    HB2  ALA  85           2HB      ALA  85  -2.085  -2.233  -7.612
  661    HB3  ALA  85           3HB      ALA  85  -2.444  -3.142  -9.081
  662    H    LYS  86           H        LYS  86  -1.284   0.655  -9.851
  663    HA   LYS  86           HA       LYS  86   0.007   1.745  -7.455
  664    HB2  LYS  86           1HB      LYS  86   1.611   1.929  -9.281
  665    HB3  LYS  86           2HB      LYS  86   0.399   2.686 -10.304
  666    HG2  LYS  86           1HG      LYS  86   0.315   4.576  -8.678
  667    HG3  LYS  86           2HG      LYS  86   1.678   3.833  -7.835
  668    HD2  LYS  86           1HD      LYS  86   2.985   3.938  -9.931
  669    HD3  LYS  86           2HD      LYS  86   1.633   4.764 -10.703
  670    HE2  LYS  86           1HE      LYS  86   3.326   6.355  -9.991
  671    HE3  LYS  86           2HE      LYS  86   1.826   6.592  -9.097
  672    HZ1  LYS  86           3HZ      LYS  86   2.747   5.546  -7.205
  673    HZ2  LYS  86           1HZ      LYS  86   3.892   6.673  -7.733
  674    HZ3  LYS  86           2HZ      LYS  86   4.113   5.024  -8.053
  675    H    VAL  87           H        VAL  87  -1.496   2.901  -6.388
  676    HA   VAL  87           HA       VAL  87  -3.511   4.361  -7.974
  677    HB   VAL  87           HB       VAL  87  -4.174   2.920  -5.411
  678   HG11  VAL  87          1HG1      VAL  87  -5.924   4.078  -7.574
  679   HG12  VAL  87          2HG1      VAL  87  -5.611   4.801  -5.995
  680   HG13  VAL  87          3HG1      VAL  87  -6.481   3.270  -6.107
  681   HG21  VAL  87          3HG2      VAL  87  -4.715   1.954  -8.215
  682   HG22  VAL  87          1HG2      VAL  87  -5.237   1.178  -6.721
  683   HG23  VAL  87          2HG2      VAL  87  -3.521   1.270  -7.112
  684    H    VAL  88           H        VAL  88  -4.096   6.348  -7.169
  685    HA   VAL  88           HA       VAL  88  -2.809   7.168  -4.650
  686    HB   VAL  88           HB       VAL  88  -2.674   9.479  -5.614
  687   HG11  VAL  88          1HG1      VAL  88  -0.691   9.023  -6.987
  688   HG12  VAL  88          2HG1      VAL  88  -1.148   7.322  -7.070
  689   HG13  VAL  88          3HG1      VAL  88  -0.713   8.043  -5.521
  690   HG21  VAL  88          3HG2      VAL  88  -2.789   9.746  -8.040
  691   HG22  VAL  88          1HG2      VAL  88  -4.343   9.230  -7.385
  692   HG23  VAL  88          2HG2      VAL  88  -3.301   8.067  -8.207
  693    H    GLY  89           H        GLY  89  -5.266   6.102  -4.443
  694    HA2  GLY  89           1HA      GLY  89  -6.818   8.056  -3.236
  695    HA3  GLY  89           2HA      GLY  89  -7.422   7.882  -4.876
  696    H    ALA  90           H        ALA  90  -8.120   7.044  -1.912
  697    HA   ALA  90           HA       ALA  90  -8.543   4.286  -1.900
  698    HB1  ALA  90           1HB      ALA  90  -9.853   4.648   0.001
  699    HB2  ALA  90           2HB      ALA  90 -10.316   6.266  -0.536
  700    HB3  ALA  90           3HB      ALA  90  -8.668   5.962  -0.001
  701    H    ASN  91           H        ASN  91  -9.583   3.300  -3.510
  702    HA   ASN  91           HA       ASN  91 -12.308   4.239  -4.073
  703    HB2  ASN  91           1HB      ASN  91 -10.240   3.745  -5.882
  704    HB3  ASN  91           2HB      ASN  91 -11.280   2.324  -5.993
  705   HD21  ASN  91          1HD2      ASN  91 -12.531   5.454  -5.115
  706   HD22  ASN  91          2HD2      ASN  91 -13.431   5.706  -6.565
  707    HA   PRO  92           HA       PRO  92 -12.925   0.916  -1.032
  708    HB2  PRO  92           1HB      PRO  92 -15.610   1.411  -2.261
  709    HB3  PRO  92           2HB      PRO  92 -15.187   1.129  -0.569
  710    HG2  PRO  92           1HG      PRO  92 -15.611   3.606  -1.564
  711    HG3  PRO  92           2HG      PRO  92 -14.474   3.283  -0.246
  712    HD2  PRO  92           1HD      PRO  92 -13.922   4.130  -2.979
  713    HD3  PRO  92           2HD      PRO  92 -12.830   4.065  -1.589
  714    H    ALA  93           H        ALA  93 -14.927   0.676  -3.988
  715    HA   ALA  93           HA       ALA  93 -14.769  -2.204  -3.783
  716    HB1  ALA  93           1HB      ALA  93 -16.431  -2.252  -5.536
  717    HB2  ALA  93           2HB      ALA  93 -16.219  -0.525  -5.818
  718    HB3  ALA  93           3HB      ALA  93 -16.903  -1.092  -4.295
  719    H    ALA  94           H        ALA  94 -13.782   0.286  -6.088
  720    HA   ALA  94           HA       ALA  94 -12.971  -1.518  -8.103
  721    HB1  ALA  94           1HB      ALA  94 -12.022   1.310  -7.657
  722    HB2  ALA  94           2HB      ALA  94 -13.487   0.849  -8.526
  723    HB3  ALA  94           3HB      ALA  94 -11.906   0.385  -9.154
  724    H    ILE  95           H        ILE  95 -11.299  -0.276  -5.276
  725    HA   ILE  95           HA       ILE  95  -8.765  -1.221  -6.351
  726    HB   ILE  95           HB       ILE  95  -9.291  -0.010  -3.639
  727   HG12  ILE  95          1HG1      ILE  95  -9.709   1.662  -5.286
  728   HG13  ILE  95          2HG1      ILE  95  -8.098   1.968  -4.656
  729   HG21  ILE  95          1HG2      ILE  95  -7.321  -1.393  -3.603
  730   HG22  ILE  95          2HG2      ILE  95  -6.839   0.302  -3.611
  731   HG23  ILE  95          3HG2      ILE  95  -6.729  -0.650  -5.087
  732   HD11  ILE  95          3HD1      ILE  95  -7.152   0.838  -6.628
  733   HD12  ILE  95          1HD1      ILE  95  -8.111   2.259  -7.040
  734   HD13  ILE  95          2HD1      ILE  95  -8.782   0.645  -7.268
  735    H    LYS  96           H        LYS  96 -11.118  -2.130  -3.880
  736    HA   LYS  96           HA       LYS  96  -9.756  -4.378  -2.905
  737    HB2  LYS  96           1HB      LYS  96 -11.610  -4.058  -1.639
  738    HB3  LYS  96           2HB      LYS  96 -12.570  -3.465  -2.993
  739    HG2  LYS  96           1HG      LYS  96 -12.910  -5.771  -3.735
  740    HG3  LYS  96           2HG      LYS  96 -11.942  -6.341  -2.377
  741    HD2  LYS  96           1HD      LYS  96 -13.534  -5.367  -0.812
  742    HD3  LYS  96           2HD      LYS  96 -14.494  -4.753  -2.159
  743    HE2  LYS  96           1HE      LYS  96 -14.844  -7.076  -2.919
  744    HE3  LYS  96           2HE      LYS  96 -13.958  -7.646  -1.505
  745    HZ1  LYS  96           3HZ      LYS  96 -15.627  -6.633  -0.088
  746    HZ2  LYS  96           1HZ      LYS  96 -16.347  -7.727  -1.156
  747    HZ3  LYS  96           2HZ      LYS  96 -16.469  -6.064  -1.437
  748    H    GLN  97           H        GLN  97 -11.756  -3.882  -5.749
  749    HA   GLN  97           HA       GLN  97 -11.555  -6.516  -6.757
  750    HB2  GLN  97           1HB      GLN  97 -13.240  -4.916  -7.549
  751    HB3  GLN  97           2HB      GLN  97 -11.978  -3.884  -8.207
  752    HG2  GLN  97           1HG      GLN  97 -13.048  -5.151  -9.964
  753    HG3  GLN  97           2HG      GLN  97 -11.370  -5.656  -9.786
  754   HE21  GLN  97          1HE2      GLN  97 -10.916  -7.703  -8.989
  755   HE22  GLN  97          2HE2      GLN  97 -12.121  -8.939  -8.882
  756    H    ALA  98           H        ALA  98  -9.435  -3.742  -6.860
  757    HA   ALA  98           HA       ALA  98  -7.720  -4.676  -8.910
  758    HB1  ALA  98           1HB      ALA  98  -7.759  -2.339  -8.236
  759    HB2  ALA  98           2HB      ALA  98  -6.138  -3.019  -8.112
  760    HB3  ALA  98           3HB      ALA  98  -7.108  -2.781  -6.659
  761    H    ILE  99           H        ILE  99  -7.338  -4.675  -5.380
  762    HA   ILE  99           HA       ILE  99  -4.954  -6.049  -5.178
  763    HB   ILE  99           HB       ILE  99  -7.158  -6.706  -3.242
  764   HG12  ILE  99          1HG1      ILE  99  -7.540  -4.380  -3.436
  765   HG13  ILE  99          2HG1      ILE  99  -6.525  -4.580  -2.014
  766   HG21  ILE  99          1HG2      ILE  99  -5.027  -7.726  -2.873
  767   HG22  ILE  99          2HG2      ILE  99  -5.262  -6.478  -1.646
  768   HG23  ILE  99          3HG2      ILE  99  -4.208  -6.173  -3.027
  769   HD11  ILE  99          3HD1      ILE  99  -5.755  -3.585  -4.724
  770   HD12  ILE  99          1HD1      ILE  99  -4.573  -4.036  -3.486
  771   HD13  ILE  99          2HD1      ILE  99  -5.710  -2.724  -3.180
  772    H    ALA 100           H        ALA 100  -8.250  -7.320  -5.511
  773    HA   ALA 100           HA       ALA 100  -7.530 -10.066  -5.249
  774    HB1  ALA 100           1HB      ALA 100  -9.974  -8.815  -6.496
  775    HB2  ALA 100           2HB      ALA 100  -9.793  -9.283  -4.804
  776    HB3  ALA 100           3HB      ALA 100  -9.795 -10.515  -6.066
  777    H    ALA 101           H        ALA 101  -7.729  -7.841  -7.934
  778    HA   ALA 101           HA       ALA 101  -7.689  -9.783 -10.017
  779    HB1  ALA 101           1HB      ALA 101  -7.282  -7.909 -11.495
  780    HB2  ALA 101           2HB      ALA 101  -6.868  -6.878 -10.123
  781    HB3  ALA 101           3HB      ALA 101  -8.521  -7.476 -10.317
  782    H    ASN 102           H        ASN 102  -5.230  -7.834  -8.417
  783    HA   ASN 102           HA       ASN 102  -3.108  -8.761 -10.128
  784    HB2  ASN 102           1HB      ASN 102  -2.983  -7.207  -7.548
  785    HB3  ASN 102           2HB      ASN 102  -1.646  -7.446  -8.666
  786   HD21  ASN 102          1HD2      ASN 102  -4.495  -5.701  -7.954
  787   HD22  ASN 102          2HD2      ASN 102  -4.455  -4.609  -9.292
  788    H    ALA 103           H        ALA 103  -4.569  -9.803  -7.192
  789    HA   ALA 103           HA       ALA 103  -2.416 -11.316  -6.148
  790    HB1  ALA 103           1HB      ALA 103  -5.381 -11.740  -5.796
  791    HB2  ALA 103           2HB      ALA 103  -4.358 -10.710  -4.794
  792    HB3  ALA 103           3HB      ALA 103  -4.109 -12.456  -4.805
  Start of MODEL    2
    1    H1   MET   1           1H       MET   1  -5.763  -6.806   9.892
    2    H2   MET   1           2H       MET   1  -6.074  -6.921  11.547
    3    H3   MET   1           3H       MET   1  -4.705  -7.661  10.892
    4    HA   MET   1           HA       MET   1  -5.214  -4.750  10.991
    5    HB2  MET   1           1HB      MET   1  -4.713  -5.675  13.191
    6    HB3  MET   1           2HB      MET   1  -3.295  -6.490  12.549
    7    HG2  MET   1           1HG      MET   1  -2.204  -4.399  12.130
    8    HG3  MET   1           2HG      MET   1  -3.662  -3.503  12.558
    9    HE1  MET   1           3HE      MET   1  -3.971  -4.156  16.381
   10    HE2  MET   1           1HE      MET   1  -4.687  -5.146  15.110
   11    HE3  MET   1           2HE      MET   1  -4.675  -3.391  14.954
   12    H    VAL   2           H        VAL   2  -3.970  -3.558   9.698
   13    HA   VAL   2           HA       VAL   2  -2.171  -4.899   7.872
   14    HB   VAL   2           HB       VAL   2  -3.147  -2.039   7.981
   15   HG11  VAL   2          1HG1      VAL   2  -1.539  -3.479   5.882
   16   HG12  VAL   2          2HG1      VAL   2  -1.023  -2.105   6.855
   17   HG13  VAL   2          3HG1      VAL   2  -2.302  -1.907   5.654
   18   HG21  VAL   2          3HG2      VAL   2  -4.915  -3.633   7.537
   19   HG22  VAL   2          1HG2      VAL   2  -3.966  -4.347   6.237
   20   HG23  VAL   2          2HG2      VAL   2  -4.550  -2.691   6.092
   21    H    THR   3           H        THR   3   0.001  -4.663   7.842
   22    HA   THR   3           HA       THR   3   1.143  -3.845  10.374
   23    HB   THR   3           HB       THR   3   2.558  -5.082   8.009
   24    HG1  THR   3           1HG      THR   3   2.031  -7.066   8.930
   25   HG21  THR   3          3HG2      THR   3   4.119  -5.913   9.698
   26   HG22  THR   3          1HG2      THR   3   3.191  -5.110  10.965
   27   HG23  THR   3          2HG2      THR   3   4.029  -4.152   9.744
   28    H    GLN   4           H        GLN   4   2.598  -2.310  10.754
   29    HA   GLN   4           HA       GLN   4   2.807  -0.144   8.818
   30    HB2  GLN   4           1HB      GLN   4   2.131   0.174  11.208
   31    HB3  GLN   4           2HB      GLN   4   3.745  -0.320  11.683
   32    HG2  GLN   4           1HG      GLN   4   3.524   2.094  11.716
   33    HG3  GLN   4           2HG      GLN   4   4.711   1.572  10.527
   34   HE21  GLN   4          1HE2      GLN   4   1.277   1.318   9.979
   35   HE22  GLN   4          2HE2      GLN   4   1.197   2.527   8.756
   36    H    PHE   5           H        PHE   5   4.686   0.456   7.823
   37    HA   PHE   5           HA       PHE   5   7.170  -1.022   8.379
   38    HB2  PHE   5           1HB      PHE   5   6.404   0.964   6.232
   39    HB3  PHE   5           2HB      PHE   5   8.026   0.327   6.418
   40    HD1  PHE   5           2HD      PHE   5   7.150  -2.542   7.094
   41    HD2  PHE   5           1HD      PHE   5   5.996   0.213   4.061
   42    HE1  PHE   5           2HE      PHE   5   6.593  -4.416   5.604
   43    HE2  PHE   5           1HE      PHE   5   5.436  -1.659   2.568
   44    HZ   PHE   5           HZ       PHE   5   5.738  -3.973   3.340
   45    H    LYS   6           H        LYS   6   9.173   0.170   8.737
   46    HA   LYS   6           HA       LYS   6   8.828   3.021   9.343
   47    HB2  LYS   6           1HB      LYS   6   9.992   2.923  11.353
   48    HB3  LYS   6           2HB      LYS   6   9.041   1.448  11.406
   49    HG2  LYS   6           1HG      LYS   6  11.087   0.271  10.472
   50    HG3  LYS   6           2HG      LYS   6  11.971   1.752  10.839
   51    HD2  LYS   6           1HD      LYS   6  12.279   0.311  12.692
   52    HD3  LYS   6           2HD      LYS   6  11.113   1.534  13.203
   53    HE2  LYS   6           1HE      LYS   6  10.436  -0.705  13.922
   54    HE3  LYS   6           2HE      LYS   6   9.282  -0.019  12.780
   55    HZ1  LYS   6           3HZ      LYS   6   9.720  -2.307  12.237
   56    HZ2  LYS   6           1HZ      LYS   6  11.386  -2.020  12.159
   57    HZ3  LYS   6           2HZ      LYS   6  10.354  -1.322  11.015
   58    H    THR   7           H        THR   7  10.309   0.726   7.479
   59    HA   THR   7           HA       THR   7  12.427   2.609   6.728
   60    HB   THR   7           HB       THR   7  13.973   0.592   6.412
   61    HG1  THR   7           1HG      THR   7  12.035  -0.522   8.196
   62   HG21  THR   7          3HG2      THR   7  14.774   0.672   8.725
   63   HG22  THR   7          1HG2      THR   7  13.262   1.432   9.222
   64   HG23  THR   7          2HG2      THR   7  14.358   2.281   8.133
   65    H    ALA   8           H        ALA   8  13.300   2.232   4.581
   66    HA   ALA   8           HA       ALA   8  11.332   1.403   2.696
   67    HB1  ALA   8           1HB      ALA   8  12.866   3.184   2.131
   68    HB2  ALA   8           2HB      ALA   8  13.054   1.846   1.003
   69    HB3  ALA   8           3HB      ALA   8  14.235   2.085   2.288
   70    H    SER   9           H        SER   9  14.109  -0.070   4.185
   71    HA   SER   9           HA       SER   9  14.423  -2.345   2.612
   72    HB2  SER   9           1HB      SER   9  14.590  -2.274   5.636
   73    HB3  SER   9           2HB      SER   9  15.470  -3.339   4.538
   74    HG   SER   9           HG       SER   9  16.940  -1.857   4.398
   75    H    GLU  10           H        GLU  10  12.301  -1.764   5.393
   76    HA   GLU  10           HA       GLU  10  10.889  -4.122   5.439
   77    HB2  GLU  10           1HB      GLU  10  10.304  -1.305   6.207
   78    HB3  GLU  10           2HB      GLU  10   9.000  -2.479   6.260
   79    HG2  GLU  10           1HG      GLU  10  10.286  -3.869   7.743
   80    HG3  GLU  10           2HG      GLU  10  11.640  -2.752   7.661
   81    H    PHE  11           H        PHE  11  10.271  -1.220   3.453
   82    HA   PHE  11           HA       PHE  11   7.883  -2.138   2.291
   83    HB2  PHE  11           1HB      PHE  11   8.711   0.206   2.136
   84    HB3  PHE  11           2HB      PHE  11   9.959  -0.333   1.019
   85    HD1  PHE  11           2HD      PHE  11   9.221  -1.342  -1.197
   86    HD2  PHE  11           1HD      PHE  11   6.579   0.802   1.360
   87    HE1  PHE  11           2HE      PHE  11   7.698  -0.956  -3.091
   88    HE2  PHE  11           1HE      PHE  11   5.051   1.207  -0.552
   89    HZ   PHE  11           HZ       PHE  11   5.623   0.313  -2.762
   90    H    ASP  12           H        ASP  12  11.172  -2.237   0.977
   91    HA   ASP  12           HA       ASP  12  10.549  -3.661  -1.367
   92    HB2  ASP  12           1HB      ASP  12  12.679  -2.356  -0.786
   93    HB3  ASP  12           2HB      ASP  12  13.209  -3.809   0.053
   94    H    SER  13           H        SER  13  11.492  -4.785   1.848
   95    HA   SER  13           HA       SER  13  11.885  -7.489   1.259
   96    HB2  SER  13           1HB      SER  13  12.510  -6.484   3.412
   97    HB3  SER  13           2HB      SER  13  10.807  -6.246   3.804
   98    HG   SER  13           HG       SER  13  12.319  -8.605   3.722
   99    H    ALA  14           H        ALA  14   8.902  -5.755   2.141
  100    HA   ALA  14           HA       ALA  14   7.259  -8.047   2.059
  101    HB1  ALA  14           1HB      ALA  14   6.598  -5.996   3.241
  102    HB2  ALA  14           2HB      ALA  14   5.372  -6.522   2.085
  103    HB3  ALA  14           3HB      ALA  14   6.441  -5.167   1.692
  104    H    ILE  15           H        ILE  15   8.333  -5.736  -0.308
  105    HA   ILE  15           HA       ILE  15   6.541  -6.321  -2.389
  106    HB   ILE  15           HB       ILE  15   9.409  -5.463  -2.633
  107   HG12  ILE  15          1HG1      ILE  15   8.419  -3.800  -1.320
  108   HG13  ILE  15          2HG1      ILE  15   8.316  -3.200  -2.972
  109   HG21  ILE  15          1HG2      ILE  15   8.117  -6.343  -4.671
  110   HG22  ILE  15          2HG2      ILE  15   8.991  -4.818  -4.799
  111   HG23  ILE  15          3HG2      ILE  15   7.244  -4.815  -4.572
  112   HD11  ILE  15          3HD1      ILE  15   6.265  -2.784  -1.718
  113   HD12  ILE  15          1HD1      ILE  15   6.077  -4.517  -1.454
  114   HD13  ILE  15          2HD1      ILE  15   5.987  -3.859  -3.087
  115    H    ALA  16           H        ALA  16   9.581  -7.769  -1.418
  116    HA   ALA  16           HA       ALA  16   9.949  -9.268  -3.814
  117    HB1  ALA  16           1HB      ALA  16  11.808 -10.314  -2.598
  118    HB2  ALA  16           2HB      ALA  16  11.270  -9.516  -1.119
  119    HB3  ALA  16           3HB      ALA  16  11.840  -8.554  -2.484
  120    H    GLN  17           H        GLN  17   7.759  -9.637  -1.474
  121    HA   GLN  17           HA       GLN  17   7.889 -12.439  -0.957
  122    HB2  GLN  17           1HB      GLN  17   6.790 -10.648   0.466
  123    HB3  GLN  17           2HB      GLN  17   5.490 -10.631  -0.715
  124    HG2  GLN  17           1HG      GLN  17   4.848 -12.829  -0.188
  125    HG3  GLN  17           2HG      GLN  17   6.324 -13.118   0.733
  126   HE21  GLN  17          1HE2      GLN  17   4.751 -10.059   1.014
  127   HE22  GLN  17          2HE2      GLN  17   4.078 -10.312   2.595
  128    H    ASP  18           H        ASP  18   6.709 -14.090  -1.902
  129    HA   ASP  18           HA       ASP  18   6.155 -13.666  -4.700
  130    HB2  ASP  18           1HB      ASP  18   5.986 -16.185  -3.029
  131    HB3  ASP  18           2HB      ASP  18   5.863 -16.117  -4.783
  132    H    LYS  19           H        LYS  19   4.308 -12.230  -3.346
  133    HA   LYS  19           HA       LYS  19   1.875 -13.412  -4.310
  134    HB2  LYS  19           1HB      LYS  19   0.621 -13.331  -2.259
  135    HB3  LYS  19           2HB      LYS  19   2.036 -14.336  -1.993
  136    HG2  LYS  19           1HG      LYS  19   2.971 -12.879  -0.530
  137    HG3  LYS  19           2HG      LYS  19   2.257 -11.462  -1.302
  138    HD2  LYS  19           1HD      LYS  19   1.153 -11.683   0.772
  139    HD3  LYS  19           2HD      LYS  19   0.025 -12.303  -0.432
  140    HE2  LYS  19           1HE      LYS  19  -0.091 -13.889   1.254
  141    HE3  LYS  19           2HE      LYS  19   1.058 -14.604   0.124
  142    HZ1  LYS  19           3HZ      LYS  19   2.866 -13.900   1.498
  143    HZ2  LYS  19           1HZ      LYS  19   1.761 -14.724   2.476
  144    HZ3  LYS  19           2HZ      LYS  19   1.831 -13.032   2.522
  145    H    LEU  20           H        LEU  20  -0.005 -11.756  -3.579
  146    HA   LEU  20           HA       LEU  20   0.793  -9.253  -4.707
  147    HB2  LEU  20           1HB      LEU  20  -1.450 -10.424  -4.991
  148    HB3  LEU  20           2HB      LEU  20  -1.837  -9.886  -3.371
  149    HG   LEU  20           HG       LEU  20  -2.797  -8.497  -5.235
  150   HD11  LEU  20          1HD1      LEU  20  -0.941  -7.034  -3.369
  151   HD12  LEU  20          2HD1      LEU  20  -2.556  -7.612  -2.962
  152   HD13  LEU  20          3HD1      LEU  20  -2.350  -6.362  -4.190
  153   HD21  LEU  20          3HD2      LEU  20  -1.331  -6.930  -6.373
  154   HD22  LEU  20          1HD2      LEU  20  -0.877  -8.597  -6.732
  155   HD23  LEU  20          2HD2      LEU  20   0.070  -7.651  -5.584
  156    H    VAL  21           H        VAL  21   1.602  -7.587  -3.675
  157    HA   VAL  21           HA       VAL  21   1.380  -7.455  -0.749
  158    HB   VAL  21           HB       VAL  21   3.124  -5.604  -2.313
  159   HG11  VAL  21          1HG1      VAL  21   3.428  -6.982   0.347
  160   HG12  VAL  21          2HG1      VAL  21   2.938  -5.310   0.080
  161   HG13  VAL  21          3HG1      VAL  21   4.569  -5.830  -0.347
  162   HG21  VAL  21          3HG2      VAL  21   4.960  -7.348  -2.132
  163   HG22  VAL  21          1HG2      VAL  21   3.751  -7.591  -3.394
  164   HG23  VAL  21          2HG2      VAL  21   3.673  -8.527  -1.898
  165    H    VAL  22           H        VAL  22  -0.162  -6.142   0.022
  166    HA   VAL  22           HA       VAL  22  -1.023  -3.842  -1.579
  167    HB   VAL  22           HB       VAL  22  -2.187  -4.907   1.004
  168   HG11  VAL  22          1HG1      VAL  22  -3.310  -2.918  -0.969
  169   HG12  VAL  22          2HG1      VAL  22  -2.625  -2.522   0.606
  170   HG13  VAL  22          3HG1      VAL  22  -4.095  -3.488   0.503
  171   HG21  VAL  22          3HG2      VAL  22  -2.441  -6.539  -0.766
  172   HG22  VAL  22          1HG2      VAL  22  -3.099  -5.303  -1.839
  173   HG23  VAL  22          2HG2      VAL  22  -3.997  -5.792  -0.401
  174    H    VAL  23           H        VAL  23   0.384  -2.191  -1.275
  175    HA   VAL  23           HA       VAL  23   1.192  -1.667   1.492
  176    HB   VAL  23           HB       VAL  23   2.479  -0.561  -1.001
  177   HG11  VAL  23          1HG1      VAL  23   3.144  -0.434   1.931
  178   HG12  VAL  23          2HG1      VAL  23   2.827   0.905   0.828
  179   HG13  VAL  23          3HG1      VAL  23   4.301  -0.046   0.660
  180   HG21  VAL  23          3HG2      VAL  23   3.336  -2.803   0.819
  181   HG22  VAL  23          1HG2      VAL  23   4.306  -2.117  -0.487
  182   HG23  VAL  23          2HG2      VAL  23   2.803  -2.968  -0.855
  183    H    ALA  24           H        ALA  24   0.464  -0.079   2.512
  184    HA   ALA  24           HA       ALA  24  -1.353   1.831   1.188
  185    HB1  ALA  24           1HB      ALA  24  -2.301   2.073   3.423
  186    HB2  ALA  24           2HB      ALA  24  -1.003   1.094   4.118
  187    HB3  ALA  24           3HB      ALA  24  -2.172   0.358   3.024
  188    H    PHE  25           H        PHE  25   0.121   3.498   0.549
  189    HA   PHE  25           HA       PHE  25   1.706   4.663   2.719
  190    HB2  PHE  25           1HB      PHE  25   2.014   4.583  -0.200
  191    HB3  PHE  25           2HB      PHE  25   2.442   6.118   0.554
  192    HD1  PHE  25           1HD      PHE  25   2.793   2.588   1.637
  193    HD2  PHE  25           2HD      PHE  25   4.725   6.268   0.768
  194    HE1  PHE  25           1HE      PHE  25   4.930   1.626   2.365
  195    HE2  PHE  25           2HE      PHE  25   6.872   5.313   1.493
  196    HZ   PHE  25           HZ       PHE  25   6.974   2.987   2.293
  197    H    TYR  26           H        TYR  26   1.249   6.457   3.660
  198    HA   TYR  26           HA       TYR  26  -0.425   8.482   2.440
  199    HB2  TYR  26           1HB      TYR  26  -1.961   8.474   4.443
  200    HB3  TYR  26           2HB      TYR  26  -2.152   7.095   3.368
  201    HD1  TYR  26           2HD      TYR  26  -0.727   8.175   6.617
  202    HD2  TYR  26           1HD      TYR  26  -1.785   4.887   4.140
  203    HE1  TYR  26           2HE      TYR  26  -0.363   6.641   8.504
  204    HE2  TYR  26           1HE      TYR  26  -1.428   3.349   6.010
  205    HH   TYR  26           HH       TYR  26  -1.159   4.354   9.197
  206    H    ALA  27           H        ALA  27  -0.760  10.256   4.304
  207    HA   ALA  27           HA       ALA  27   1.717  10.368   5.880
  208    HB1  ALA  27           1HB      ALA  27   1.975  11.792   3.913
  209    HB2  ALA  27           2HB      ALA  27   1.927  12.745   5.395
  210    HB3  ALA  27           3HB      ALA  27   0.509  12.668   4.351
  211    H    THR  28           H        THR  28   1.521  11.156   7.904
  212    HA   THR  28           HA       THR  28  -1.018  11.045   9.122
  213    HB   THR  28           HB       THR  28   0.311  12.025  11.124
  214    HG1  THR  28           1HG      THR  28   2.615  11.137   9.830
  215   HG21  THR  28          3HG2      THR  28   1.077   9.405   9.831
  216   HG22  THR  28          1HG2      THR  28  -0.286   9.674  10.917
  217   HG23  THR  28          2HG2      THR  28   1.364   9.830  11.518
  218    H    TRP  29           H        TRP  29   0.664  13.681   7.670
  219    HA   TRP  29           HA       TRP  29  -0.901  15.689   9.058
  220    HB2  TRP  29           1HB      TRP  29   0.239  17.306   7.571
  221    HB3  TRP  29           2HB      TRP  29   1.374  16.284   8.439
  222    HD1  TRP  29           HD       TRP  29   3.097  14.962   7.026
  223    HE1  TRP  29           1HE      TRP  29   3.552  14.696   4.512
  224    HE3  TRP  29           3HE      TRP  29  -1.105  17.228   5.180
  225    HZ2  TRP  29           2HZ      TRP  29   2.308  15.357   2.070
  226    HZ3  TRP  29           3HZ      TRP  29  -1.391  17.369   2.746
  227    HH2  TRP  29           HH       TRP  29   0.282  16.455   1.220
  228    H    CYS  30           H        CYS  30  -1.412  13.577   6.568
  229    HA   CYS  30           HA       CYS  30  -2.908  15.328   4.817
  230    HB2  CYS  30           1HB      CYS  30  -1.567  13.578   3.823
  231    HB3  CYS  30           2HB      CYS  30  -2.366  12.353   4.797
  232    HG   CYS  30           HG       CYS  30  -3.357  13.800   1.929
  233    H    GLY  31           H        GLY  31  -5.135  15.053   4.341
  234    HA2  GLY  31           1HA      GLY  31  -6.719  14.379   6.674
  235    HA3  GLY  31           2HA      GLY  31  -7.294  15.148   5.206
  236    HA   PRO  32           HA       PRO  32  -8.933  11.386   3.600
  237    HB2  PRO  32           1HB      PRO  32  -7.778  10.951   1.174
  238    HB3  PRO  32           2HB      PRO  32  -8.983  12.210   1.469
  239    HG2  PRO  32           1HG      PRO  32  -5.996  12.435   1.380
  240    HG3  PRO  32           2HG      PRO  32  -7.217  13.486   0.636
  241    HD2  PRO  32           1HD      PRO  32  -6.000  14.158   2.928
  242    HD3  PRO  32           2HD      PRO  32  -7.711  14.538   2.644
  243    H    CYS  33           H        CYS  33  -5.760  11.361   4.562
  244    HA   CYS  33           HA       CYS  33  -4.783   8.885   3.659
  245    HB2  CYS  33           1HB      CYS  33  -3.306   8.946   5.615
  246    HB3  CYS  33           2HB      CYS  33  -3.373  10.524   4.837
  247    HG   CYS  33           HG       CYS  33  -4.046  11.833   6.941
  248    H    LYS  34           H        LYS  34  -7.032   9.762   6.140
  249    HA   LYS  34           HA       LYS  34  -7.024   7.322   7.562
  250    HB2  LYS  34           1HB      LYS  34  -7.841   9.508   8.434
  251    HB3  LYS  34           2HB      LYS  34  -9.234   9.364   7.382
  252    HG2  LYS  34           1HG      LYS  34  -9.840   8.721   9.611
  253    HG3  LYS  34           2HG      LYS  34  -9.874   7.299   8.567
  254    HD2  LYS  34           1HD      LYS  34  -7.730   6.582   9.404
  255    HD3  LYS  34           2HD      LYS  34  -7.568   8.060  10.352
  256    HE2  LYS  34           1HE      LYS  34  -9.685   5.948  10.730
  257    HE3  LYS  34           2HE      LYS  34  -8.247   6.148  11.728
  258    HZ1  LYS  34           3HZ      LYS  34 -10.484   8.078  11.438
  259    HZ2  LYS  34           1HZ      LYS  34  -9.061   8.390  12.299
  260    HZ3  LYS  34           2HZ      LYS  34 -10.105   7.163  12.809
  261    H    MET  35           H        MET  35  -8.224   8.100   4.456
  262    HA   MET  35           HA       MET  35 -10.441   6.236   4.580
  263    HB2  MET  35           1HB      MET  35 -10.298   8.229   2.975
  264    HB3  MET  35           2HB      MET  35  -9.153   7.248   2.050
  265    HG2  MET  35           1HG      MET  35 -10.826   5.500   1.816
  266    HG3  MET  35           2HG      MET  35 -11.973   6.457   2.748
  267    HE1  MET  35           3HE      MET  35 -12.340   5.069  -0.003
  268    HE2  MET  35           1HE      MET  35 -13.150   6.253  -1.039
  269    HE3  MET  35           2HE      MET  35 -13.700   6.008   0.621
  270    H    ILE  36           H        ILE  36  -7.095   6.260   3.784
  271    HA   ILE  36           HA       ILE  36  -7.060   3.649   2.619
  272    HB   ILE  36           HB       ILE  36  -5.073   5.710   3.291
  273   HG12  ILE  36          1HG1      ILE  36  -4.304   5.225   1.056
  274   HG13  ILE  36          2HG1      ILE  36  -5.264   3.754   1.006
  275   HG21  ILE  36          1HG2      ILE  36  -4.010   3.964   4.505
  276   HG22  ILE  36          2HG2      ILE  36  -3.177   4.113   2.957
  277   HG23  ILE  36          3HG2      ILE  36  -4.325   2.802   3.219
  278   HD11  ILE  36          3HD1      ILE  36  -6.340   5.493  -0.265
  279   HD12  ILE  36          1HD1      ILE  36  -6.330   6.557   1.143
  280   HD13  ILE  36          2HD1      ILE  36  -7.304   5.090   1.162
  281    H    ALA  37           H        ALA  37  -6.918   5.006   5.777
  282    HA   ALA  37           HA       ALA  37  -5.974   2.875   7.246
  283    HB1  ALA  37           1HB      ALA  37  -8.073   4.934   7.861
  284    HB2  ALA  37           2HB      ALA  37  -6.421   4.813   8.459
  285    HB3  ALA  37           3HB      ALA  37  -7.645   3.680   9.026
  286    HA   PRO  38           HA       PRO  38  -9.982   0.535   7.530
  287    HB2  PRO  38           1HB      PRO  38 -12.388   1.404   6.794
  288    HB3  PRO  38           2HB      PRO  38 -11.603   2.020   8.253
  289    HG2  PRO  38           1HG      PRO  38 -11.854   3.278   5.561
  290    HG3  PRO  38           2HG      PRO  38 -11.959   4.025   7.164
  291    HD2  PRO  38           1HD      PRO  38  -9.707   4.021   5.527
  292    HD3  PRO  38           2HD      PRO  38  -9.720   4.349   7.267
  293    H    MET  39           H        MET  39  -9.978   2.167   4.344
  294    HA   MET  39           HA       MET  39 -11.486   0.139   3.022
  295    HB2  MET  39           1HB      MET  39 -11.293   2.286   1.926
  296    HB3  MET  39           2HB      MET  39  -9.547   2.251   2.079
  297    HG2  MET  39           1HG      MET  39  -9.859   0.068   0.597
  298    HG3  MET  39           2HG      MET  39 -11.296   0.960   0.096
  299    HE1  MET  39           3HE      MET  39  -7.528   1.498   0.943
  300    HE2  MET  39           1HE      MET  39  -8.223   3.083   1.289
  301    HE3  MET  39           2HE      MET  39  -7.119   2.892  -0.072
  302    H    ILE  40           H        ILE  40  -8.021   0.761   3.326
  303    HA   ILE  40           HA       ILE  40  -7.193  -1.524   1.862
  304    HB   ILE  40           HB       ILE  40  -5.996   0.675   3.308
  305   HG12  ILE  40          1HG1      ILE  40  -4.684  -1.037   1.226
  306   HG13  ILE  40          2HG1      ILE  40  -6.016   0.042   0.815
  307   HG21  ILE  40          1HG2      ILE  40  -4.521  -1.959   3.440
  308   HG22  ILE  40          2HG2      ILE  40  -5.169  -1.067   4.816
  309   HG23  ILE  40          3HG2      ILE  40  -3.857  -0.380   3.861
  310   HD11  ILE  40          3HD1      ILE  40  -3.563   0.839   0.579
  311   HD12  ILE  40          1HD1      ILE  40  -3.680   1.099   2.315
  312   HD13  ILE  40          2HD1      ILE  40  -4.788   1.928   1.226
  313    H    GLU  41           H        GLU  41  -7.702  -0.893   5.322
  314    HA   GLU  41           HA       GLU  41  -6.795  -3.447   6.176
  315    HB2  GLU  41           1HB      GLU  41  -7.141  -1.490   7.679
  316    HB3  GLU  41           2HB      GLU  41  -8.876  -1.631   7.441
  317    HG2  GLU  41           1HG      GLU  41  -8.826  -3.850   8.482
  318    HG3  GLU  41           2HG      GLU  41  -7.091  -3.674   8.745
  319    H    LYS  42           H        LYS  42  -9.684  -2.302   4.692
  320    HA   LYS  42           HA       LYS  42 -11.343  -4.500   5.420
  321    HB2  LYS  42           1HB      LYS  42 -12.118  -2.164   4.871
  322    HB3  LYS  42           2HB      LYS  42 -11.795  -2.513   3.180
  323    HG2  LYS  42           1HG      LYS  42 -14.130  -2.836   3.600
  324    HG3  LYS  42           2HG      LYS  42 -13.401  -4.429   3.366
  325    HD2  LYS  42           1HD      LYS  42 -13.309  -4.774   5.763
  326    HD3  LYS  42           2HD      LYS  42 -13.923  -3.148   6.044
  327    HE2  LYS  42           1HE      LYS  42 -16.015  -3.781   4.899
  328    HE3  LYS  42           2HE      LYS  42 -15.393  -5.423   4.725
  329    HZ1  LYS  42           3HZ      LYS  42 -16.821  -5.278   6.642
  330    HZ2  LYS  42           1HZ      LYS  42 -15.908  -4.004   7.282
  331    HZ3  LYS  42           2HZ      LYS  42 -15.227  -5.547   7.152
  332    H    PHE  43           H        PHE  43  -9.240  -3.711   2.721
  333    HA   PHE  43           HA       PHE  43 -10.013  -5.583   0.814
  334    HB2  PHE  43           1HB      PHE  43  -7.161  -4.848   1.590
  335    HB3  PHE  43           2HB      PHE  43  -7.630  -5.674   0.097
  336    HD1  PHE  43           1HD      PHE  43 -10.215  -3.629   0.235
  337    HD2  PHE  43           2HD      PHE  43  -5.992  -3.343  -0.018
  338    HE1  PHE  43           1HE      PHE  43 -10.433  -1.451  -0.895
  339    HE2  PHE  43           2HE      PHE  43  -6.195  -1.168  -1.137
  340    HZ   PHE  43           HZ       PHE  43  -8.420  -0.221  -1.575
  341    H    SER  44           H        SER  44  -7.448  -6.085   3.301
  342    HA   SER  44           HA       SER  44  -7.441  -8.891   2.659
  343    HB2  SER  44           1HB      SER  44  -5.911  -7.564   4.890
  344    HB3  SER  44           2HB      SER  44  -5.556  -9.078   4.051
  345    HG   SER  44           HG       SER  44  -4.385  -7.896   2.782
  346    H    GLU  45           H        GLU  45  -9.111  -6.909   4.892
  347    HA   GLU  45           HA       GLU  45  -9.666  -8.813   6.888
  348    HB2  GLU  45           1HB      GLU  45 -10.325  -6.385   6.967
  349    HB3  GLU  45           2HB      GLU  45 -11.594  -6.747   5.803
  350    HG2  GLU  45           1HG      GLU  45 -12.536  -8.376   7.419
  351    HG3  GLU  45           2HG      GLU  45 -11.332  -7.847   8.591
  352    H    GLN  46           H        GLN  46 -10.960  -8.275   3.663
  353    HA   GLN  46           HA       GLN  46 -12.869 -10.433   3.946
  354    HB2  GLN  46           1HB      GLN  46 -12.167  -8.748   1.535
  355    HB3  GLN  46           2HB      GLN  46 -13.501  -9.889   1.632
  356    HG2  GLN  46           1HG      GLN  46 -13.214  -7.444   3.363
  357    HG3  GLN  46           2HG      GLN  46 -14.174  -7.523   1.889
  358   HE21  GLN  46          1HE2      GLN  46 -16.069  -7.050   2.962
  359   HE22  GLN  46          2HE2      GLN  46 -16.860  -8.180   4.004
  360    H    TYR  47           H        TYR  47  -9.847  -9.728   2.259
  361    HA   TYR  47           HA       TYR  47  -9.517 -12.608   1.866
  362    HB2  TYR  47           1HB      TYR  47  -8.266 -11.972  -0.291
  363    HB3  TYR  47           2HB      TYR  47 -10.022 -11.962  -0.292
  364    HD1  TYR  47           1HD      TYR  47  -7.033  -9.758  -0.159
  365    HD2  TYR  47           2HD      TYR  47 -11.237 -10.031  -0.778
  366    HE1  TYR  47           1HE      TYR  47  -7.051  -7.454  -1.043
  367    HE2  TYR  47           2HE      TYR  47 -11.268  -7.729  -1.638
  368    HH   TYR  47           HH       TYR  47  -8.544  -6.079  -2.565
  369    HA   PRO  48           HA       PRO  48  -5.863 -11.140   4.157
  370    HB2  PRO  48           1HB      PRO  48  -5.480 -13.393   5.560
  371    HB3  PRO  48           2HB      PRO  48  -6.691 -12.195   6.019
  372    HG2  PRO  48           1HG      PRO  48  -7.053 -14.773   4.538
  373    HG3  PRO  48           2HG      PRO  48  -8.038 -14.085   5.843
  374    HD2  PRO  48           1HD      PRO  48  -8.723 -13.910   3.214
  375    HD3  PRO  48           2HD      PRO  48  -9.176 -12.685   4.415
  376    H    GLN  49           H        GLN  49  -6.332 -13.236   1.669
  377    HA   GLN  49           HA       GLN  49  -4.010 -14.818   1.591
  378    HB2  GLN  49           1HB      GLN  49  -5.849 -15.325   0.143
  379    HB3  GLN  49           2HB      GLN  49  -5.799 -13.723  -0.578
  380    HG2  GLN  49           1HG      GLN  49  -3.340 -14.533  -1.194
  381    HG3  GLN  49           2HG      GLN  49  -4.139 -16.102  -1.111
  382   HE21  GLN  49          1HE2      GLN  49  -4.012 -13.023  -2.731
  383   HE22  GLN  49          2HE2      GLN  49  -4.933 -13.500  -4.119
  384    H    ALA  50           H        ALA  50  -4.519 -11.472   0.972
  385    HA   ALA  50           HA       ALA  50  -1.913 -11.236  -0.359
  386    HB1  ALA  50           1HB      ALA  50  -2.626  -8.949  -0.899
  387    HB2  ALA  50           2HB      ALA  50  -4.147  -9.233  -0.050
  388    HB3  ALA  50           3HB      ALA  50  -3.759 -10.160  -1.506
  389    H    ASP  51           H        ASP  51  -0.469  -9.485   0.397
  390    HA   ASP  51           HA       ASP  51  -0.507  -9.525   3.303
  391    HB2  ASP  51           1HB      ASP  51   1.641  -9.297   1.299
  392    HB3  ASP  51           2HB      ASP  51   1.857  -8.320   2.743
  393    H    PHE  52           H        PHE  52  -0.452  -7.808   4.586
  394    HA   PHE  52           HA       PHE  52  -1.512  -5.355   3.365
  395    HB2  PHE  52           1HB      PHE  52  -2.382  -5.239   5.905
  396    HB3  PHE  52           2HB      PHE  52  -3.278  -6.060   4.635
  397    HD1  PHE  52           2HD      PHE  52  -0.839  -6.614   7.380
  398    HD2  PHE  52           1HD      PHE  52  -3.727  -8.350   4.784
  399    HE1  PHE  52           2HE      PHE  52  -0.715  -8.715   8.649
  400    HE2  PHE  52           1HE      PHE  52  -3.608 -10.455   6.049
  401    HZ   PHE  52           HZ       PHE  52  -2.098 -10.640   7.983
  402    H    TYR  53           H        TYR  53  -0.106  -3.694   3.436
  403    HA   TYR  53           HA       TYR  53   1.333  -3.256   5.952
  404    HB2  TYR  53           1HB      TYR  53   2.627  -3.257   3.216
  405    HB3  TYR  53           2HB      TYR  53   3.384  -2.644   4.682
  406    HD1  TYR  53           2HD      TYR  53   3.738  -4.269   6.607
  407    HD2  TYR  53           1HD      TYR  53   2.731  -5.539   2.674
  408    HE1  TYR  53           2HE      TYR  53   4.567  -6.520   7.131
  409    HE2  TYR  53           1HE      TYR  53   3.559  -7.801   3.185
  410    HH   TYR  53           HH       TYR  53   4.198  -8.851   6.318
  411    H    LYS  54           H        LYS  54   2.080  -1.123   6.291
  412    HA   LYS  54           HA       LYS  54   0.783   1.014   4.736
  413    HB2  LYS  54           1HB      LYS  54   0.357   0.276   7.597
  414    HB3  LYS  54           2HB      LYS  54   0.241   1.960   7.135
  415    HG2  LYS  54           1HG      LYS  54  -1.643   1.499   5.759
  416    HG3  LYS  54           2HG      LYS  54  -1.416  -0.241   5.936
  417    HD2  LYS  54           1HD      LYS  54  -1.889  -0.066   8.323
  418    HD3  LYS  54           2HD      LYS  54  -2.067   1.681   8.169
  419    HE2  LYS  54           1HE      LYS  54  -3.788  -0.370   6.781
  420    HE3  LYS  54           2HE      LYS  54  -4.231   0.497   8.250
  421    HZ1  LYS  54           3HZ      LYS  54  -5.195   1.512   6.281
  422    HZ2  LYS  54           1HZ      LYS  54  -3.654   1.750   5.625
  423    HZ3  LYS  54           2HZ      LYS  54  -4.106   2.567   7.035
  424    H    LEU  55           H        LEU  55   1.804   3.112   5.068
  425    HA   LEU  55           HA       LEU  55   3.743   3.397   7.157
  426    HB2  LEU  55           1HB      LEU  55   5.148   2.293   5.553
  427    HB3  LEU  55           2HB      LEU  55   4.630   3.372   4.277
  428    HG   LEU  55           HG       LEU  55   5.994   4.571   6.642
  429   HD11  LEU  55          1HD1      LEU  55   7.437   2.703   6.188
  430   HD12  LEU  55          2HD1      LEU  55   8.179   4.159   5.528
  431   HD13  LEU  55          3HD1      LEU  55   7.369   3.017   4.456
  432   HD21  LEU  55          3HD2      LEU  55   6.660   6.197   5.078
  433   HD22  LEU  55          1HD2      LEU  55   4.989   5.808   4.666
  434   HD23  LEU  55          2HD2      LEU  55   6.315   5.138   3.711
  435    H    ASP  56           H        ASP  56   4.251   5.513   7.617
  436    HA   ASP  56           HA       ASP  56   2.572   7.544   6.346
  437    HB2  ASP  56           1HB      ASP  56   2.332   7.540   8.706
  438    HB3  ASP  56           2HB      ASP  56   4.069   7.430   8.962
  439    H    VAL  57           H        VAL  57   3.392   8.825   4.858
  440    HA   VAL  57           HA       VAL  57   6.114   8.795   4.082
  441    HB   VAL  57           HB       VAL  57   4.056  10.877   3.338
  442   HG11  VAL  57          1HG1      VAL  57   6.517   9.871   1.919
  443   HG12  VAL  57          2HG1      VAL  57   6.301  11.456   2.661
  444   HG13  VAL  57          3HG1      VAL  57   5.351  11.008   1.245
  445   HG21  VAL  57          3HG2      VAL  57   3.074   8.711   2.965
  446   HG22  VAL  57          1HG2      VAL  57   4.527   8.157   2.128
  447   HG23  VAL  57          2HG2      VAL  57   3.527   9.420   1.412
  448    H    ASP  58           H        ASP  58   4.279  10.837   6.242
  449    HA   ASP  58           HA       ASP  58   6.054  13.061   6.234
  450    HB2  ASP  58           1HB      ASP  58   3.721  13.181   7.064
  451    HB3  ASP  58           2HB      ASP  58   4.178  12.170   8.432
  452    H    GLU  59           H        GLU  59   6.037   9.976   7.755
  453    HA   GLU  59           HA       GLU  59   8.181  10.701   9.589
  454    HB2  GLU  59           1HB      GLU  59   6.254   9.265  10.312
  455    HB3  GLU  59           2HB      GLU  59   6.830   8.025   9.210
  456    HG2  GLU  59           1HG      GLU  59   8.900   7.844  10.455
  457    HG3  GLU  59           2HG      GLU  59   8.382   9.139  11.531
  458    H    LEU  60           H        LEU  60   7.568   8.593   6.794
  459    HA   LEU  60           HA       LEU  60  10.489   8.344   6.475
  460    HB2  LEU  60           1HB      LEU  60   8.357   6.305   5.890
  461    HB3  LEU  60           2HB      LEU  60   9.979   6.187   5.252
  462    HG   LEU  60           HG       LEU  60  10.003   4.768   7.084
  463   HD11  LEU  60          1HD1      LEU  60  11.893   6.318   7.114
  464   HD12  LEU  60          2HD1      LEU  60  11.454   5.776   8.733
  465   HD13  LEU  60          3HD1      LEU  60  10.991   7.388   8.188
  466   HD21  LEU  60          3HD2      LEU  60   8.508   6.860   8.647
  467   HD22  LEU  60          1HD2      LEU  60   9.083   5.321   9.287
  468   HD23  LEU  60          2HD2      LEU  60   7.854   5.346   8.023
  469    H    GLY  61           H        GLY  61  10.265  10.325   5.230
  470    HA2  GLY  61           1HA      GLY  61   8.712  10.469   2.867
  471    HA3  GLY  61           2HA      GLY  61  10.055  11.520   3.283
  472    H    ASP  62           H        ASP  62  12.080   9.530   3.433
  473    HA   ASP  62           HA       ASP  62  12.783   9.453   0.685
  474    HB2  ASP  62           1HB      ASP  62  14.495   9.669   2.400
  475    HB3  ASP  62           2HB      ASP  62  14.066   8.091   3.049
  476    H    VAL  63           H        VAL  63  11.423   7.140   2.876
  477    HA   VAL  63           HA       VAL  63  11.664   4.823   1.289
  478    HB   VAL  63           HB       VAL  63   9.470   5.573   3.220
  479   HG11  VAL  63          1HG1      VAL  63   9.120   3.107   3.366
  480   HG12  VAL  63          2HG1      VAL  63  10.214   2.922   1.994
  481   HG13  VAL  63          3HG1      VAL  63   8.701   3.804   1.803
  482   HG21  VAL  63          3HG2      VAL  63  10.690   4.296   4.863
  483   HG22  VAL  63          1HG2      VAL  63  11.755   5.530   4.190
  484   HG23  VAL  63          2HG2      VAL  63  11.905   3.850   3.668
  485    H    ALA  64           H        ALA  64   8.924   7.125   1.578
  486    HA   ALA  64           HA       ALA  64   7.310   6.108  -0.395
  487    HB1  ALA  64           1HB      ALA  64   7.806   9.007   0.256
  488    HB2  ALA  64           2HB      ALA  64   6.643   7.939   1.045
  489    HB3  ALA  64           3HB      ALA  64   6.428   8.380  -0.650
  490    H    GLN  65           H        GLN  65  10.134   8.181  -0.732
  491    HA   GLN  65           HA       GLN  65   9.844   8.616  -3.540
  492    HB2  GLN  65           1HB      GLN  65  12.315   8.798  -1.805
  493    HB3  GLN  65           2HB      GLN  65  12.166   9.434  -3.439
  494    HG2  GLN  65           1HG      GLN  65  10.461  10.992  -2.707
  495    HG3  GLN  65           2HG      GLN  65  10.524  10.322  -1.077
  496   HE21  GLN  65          1HE2      GLN  65  13.435  10.016  -1.170
  497   HE22  GLN  65          2HE2      GLN  65  14.086  11.605  -0.980
  498    H    LYS  66           H        LYS  66  11.417   6.210  -1.571
  499    HA   LYS  66           HA       LYS  66  12.908   4.902  -3.530
  500    HB2  LYS  66           1HB      LYS  66  13.606   4.143  -1.520
  501    HB3  LYS  66           2HB      LYS  66  12.072   4.528  -0.754
  502    HG2  LYS  66           1HG      LYS  66  11.753   2.376  -0.536
  503    HG3  LYS  66           2HG      LYS  66  11.516   2.312  -2.273
  504    HD2  LYS  66           1HD      LYS  66  14.210   2.037  -0.952
  505    HD3  LYS  66           2HD      LYS  66  13.185   0.661  -1.352
  506    HE2  LYS  66           1HE      LYS  66  14.144   2.687  -3.363
  507    HE3  LYS  66           2HE      LYS  66  14.978   1.172  -3.025
  508    HZ1  LYS  66           3HZ      LYS  66  13.564   0.934  -4.939
  509    HZ2  LYS  66           1HZ      LYS  66  12.211   1.462  -4.068
  510    HZ3  LYS  66           2HZ      LYS  66  12.949  -0.010  -3.680
  511    H    ASN  67           H        ASN  67   9.528   4.995  -2.927
  512    HA   ASN  67           HA       ASN  67   9.075   2.464  -4.353
  513    HB2  ASN  67           1HB      ASN  67   7.055   4.013  -2.788
  514    HB3  ASN  67           2HB      ASN  67   7.036   2.320  -3.214
  515   HD21  ASN  67          1HD2      ASN  67   7.057   4.072  -0.726
  516   HD22  ASN  67          2HD2      ASN  67   8.130   3.251   0.319
  517    H    GLU  68           H        GLU  68   8.926   5.802  -4.637
  518    HA   GLU  68           HA       GLU  68   8.307   7.133  -6.363
  519    HB2  GLU  68           1HB      GLU  68   8.494   5.053  -7.784
  520    HB3  GLU  68           2HB      GLU  68   6.752   4.855  -7.566
  521    HG2  GLU  68           1HG      GLU  68   6.528   7.194  -8.518
  522    HG3  GLU  68           2HG      GLU  68   8.229   7.081  -8.962
  523    H    VAL  69           H        VAL  69   6.746   6.515  -3.887
  524    HA   VAL  69           HA       VAL  69   4.167   7.560  -4.826
  525    HB   VAL  69           HB       VAL  69   3.510   5.811  -3.487
  526   HG11  VAL  69          1HG1      VAL  69   5.705   5.125  -2.701
  527   HG12  VAL  69          2HG1      VAL  69   4.524   5.111  -1.398
  528   HG13  VAL  69          3HG1      VAL  69   5.705   6.423  -1.507
  529   HG21  VAL  69          3HG2      VAL  69   2.676   6.692  -1.371
  530   HG22  VAL  69          1HG2      VAL  69   2.455   7.851  -2.681
  531   HG23  VAL  69          2HG2      VAL  69   3.759   8.075  -1.515
  532    H    SER  70           H        SER  70   3.712   9.625  -4.551
  533    HA   SER  70           HA       SER  70   5.039  11.103  -2.400
  534    HB2  SER  70           1HB      SER  70   6.354  11.400  -4.499
  535    HB3  SER  70           2HB      SER  70   4.920  12.085  -5.261
  536    HG   SER  70           HG       SER  70   5.067  13.515  -3.204
  537    H    ALA  71           H        ALA  71   2.234  10.165  -3.658
  538    HA   ALA  71           HA       ALA  71   0.860  12.692  -3.024
  539    HB1  ALA  71           1HB      ALA  71  -1.036  11.855  -4.315
  540    HB2  ALA  71           2HB      ALA  71  -0.161  10.361  -4.650
  541    HB3  ALA  71           3HB      ALA  71   0.426  11.891  -5.300
  542    H    MET  72           H        MET  72  -0.980  12.593  -1.642
  543    HA   MET  72           HA       MET  72  -1.056  10.157  -0.002
  544    HB2  MET  72           1HB      MET  72  -1.207  13.015   0.960
  545    HB3  MET  72           2HB      MET  72  -1.455  11.603   1.973
  546    HG2  MET  72           1HG      MET  72   0.724  12.237   2.413
  547    HG3  MET  72           2HG      MET  72   0.897  10.908   1.273
  548    HE1  MET  72           3HE      MET  72   3.896  13.272   0.406
  549    HE2  MET  72           1HE      MET  72   3.407  11.668   0.955
  550    HE3  MET  72           2HE      MET  72   3.198  13.065   2.012
  551    HA   PRO  73           HA       PRO  73  -2.034   8.848   0.678
  552    HB2  PRO  73           1HB      PRO  73  -3.990   6.976   0.588
  553    HB3  PRO  73           2HB      PRO  73  -3.753   8.073   1.945
  554    HG2  PRO  73           1HG      PRO  73  -5.899   8.010  -0.037
  555    HG3  PRO  73           2HG      PRO  73  -5.848   8.854   1.527
  556    HD2  PRO  73           1HD      PRO  73  -5.397   9.904  -1.146
  557    HD3  PRO  73           2HD      PRO  73  -5.490  10.783   0.390
  558    H    THR  74           H        THR  74  -1.344   6.828  -0.282
  559    HA   THR  74           HA       THR  74  -2.095   6.386  -3.089
  560    HB   THR  74           HB       THR  74   0.701   6.796  -2.031
  561    HG1  THR  74           1HG      THR  74  -0.034   8.663  -2.853
  562   HG21  THR  74          3HG2      THR  74   1.460   6.102  -4.342
  563   HG22  THR  74          1HG2      THR  74  -0.135   5.370  -4.558
  564   HG23  THR  74          2HG2      THR  74   0.944   4.798  -3.276
  565    H    LEU  75           H        LEU  75  -2.410   4.348  -3.560
  566    HA   LEU  75           HA       LEU  75  -1.515   2.278  -1.675
  567    HB2  LEU  75           1HB      LEU  75  -3.464   2.153  -3.972
  568    HB3  LEU  75           2HB      LEU  75  -3.085   0.826  -2.890
  569    HG   LEU  75           HG       LEU  75  -3.916   2.722  -1.124
  570   HD11  LEU  75          1HD1      LEU  75  -5.685   3.007  -3.573
  571   HD12  LEU  75          2HD1      LEU  75  -4.562   4.239  -2.992
  572   HD13  LEU  75          3HD1      LEU  75  -5.932   3.755  -1.993
  573   HD21  LEU  75          3HD2      LEU  75  -5.384   0.560  -2.593
  574   HD22  LEU  75          1HD2      LEU  75  -6.090   1.437  -1.235
  575   HD23  LEU  75          2HD2      LEU  75  -4.617   0.495  -1.008
  576    H    LEU  76           H        LEU  76   0.220   1.075  -2.246
  577    HA   LEU  76           HA       LEU  76   0.824   0.859  -5.120
  578    HB2  LEU  76           1HB      LEU  76   2.491   1.668  -2.908
  579    HB3  LEU  76           2HB      LEU  76   3.156   0.245  -3.683
  580    HG   LEU  76           HG       LEU  76   2.443   2.800  -5.131
  581   HD11  LEU  76          1HD1      LEU  76   4.301   3.199  -3.628
  582   HD12  LEU  76          2HD1      LEU  76   4.887   3.141  -5.300
  583   HD13  LEU  76          3HD1      LEU  76   5.123   1.756  -4.220
  584   HD21  LEU  76          3HD2      LEU  76   3.551   1.841  -7.017
  585   HD22  LEU  76          1HD2      LEU  76   2.359   0.676  -6.446
  586   HD23  LEU  76          2HD2      LEU  76   4.064   0.442  -6.075
  587    H    LEU  77           H        LEU  77   0.314  -1.052  -5.850
  588    HA   LEU  77           HA       LEU  77   0.444  -3.402  -4.095
  589    HB2  LEU  77           1HB      LEU  77  -0.787  -2.914  -6.809
  590    HB3  LEU  77           2HB      LEU  77  -0.619  -4.517  -6.137
  591    HG   LEU  77           HG       LEU  77  -2.324  -4.187  -4.568
  592   HD11  LEU  77          1HD1      LEU  77  -2.144  -1.207  -5.060
  593   HD12  LEU  77          2HD1      LEU  77  -1.528  -2.044  -3.635
  594   HD13  LEU  77          3HD1      LEU  77  -3.261  -2.020  -3.964
  595   HD21  LEU  77          3HD2      LEU  77  -4.179  -3.328  -5.866
  596   HD22  LEU  77          1HD2      LEU  77  -3.098  -4.283  -6.886
  597   HD23  LEU  77          2HD2      LEU  77  -3.061  -2.517  -6.965
  598    H    PHE  78           H        PHE  78   2.004  -4.920  -4.378
  599    HA   PHE  78           HA       PHE  78   3.560  -4.831  -6.869
  600    HB2  PHE  78           1HB      PHE  78   4.601  -4.969  -4.055
  601    HB3  PHE  78           2HB      PHE  78   5.538  -5.559  -5.418
  602    HD1  PHE  78           1HD      PHE  78   3.962  -2.537  -3.981
  603    HD2  PHE  78           2HD      PHE  78   6.731  -4.095  -6.804
  604    HE1  PHE  78           1HE      PHE  78   4.834  -0.277  -4.382
  605    HE2  PHE  78           2HE      PHE  78   7.603  -1.834  -7.210
  606    HZ   PHE  78           HZ       PHE  78   6.653   0.081  -5.993
  607    H    LYS  79           H        LYS  79   4.509  -6.858  -7.517
  608    HA   LYS  79           HA       LYS  79   3.872  -9.142  -5.785
  609    HB2  LYS  79           1HB      LYS  79   2.191  -8.787  -7.728
  610    HB3  LYS  79           2HB      LYS  79   3.494  -9.360  -8.758
  611    HG2  LYS  79           1HG      LYS  79   3.387 -11.497  -7.941
  612    HG3  LYS  79           2HG      LYS  79   2.718 -10.986  -6.388
  613    HD2  LYS  79           1HD      LYS  79   0.603 -10.412  -7.531
  614    HD3  LYS  79           2HD      LYS  79   1.279 -11.023  -9.039
  615    HE2  LYS  79           1HE      LYS  79   1.032 -12.689  -6.547
  616    HE3  LYS  79           2HE      LYS  79  -0.230 -12.604  -7.775
  617    HZ1  LYS  79           3HZ      LYS  79   2.552 -13.557  -8.184
  618    HZ2  LYS  79           1HZ      LYS  79   1.390 -13.410  -9.404
  619    HZ3  LYS  79           2HZ      LYS  79   1.160 -14.513  -8.142
  620    H    ASN  80           H        ASN  80   5.611 -10.299  -5.425
  621    HA   ASN  80           HA       ASN  80   7.740 -11.022  -5.429
  622    HB2  ASN  80           1HB      ASN  80   8.498 -12.161  -7.514
  623    HB3  ASN  80           2HB      ASN  80   6.917 -12.663  -6.936
  624   HD21  ASN  80          1HD2      ASN  80   5.138 -12.296  -8.203
  625   HD22  ASN  80          2HD2      ASN  80   5.233 -11.719  -9.831
  626    H    GLY  81           H        GLY  81   7.943  -8.385  -5.328
  627    HA2  GLY  81           1HA      GLY  81   9.717  -6.891  -5.415
  628    HA3  GLY  81           2HA      GLY  81  10.572  -8.034  -6.448
  629    H    LYS  82           H        LYS  82   7.598  -7.587  -7.766
  630    HA   LYS  82           HA       LYS  82   8.495  -5.327  -9.433
  631    HB2  LYS  82           1HB      LYS  82   6.653  -7.580 -10.262
  632    HB3  LYS  82           2HB      LYS  82   7.286  -6.305 -11.291
  633    HG2  LYS  82           1HG      LYS  82   9.555  -7.224 -10.976
  634    HG3  LYS  82           2HG      LYS  82   8.857  -8.543 -10.024
  635    HD2  LYS  82           1HD      LYS  82   7.525  -9.239 -11.937
  636    HD3  LYS  82           2HD      LYS  82   8.163  -7.900 -12.890
  637    HE2  LYS  82           1HE      LYS  82  10.421  -8.840 -12.667
  638    HE3  LYS  82           2HE      LYS  82   9.756 -10.192 -11.754
  639    HZ1  LYS  82           3HZ      LYS  82   8.450 -10.816 -13.680
  640    HZ2  LYS  82           1HZ      LYS  82  10.092 -10.759 -14.082
  641    HZ3  LYS  82           2HZ      LYS  82   9.061  -9.507 -14.557
  642    H    GLU  83           H        GLU  83   6.656  -3.995 -10.230
  643    HA   GLU  83           HA       GLU  83   4.703  -3.527  -8.209
  644    HB2  GLU  83           1HB      GLU  83   5.723  -1.825  -9.806
  645    HB3  GLU  83           2HB      GLU  83   4.696  -2.504 -11.057
  646    HG2  GLU  83           1HG      GLU  83   2.715  -1.800  -9.917
  647    HG3  GLU  83           2HG      GLU  83   3.653  -1.326  -8.495
  648    H    VAL  84           H        VAL  84   2.300  -3.361  -8.994
  649    HA   VAL  84           HA       VAL  84   1.620  -5.001 -11.267
  650    HB   VAL  84           HB       VAL  84  -0.391  -5.938  -9.903
  651   HG11  VAL  84          1HG1      VAL  84   1.356  -7.284 -11.021
  652   HG12  VAL  84          2HG1      VAL  84   0.782  -8.003  -9.518
  653   HG13  VAL  84          3HG1      VAL  84   2.338  -7.169  -9.559
  654   HG21  VAL  84          3HG2      VAL  84   0.118  -4.772  -7.854
  655   HG22  VAL  84          1HG2      VAL  84   1.688  -5.565  -7.770
  656   HG23  VAL  84          2HG2      VAL  84   0.210  -6.515  -7.609
  657    H    ALA  85           H        ALA  85   0.707  -2.754  -8.745
  658    HA   ALA  85           HA       ALA  85  -0.644  -1.103 -10.601
  659    HB1  ALA  85           1HB      ALA  85  -2.468  -2.607 -10.428
  660    HB2  ALA  85           2HB      ALA  85  -2.888  -1.194  -9.458
  661    HB3  ALA  85           3HB      ALA  85  -2.327  -2.672  -8.675
  662    H    LYS  86           H        LYS  86  -1.127   0.956  -9.796
  663    HA   LYS  86           HA       LYS  86  -0.769   1.426  -6.946
  664    HB2  LYS  86           1HB      LYS  86   0.714   3.400  -7.411
  665    HB3  LYS  86           2HB      LYS  86   1.460   1.832  -7.659
  666    HG2  LYS  86           1HG      LYS  86   1.348   2.053 -10.017
  667    HG3  LYS  86           2HG      LYS  86   0.309   3.475  -9.893
  668    HD2  LYS  86           1HD      LYS  86   2.089   4.763  -8.924
  669    HD3  LYS  86           2HD      LYS  86   3.123   3.339  -8.823
  670    HE2  LYS  86           1HE      LYS  86   2.061   4.408 -11.425
  671    HE3  LYS  86           2HE      LYS  86   3.588   4.943 -10.725
  672    HZ1  LYS  86           3HZ      LYS  86   2.905   2.153 -11.491
  673    HZ2  LYS  86           1HZ      LYS  86   4.353   2.638 -10.768
  674    HZ3  LYS  86           2HZ      LYS  86   3.956   3.189 -12.317
  675    H    VAL  87           H        VAL  87  -2.102   2.957  -6.170
  676    HA   VAL  87           HA       VAL  87  -3.553   4.616  -8.115
  677    HB   VAL  87           HB       VAL  87  -4.925   3.064  -5.915
  678   HG11  VAL  87          1HG1      VAL  87  -6.049   4.769  -8.135
  679   HG12  VAL  87          2HG1      VAL  87  -5.982   5.205  -6.428
  680   HG13  VAL  87          3HG1      VAL  87  -6.988   3.857  -6.955
  681   HG21  VAL  87          3HG2      VAL  87  -4.905   2.586  -8.894
  682   HG22  VAL  87          1HG2      VAL  87  -5.967   1.773  -7.745
  683   HG23  VAL  87          2HG2      VAL  87  -4.223   1.535  -7.653
  684    H    VAL  88           H        VAL  88  -3.563   6.670  -7.525
  685    HA   VAL  88           HA       VAL  88  -2.741   7.359  -4.820
  686    HB   VAL  88           HB       VAL  88  -2.641   9.701  -5.712
  687   HG11  VAL  88          1HG1      VAL  88  -1.070   7.620  -7.228
  688   HG12  VAL  88          2HG1      VAL  88  -0.665   8.274  -5.642
  689   HG13  VAL  88          3HG1      VAL  88  -0.634   9.320  -7.061
  690   HG21  VAL  88          3HG2      VAL  88  -4.293   9.465  -7.510
  691   HG22  VAL  88          1HG2      VAL  88  -3.215   8.355  -8.354
  692   HG23  VAL  88          2HG2      VAL  88  -2.746  10.039  -8.130
  693    H    GLY  89           H        GLY  89  -5.106   6.302  -4.456
  694    HA2  GLY  89           1HA      GLY  89  -6.625   8.123  -3.124
  695    HA3  GLY  89           2HA      GLY  89  -7.261   8.182  -4.761
  696    H    ALA  90           H        ALA  90  -7.944   6.986  -1.901
  697    HA   ALA  90           HA       ALA  90  -8.419   4.256  -2.227
  698    HB1  ALA  90           1HB      ALA  90 -10.119   6.116  -0.607
  699    HB2  ALA  90           2HB      ALA  90  -8.506   5.614  -0.118
  700    HB3  ALA  90           3HB      ALA  90  -9.783   4.406  -0.307
  701    H    ASN  91           H        ASN  91  -9.600   3.334  -3.738
  702    HA   ASN  91           HA       ASN  91 -12.238   4.500  -4.318
  703    HB2  ASN  91           1HB      ASN  91 -10.226   3.879  -6.129
  704    HB3  ASN  91           2HB      ASN  91 -11.305   2.490  -6.214
  705   HD21  ASN  91          1HD2      ASN  91 -12.398   5.716  -5.420
  706   HD22  ASN  91          2HD2      ASN  91 -13.303   5.970  -6.872
  707    HA   PRO  92           HA       PRO  92 -13.083   1.412  -1.150
  708    HB2  PRO  92           1HB      PRO  92 -15.667   1.703  -2.647
  709    HB3  PRO  92           2HB      PRO  92 -15.397   1.527  -0.908
  710    HG2  PRO  92           1HG      PRO  92 -15.750   3.942  -2.087
  711    HG3  PRO  92           2HG      PRO  92 -14.740   3.712  -0.650
  712    HD2  PRO  92           1HD      PRO  92 -13.931   4.442  -3.342
  713    HD3  PRO  92           2HD      PRO  92 -12.951   4.392  -1.870
  714    H    ALA  93           H        ALA  93 -15.276   0.458  -3.772
  715    HA   ALA  93           HA       ALA  93 -14.463  -2.275  -3.301
  716    HB1  ALA  93           1HB      ALA  93 -16.310  -2.887  -4.756
  717    HB2  ALA  93           2HB      ALA  93 -16.531  -1.197  -5.209
  718    HB3  ALA  93           3HB      ALA  93 -16.831  -1.712  -3.549
  719    H    ALA  94           H        ALA  94 -13.918   0.140  -5.737
  720    HA   ALA  94           HA       ALA  94 -13.214  -1.599  -7.854
  721    HB1  ALA  94           1HB      ALA  94 -13.754   0.777  -8.189
  722    HB2  ALA  94           2HB      ALA  94 -12.194   0.348  -8.889
  723    HB3  ALA  94           3HB      ALA  94 -12.262   1.224  -7.360
  724    H    ILE  95           H        ILE  95 -11.384  -0.226  -5.170
  725    HA   ILE  95           HA       ILE  95  -8.909  -1.245  -6.249
  726    HB   ILE  95           HB       ILE  95  -9.398  -0.052  -3.521
  727   HG12  ILE  95          1HG1      ILE  95  -9.884   1.589  -5.228
  728   HG13  ILE  95          2HG1      ILE  95  -8.320   1.968  -4.516
  729   HG21  ILE  95          1HG2      ILE  95  -7.413  -1.446  -3.596
  730   HG22  ILE  95          2HG2      ILE  95  -6.970   0.256  -3.492
  731   HG23  ILE  95          3HG2      ILE  95  -6.845  -0.591  -5.032
  732   HD11  ILE  95          3HD1      ILE  95  -8.798   0.609  -7.157
  733   HD12  ILE  95          1HD1      ILE  95  -7.217   0.912  -6.438
  734   HD13  ILE  95          2HD1      ILE  95  -8.247   2.264  -6.905
  735    H    LYS  96           H        LYS  96 -11.269  -2.247  -3.801
  736    HA   LYS  96           HA       LYS  96  -9.785  -4.432  -2.820
  737    HB2  LYS  96           1HB      LYS  96 -12.771  -4.593  -3.268
  738    HB3  LYS  96           2HB      LYS  96 -11.795  -5.404  -2.034
  739    HG2  LYS  96           1HG      LYS  96 -11.359  -3.130  -1.072
  740    HG3  LYS  96           2HG      LYS  96 -12.600  -2.518  -2.159
  741    HD2  LYS  96           1HD      LYS  96 -13.008  -4.728  -0.146
  742    HD3  LYS  96           2HD      LYS  96 -13.455  -3.040   0.108
  743    HE2  LYS  96           1HE      LYS  96 -15.067  -3.118  -1.631
  744    HE3  LYS  96           2HE      LYS  96 -14.481  -4.680  -2.196
  745    HZ1  LYS  96           3HZ      LYS  96 -15.741  -4.209   0.445
  746    HZ2  LYS  96           1HZ      LYS  96 -15.280  -5.702  -0.202
  747    HZ3  LYS  96           2HZ      LYS  96 -16.544  -4.827  -0.907
  748    H    GLN  97           H        GLN  97 -11.869  -4.027  -5.631
  749    HA   GLN  97           HA       GLN  97 -11.547  -6.609  -6.702
  750    HB2  GLN  97           1HB      GLN  97 -12.356  -3.957  -7.799
  751    HB3  GLN  97           2HB      GLN  97 -11.947  -5.248  -8.924
  752    HG2  GLN  97           1HG      GLN  97 -14.098  -5.274  -6.828
  753    HG3  GLN  97           2HG      GLN  97 -14.302  -5.268  -8.582
  754   HE21  GLN  97          1HE2      GLN  97 -13.642  -7.139  -9.757
  755   HE22  GLN  97          2HE2      GLN  97 -13.651  -8.693  -8.997
  756    H    ALA  98           H        ALA  98  -9.498  -3.784  -6.741
  757    HA   ALA  98           HA       ALA  98  -7.831  -4.574  -8.883
  758    HB1  ALA  98           1HB      ALA  98  -7.191  -2.785  -6.552
  759    HB2  ALA  98           2HB      ALA  98  -7.886  -2.274  -8.089
  760    HB3  ALA  98           3HB      ALA  98  -6.252  -2.933  -8.037
  761    H    ILE  99           H        ILE  99  -7.461  -4.810  -5.376
  762    HA   ILE  99           HA       ILE  99  -5.043  -6.133  -5.260
  763    HB   ILE  99           HB       ILE  99  -7.292  -6.883  -3.384
  764   HG12  ILE  99          1HG1      ILE  99  -7.515  -4.544  -3.379
  765   HG13  ILE  99          2HG1      ILE  99  -6.446  -4.885  -2.021
  766   HG21  ILE  99          1HG2      ILE  99  -4.312  -6.614  -3.163
  767   HG22  ILE  99          2HG2      ILE  99  -5.271  -8.091  -3.068
  768   HG23  ILE  99          3HG2      ILE  99  -5.374  -6.886  -1.783
  769   HD11  ILE  99          3HD1      ILE  99  -4.531  -4.347  -3.487
  770   HD12  ILE  99          1HD1      ILE  99  -5.625  -2.992  -3.199
  771   HD13  ILE  99          2HD1      ILE  99  -5.692  -3.867  -4.734
  772    H    ALA 100           H        ALA 100  -8.283  -7.476  -5.722
  773    HA   ALA 100           HA       ALA 100  -7.439 -10.207  -5.766
  774    HB1  ALA 100           1HB      ALA 100  -9.970  -8.972  -6.847
  775    HB2  ALA 100           2HB      ALA 100  -9.733  -9.557  -5.200
  776    HB3  ALA 100           3HB      ALA 100  -9.692 -10.688  -6.553
  777    H    ALA 101           H        ALA 101  -7.782  -7.698  -8.167
  778    HA   ALA 101           HA       ALA 101  -7.641  -9.389 -10.459
  779    HB1  ALA 101           1HB      ALA 101  -7.408  -7.345 -11.723
  780    HB2  ALA 101           2HB      ALA 101  -7.021  -6.440 -10.255
  781    HB3  ALA 101           3HB      ALA 101  -8.640  -7.122 -10.477
  782    H    ASN 102           H        ASN 102  -5.285  -7.678  -8.509
  783    HA   ASN 102           HA       ASN 102  -3.141  -8.191 -10.392
  784    HB2  ASN 102           1HB      ASN 102  -3.108  -6.896  -7.669
  785    HB3  ASN 102           2HB      ASN 102  -1.723  -6.992  -8.744
  786   HD21  ASN 102          1HD2      ASN 102  -4.578  -5.360  -7.950
  787   HD22  ASN 102          2HD2      ASN 102  -4.588  -4.206  -9.232
  788    H    ALA 103           H        ALA 103  -4.493  -9.665  -7.604
  789    HA   ALA 103           HA       ALA 103  -2.189 -11.211  -6.896
  790    HB1  ALA 103           1HB      ALA 103  -3.716 -12.458  -5.455
  791    HB2  ALA 103           2HB      ALA 103  -5.092 -11.655  -6.209
  792    HB3  ALA 103           3HB      ALA 103  -3.939 -10.719  -5.260
  Start of MODEL    3
    1    H1   MET   1           1H       MET   1  -6.235  -6.483   9.408
    2    H2   MET   1           2H       MET   1  -6.823  -6.530  10.990
    3    H3   MET   1           3H       MET   1  -5.357  -7.280  10.611
    4    HA   MET   1           HA       MET   1  -5.882  -4.373  10.459
    5    HB2  MET   1           1HB      MET   1  -5.823  -5.113  12.767
    6    HB3  MET   1           2HB      MET   1  -4.345  -6.020  12.475
    7    HG2  MET   1           1HG      MET   1  -3.099  -4.009  12.131
    8    HG3  MET   1           2HG      MET   1  -4.568  -3.036  12.184
    9    HE1  MET   1           3HE      MET   1  -6.205  -4.259  14.562
   10    HE2  MET   1           1HE      MET   1  -5.953  -2.533  14.306
   11    HE3  MET   1           2HE      MET   1  -5.651  -3.242  15.892
   12    H    VAL   2           H        VAL   2  -4.316  -3.182   9.543
   13    HA   VAL   2           HA       VAL   2  -2.416  -4.650   7.915
   14    HB   VAL   2           HB       VAL   2  -3.336  -1.782   7.924
   15   HG11  VAL   2          1HG1      VAL   2  -1.079  -1.709   7.177
   16   HG12  VAL   2          2HG1      VAL   2  -2.110  -1.628   5.745
   17   HG13  VAL   2          3HG1      VAL   2  -1.307  -3.137   6.172
   18   HG21  VAL   2          3HG2      VAL   2  -3.680  -3.565   5.602
   19   HG22  VAL   2          1HG2      VAL   2  -4.756  -2.342   6.266
   20   HG23  VAL   2          2HG2      VAL   2  -4.651  -3.927   7.029
   21    H    THR   3           H        THR   3  -0.238  -4.492   7.983
   22    HA   THR   3           HA       THR   3   0.856  -3.837  10.573
   23    HB   THR   3           HB       THR   3   2.339  -4.932   8.183
   24    HG1  THR   3           1HG      THR   3   0.375  -6.079   9.760
   25   HG21  THR   3          3HG2      THR   3   3.722  -4.239  10.087
   26   HG22  THR   3          1HG2      THR   3   3.743  -5.991   9.888
   27   HG23  THR   3          2HG2      THR   3   2.762  -5.260  11.157
   28    H    GLN   4           H        GLN   4   2.548  -2.449  11.006
   29    HA   GLN   4           HA       GLN   4   2.690  -0.108   9.257
   30    HB2  GLN   4           1HB      GLN   4   2.193  -0.061  11.749
   31    HB3  GLN   4           2HB      GLN   4   3.879  -0.474  12.008
   32    HG2  GLN   4           1HG      GLN   4   3.707   1.864  12.251
   33    HG3  GLN   4           2HG      GLN   4   4.476   1.577  10.689
   34   HE21  GLN   4          1HE2      GLN   4   3.307   1.951   8.806
   35   HE22  GLN   4          2HE2      GLN   4   1.864   2.894   8.796
   36    H    PHE   5           H        PHE   5   4.374   0.140   7.888
   37    HA   PHE   5           HA       PHE   5   6.957  -1.156   8.322
   38    HB2  PHE   5           1HB      PHE   5   5.936   0.799   6.259
   39    HB3  PHE   5           2HB      PHE   5   7.627   0.359   6.362
   40    HD1  PHE   5           1HD      PHE   5   7.039  -2.621   7.037
   41    HD2  PHE   5           2HD      PHE   5   5.630   0.072   4.060
   42    HE1  PHE   5           1HE      PHE   5   6.669  -4.510   5.505
   43    HE2  PHE   5           2HE      PHE   5   5.249  -1.810   2.529
   44    HZ   PHE   5           HZ       PHE   5   5.771  -4.100   3.250
   45    H    LYS   6           H        LYS   6   8.920   0.037   8.688
   46    HA   LYS   6           HA       LYS   6   8.569   2.891   9.289
   47    HB2  LYS   6           1HB      LYS   6  10.033   2.753  11.216
   48    HB3  LYS   6           2HB      LYS   6   8.667   1.667  11.414
   49    HG2  LYS   6           1HG      LYS   6  10.158  -0.181  10.601
   50    HG3  LYS   6           2HG      LYS   6  11.498   0.957  10.734
   51    HD2  LYS   6           1HD      LYS   6  11.122   1.208  13.095
   52    HD3  LYS   6           2HD      LYS   6   9.653   0.229  13.005
   53    HE2  LYS   6           1HE      LYS   6  12.479  -0.690  12.493
   54    HE3  LYS   6           2HE      LYS   6  11.464  -1.111  13.873
   55    HZ1  LYS   6           3HZ      LYS   6  10.938  -1.836  11.036
   56    HZ2  LYS   6           1HZ      LYS   6   9.936  -2.220  12.348
   57    HZ3  LYS   6           2HZ      LYS   6  11.487  -2.884  12.249
   58    H    THR   7           H        THR   7  10.105   0.631   7.432
   59    HA   THR   7           HA       THR   7  12.172   2.581   6.713
   60    HB   THR   7           HB       THR   7  13.803   0.671   6.356
   61    HG1  THR   7           1HG      THR   7  12.138  -0.692   8.221
   62   HG21  THR   7          3HG2      THR   7  12.988   1.299   9.192
   63   HG22  THR   7          1HG2      THR   7  14.078   2.252   8.187
   64   HG23  THR   7          2HG2      THR   7  14.541   0.628   8.693
   65    H    ALA   8           H        ALA   8  13.216   2.068   4.606
   66    HA   ALA   8           HA       ALA   8  11.199   1.441   2.665
   67    HB1  ALA   8           1HB      ALA   8  12.782   3.224   2.228
   68    HB2  ALA   8           2HB      ALA   8  12.922   1.962   1.010
   69    HB3  ALA   8           3HB      ALA   8  14.119   2.077   2.297
   70    H    SER   9           H        SER   9  14.031  -0.125   4.014
   71    HA   SER   9           HA       SER   9  14.201  -2.314   2.288
   72    HB2  SER   9           1HB      SER   9  14.716  -2.249   5.272
   73    HB3  SER   9           2HB      SER   9  15.322  -3.461   4.144
   74    HG   SER   9           HG       SER   9  16.644  -1.445   4.802
   75    H    GLU  10           H        GLU  10  12.266  -1.845   5.237
   76    HA   GLU  10           HA       GLU  10  10.829  -4.176   5.275
   77    HB2  GLU  10           1HB      GLU  10  10.278  -1.364   6.079
   78    HB3  GLU  10           2HB      GLU  10   8.957  -2.525   6.125
   79    HG2  GLU  10           1HG      GLU  10  10.152  -3.923   7.609
   80    HG3  GLU  10           2HG      GLU  10  11.611  -2.961   7.454
   81    H    PHE  11           H        PHE  11  10.126  -1.223   3.364
   82    HA   PHE  11           HA       PHE  11   7.749  -2.131   2.206
   83    HB2  PHE  11           1HB      PHE  11   8.620   0.200   2.015
   84    HB3  PHE  11           2HB      PHE  11   9.834  -0.371   0.877
   85    HD1  PHE  11           1HD      PHE  11   8.900  -1.598  -1.234
   86    HD2  PHE  11           2HD      PHE  11   6.611   1.025   1.212
   87    HE1  PHE  11           1HE      PHE  11   7.343  -1.229  -3.095
   88    HE2  PHE  11           2HE      PHE  11   5.042   1.410  -0.662
   89    HZ   PHE  11           HZ       PHE  11   5.414   0.272  -2.811
   90    H    ASP  12           H        ASP  12  11.004  -2.268   0.800
   91    HA   ASP  12           HA       ASP  12  10.301  -3.775  -1.468
   92    HB2  ASP  12           1HB      ASP  12  12.951  -3.497  -0.047
   93    HB3  ASP  12           2HB      ASP  12  12.753  -4.322  -1.588
   94    H    SER  13           H        SER  13  11.026  -4.776   1.791
   95    HA   SER  13           HA       SER  13  11.573  -7.496   1.292
   96    HB2  SER  13           1HB      SER  13  12.043  -6.369   3.456
   97    HB3  SER  13           2HB      SER  13  10.311  -6.242   3.751
   98    HG   SER  13           HG       SER  13  10.512  -8.134   4.624
   99    H    ALA  14           H        ALA  14   8.574  -5.767   2.013
  100    HA   ALA  14           HA       ALA  14   6.901  -8.034   1.934
  101    HB1  ALA  14           1HB      ALA  14   5.062  -6.421   1.851
  102    HB2  ALA  14           2HB      ALA  14   6.224  -5.122   1.554
  103    HB3  ALA  14           3HB      ALA  14   6.248  -5.999   3.086
  104    H    ILE  15           H        ILE  15   8.359  -6.108  -0.460
  105    HA   ILE  15           HA       ILE  15   6.510  -6.645  -2.582
  106    HB   ILE  15           HB       ILE  15   9.380  -5.773  -2.791
  107   HG12  ILE  15          1HG1      ILE  15   8.390  -4.107  -1.447
  108   HG13  ILE  15          2HG1      ILE  15   8.353  -3.485  -3.092
  109   HG21  ILE  15          1HG2      ILE  15   8.955  -5.110  -4.951
  110   HG22  ILE  15          2HG2      ILE  15   7.213  -5.079  -4.703
  111   HG23  ILE  15          3HG2      ILE  15   8.053  -6.623  -4.825
  112   HD11  ILE  15          3HD1      ILE  15   6.041  -4.743  -1.642
  113   HD12  ILE  15          1HD1      ILE  15   6.010  -4.081  -3.276
  114   HD13  ILE  15          2HD1      ILE  15   6.288  -3.017  -1.899
  115    H    ALA  16           H        ALA  16   9.435  -8.108  -1.342
  116    HA   ALA  16           HA       ALA  16  10.032  -9.488  -3.803
  117    HB1  ALA  16           1HB      ALA  16  11.825  -8.533  -2.481
  118    HB2  ALA  16           2HB      ALA  16  12.022 -10.281  -2.617
  119    HB3  ALA  16           3HB      ALA  16  11.404  -9.576  -1.123
  120    H    GLN  17           H        GLN  17   7.664 -10.247  -1.882
  121    HA   GLN  17           HA       GLN  17   8.306 -13.073  -1.607
  122    HB2  GLN  17           1HB      GLN  17   5.976 -13.011  -0.486
  123    HB3  GLN  17           2HB      GLN  17   7.353 -12.372   0.376
  124    HG2  GLN  17           1HG      GLN  17   6.713 -10.120  -0.365
  125    HG3  GLN  17           2HG      GLN  17   5.265 -10.817  -1.094
  126   HE21  GLN  17          1HE2      GLN  17   3.996  -9.568   0.262
  127   HE22  GLN  17          2HE2      GLN  17   3.746  -9.982   1.929
  128    H    ASP  18           H        ASP  18   6.523 -14.608  -2.181
  129    HA   ASP  18           HA       ASP  18   5.957 -14.166  -4.983
  130    HB2  ASP  18           1HB      ASP  18   5.470 -16.525  -5.076
  131    HB3  ASP  18           2HB      ASP  18   6.923 -16.303  -4.110
  132    H    LYS  19           H        LYS  19   4.342 -12.537  -3.287
  133    HA   LYS  19           HA       LYS  19   1.723 -13.500  -4.092
  134    HB2  LYS  19           1HB      LYS  19   0.710 -13.112  -1.895
  135    HB3  LYS  19           2HB      LYS  19   1.920 -14.382  -1.828
  136    HG2  LYS  19           1HG      LYS  19   3.452 -13.012  -0.698
  137    HG3  LYS  19           2HG      LYS  19   2.543 -11.549  -1.075
  138    HD2  LYS  19           1HD      LYS  19   2.222 -12.158   1.252
  139    HD3  LYS  19           2HD      LYS  19   0.710 -12.333   0.366
  140    HE2  LYS  19           1HE      LYS  19   2.533 -14.676   0.762
  141    HE3  LYS  19           2HE      LYS  19   1.429 -14.177   2.038
  142    HZ1  LYS  19           3HZ      LYS  19  -0.395 -14.387   0.373
  143    HZ2  LYS  19           1HZ      LYS  19   0.366 -15.847   0.764
  144    HZ3  LYS  19           2HZ      LYS  19   0.718 -15.080  -0.697
  145    H    LEU  20           H        LEU  20   0.036 -11.809  -3.475
  146    HA   LEU  20           HA       LEU  20   0.912  -9.280  -4.521
  147    HB2  LEU  20           1HB      LEU  20  -1.303 -10.536  -4.943
  148    HB3  LEU  20           2HB      LEU  20  -1.806  -9.915  -3.389
  149    HG   LEU  20           HG       LEU  20  -2.682  -8.608  -5.287
  150   HD11  LEU  20          1HD1      LEU  20  -2.363  -7.521  -3.120
  151   HD12  LEU  20          2HD1      LEU  20  -2.124  -6.402  -4.460
  152   HD13  LEU  20          3HD1      LEU  20  -0.731  -7.055  -3.598
  153   HD21  LEU  20          3HD2      LEU  20  -0.640  -9.001  -6.705
  154   HD22  LEU  20          1HD2      LEU  20   0.142  -7.714  -5.786
  155   HD23  LEU  20          2HD2      LEU  20  -1.309  -7.364  -6.744
  156    H    VAL  21           H        VAL  21   1.581  -7.616  -3.332
  157    HA   VAL  21           HA       VAL  21   0.817  -7.554  -0.492
  158    HB   VAL  21           HB       VAL  21   3.220  -7.717  -0.753
  159   HG11  VAL  21          1HG1      VAL  21   3.421  -6.802  -3.010
  160   HG12  VAL  21          2HG1      VAL  21   4.530  -6.012  -1.891
  161   HG13  VAL  21          3HG1      VAL  21   3.052  -5.192  -2.390
  162   HG21  VAL  21          3HG2      VAL  21   2.306  -4.976   0.101
  163   HG22  VAL  21          1HG2      VAL  21   3.902  -5.647   0.435
  164   HG23  VAL  21          2HG2      VAL  21   2.465  -6.412   1.112
  165    H    VAL  22           H        VAL  22  -0.459  -5.969   0.184
  166    HA   VAL  22           HA       VAL  22  -1.036  -3.752  -1.651
  167    HB   VAL  22           HB       VAL  22  -2.497  -4.510   0.889
  168   HG11  VAL  22          1HG1      VAL  22  -2.820  -2.194   0.228
  169   HG12  VAL  22          2HG1      VAL  22  -4.300  -3.118  -0.034
  170   HG13  VAL  22          3HG1      VAL  22  -3.265  -2.701  -1.400
  171   HG21  VAL  22          3HG2      VAL  22  -4.194  -5.520  -0.558
  172   HG22  VAL  22          1HG2      VAL  22  -2.637  -6.334  -0.715
  173   HG23  VAL  22          2HG2      VAL  22  -3.175  -5.211  -1.964
  174    H    VAL  23           H        VAL  23   0.456  -2.187  -1.319
  175    HA   VAL  23           HA       VAL  23   1.204  -1.606   1.442
  176    HB   VAL  23           HB       VAL  23   2.436  -0.481  -1.073
  177   HG11  VAL  23          1HG1      VAL  23   3.201  -0.366   1.838
  178   HG12  VAL  23          2HG1      VAL  23   2.753   0.982   0.792
  179   HG13  VAL  23          3HG1      VAL  23   4.263   0.115   0.517
  180   HG21  VAL  23          3HG2      VAL  23   2.798  -2.891  -0.918
  181   HG22  VAL  23          1HG2      VAL  23   3.369  -2.702   0.741
  182   HG23  VAL  23          2HG2      VAL  23   4.294  -2.012  -0.596
  183    H    ALA  24           H        ALA  24   0.648   0.101   2.461
  184    HA   ALA  24           HA       ALA  24  -1.264   1.937   1.166
  185    HB1  ALA  24           1HB      ALA  24  -2.247   2.106   3.419
  186    HB2  ALA  24           2HB      ALA  24  -1.016   1.000   4.038
  187    HB3  ALA  24           3HB      ALA  24  -2.193   0.435   2.855
  188    H    PHE  25           H        PHE  25   0.137   3.659   0.634
  189    HA   PHE  25           HA       PHE  25   1.663   4.810   2.859
  190    HB2  PHE  25           1HB      PHE  25   2.009   4.807  -0.072
  191    HB3  PHE  25           2HB      PHE  25   2.465   6.292   0.759
  192    HD1  PHE  25           2HD      PHE  25   2.733   2.703   1.687
  193    HD2  PHE  25           1HD      PHE  25   4.747   6.375   0.980
  194    HE1  PHE  25           2HE      PHE  25   4.847   1.666   2.383
  195    HE2  PHE  25           1HE      PHE  25   6.866   5.350   1.682
  196    HZ   PHE  25           HZ       PHE  25   6.916   2.990   2.382
  197    H    TYR  26           H        TYR  26   1.328   6.766   3.650
  198    HA   TYR  26           HA       TYR  26  -0.465   8.672   2.423
  199    HB2  TYR  26           1HB      TYR  26  -1.912   8.734   4.524
  200    HB3  TYR  26           2HB      TYR  26  -2.161   7.360   3.454
  201    HD1  TYR  26           2HD      TYR  26  -0.773   8.424   6.705
  202    HD2  TYR  26           1HD      TYR  26  -1.611   5.143   4.143
  203    HE1  TYR  26           2HE      TYR  26  -0.371   6.868   8.572
  204    HE2  TYR  26           1HE      TYR  26  -1.219   3.581   5.982
  205    HH   TYR  26           HH       TYR  26  -0.918   4.609   9.245
  206    H    ALA  27           H        ALA  27  -0.908  10.368   4.477
  207    HA   ALA  27           HA       ALA  27   1.613  10.693   5.929
  208    HB1  ALA  27           1HB      ALA  27   1.876  12.072   3.949
  209    HB2  ALA  27           2HB      ALA  27   1.670  13.096   5.370
  210    HB3  ALA  27           3HB      ALA  27   0.325  12.850   4.256
  211    H    THR  28           H        THR  28   1.342  11.452   7.962
  212    HA   THR  28           HA       THR  28  -1.265  11.325   9.062
  213    HB   THR  28           HB       THR  28  -0.021  12.152  11.162
  214    HG1  THR  28           1HG      THR  28   1.946  12.817  10.781
  215   HG21  THR  28          3HG2      THR  28  -0.578   9.796  10.727
  216   HG22  THR  28          1HG2      THR  28   0.996   9.953  11.506
  217   HG23  THR  28          2HG2      THR  28   0.897   9.627   9.776
  218    H    TRP  29           H        TRP  29   0.607  13.937   7.806
  219    HA   TRP  29           HA       TRP  29  -0.945  15.961   9.162
  220    HB2  TRP  29           1HB      TRP  29   0.304  17.568   7.767
  221    HB3  TRP  29           2HB      TRP  29   1.376  16.470   8.623
  222    HD1  TRP  29           HD       TRP  29   3.076  15.125   7.195
  223    HE1  TRP  29           1HE      TRP  29   3.586  14.947   4.676
  224    HE3  TRP  29           3HE      TRP  29  -0.991  17.627   5.366
  225    HZ2  TRP  29           2HZ      TRP  29   2.410  15.760   2.241
  226    HZ3  TRP  29           3HZ      TRP  29  -1.229  17.877   2.937
  227    HH2  TRP  29           HH       TRP  29   0.441  16.966   1.402
  228    H    CYS  30           H        CYS  30  -1.352  13.958   6.509
  229    HA   CYS  30           HA       CYS  30  -2.921  15.832   4.936
  230    HB2  CYS  30           1HB      CYS  30  -1.361  14.215   3.854
  231    HB3  CYS  30           2HB      CYS  30  -2.350  12.894   4.463
  232    HG   CYS  30           HG       CYS  30  -3.592  15.288   2.362
  233    H    GLY  31           H        GLY  31  -5.130  15.682   4.647
  234    HA2  GLY  31           1HA      GLY  31  -6.611  14.722   6.866
  235    HA3  GLY  31           2HA      GLY  31  -7.280  15.406   5.398
  236    HA   PRO  32           HA       PRO  32  -8.742  11.591   3.908
  237    HB2  PRO  32           1HB      PRO  32  -7.587  11.074   1.496
  238    HB3  PRO  32           2HB      PRO  32  -8.806  12.327   1.750
  239    HG2  PRO  32           1HG      PRO  32  -5.826  12.583   1.622
  240    HG3  PRO  32           2HG      PRO  32  -7.070  13.601   0.870
  241    HD2  PRO  32           1HD      PRO  32  -5.816  14.338   3.128
  242    HD3  PRO  32           2HD      PRO  32  -7.528  14.717   2.845
  243    H    CYS  33           H        CYS  33  -5.668  11.513   5.036
  244    HA   CYS  33           HA       CYS  33  -4.622   9.069   4.107
  245    HB2  CYS  33           1HB      CYS  33  -3.282   9.066   6.168
  246    HB3  CYS  33           2HB      CYS  33  -3.293  10.661   5.424
  247    HG   CYS  33           HG       CYS  33  -4.320  11.969   7.407
  248    H    LYS  34           H        LYS  34  -7.056   9.870   6.421
  249    HA   LYS  34           HA       LYS  34  -7.226   7.394   7.759
  250    HB2  LYS  34           1HB      LYS  34  -9.417   8.191   8.530
  251    HB3  LYS  34           2HB      LYS  34  -8.170   9.412   8.718
  252    HG2  LYS  34           1HG      LYS  34  -8.995  10.694   6.936
  253    HG3  LYS  34           2HG      LYS  34  -9.985   9.364   6.333
  254    HD2  LYS  34           1HD      LYS  34 -10.417  10.732   8.986
  255    HD3  LYS  34           2HD      LYS  34 -11.279  11.147   7.503
  256    HE2  LYS  34           1HE      LYS  34 -12.083   8.802   7.378
  257    HE3  LYS  34           2HE      LYS  34 -11.314   8.492   8.933
  258    HZ1  LYS  34           3HZ      LYS  34 -13.452  10.490   8.455
  259    HZ2  LYS  34           1HZ      LYS  34 -12.740  10.133   9.945
  260    HZ3  LYS  34           2HZ      LYS  34 -13.676   8.970   9.154
  261    H    MET  35           H        MET  35  -8.005   8.157   4.544
  262    HA   MET  35           HA       MET  35 -10.298   6.387   4.380
  263    HB2  MET  35           1HB      MET  35  -9.394   8.457   2.827
  264    HB3  MET  35           2HB      MET  35  -8.855   7.059   1.900
  265    HG2  MET  35           1HG      MET  35 -11.664   7.787   2.690
  266    HG3  MET  35           2HG      MET  35 -10.984   7.684   1.069
  267    HE1  MET  35           3HE      MET  35 -13.615   6.372   1.235
  268    HE2  MET  35           1HE      MET  35 -13.353   4.712   0.701
  269    HE3  MET  35           2HE      MET  35 -12.549   6.037  -0.132
  270    H    ILE  36           H        ILE  36  -6.867   6.362   3.836
  271    HA   ILE  36           HA       ILE  36  -6.792   3.802   2.571
  272    HB   ILE  36           HB       ILE  36  -4.868   5.874   3.302
  273   HG12  ILE  36          1HG1      ILE  36  -3.997   5.428   1.141
  274   HG13  ILE  36          2HG1      ILE  36  -4.730   3.833   1.095
  275   HG21  ILE  36          1HG2      ILE  36  -4.072   2.988   3.464
  276   HG22  ILE  36          2HG2      ILE  36  -3.773   4.277   4.631
  277   HG23  ILE  36          3HG2      ILE  36  -2.923   4.269   3.085
  278   HD11  ILE  36          3HD1      ILE  36  -5.895   5.448  -0.327
  279   HD12  ILE  36          1HD1      ILE  36  -6.250   6.426   1.097
  280   HD13  ILE  36          2HD1      ILE  36  -6.929   4.804   0.952
  281    H    ALA  37           H        ALA  37  -6.700   4.985   5.817
  282    HA   ALA  37           HA       ALA  37  -5.624   2.770   7.099
  283    HB1  ALA  37           1HB      ALA  37  -7.061   3.468   9.060
  284    HB2  ALA  37           2HB      ALA  37  -7.695   4.742   8.020
  285    HB3  ALA  37           3HB      ALA  37  -5.979   4.688   8.396
  286    HA   PRO  38           HA       PRO  38  -9.670   0.510   7.598
  287    HB2  PRO  38           1HB      PRO  38 -12.043   1.717   6.686
  288    HB3  PRO  38           2HB      PRO  38 -11.449   1.685   8.345
  289    HG2  PRO  38           1HG      PRO  38 -11.698   3.950   6.705
  290    HG3  PRO  38           2HG      PRO  38 -10.837   3.857   8.247
  291    HD2  PRO  38           1HD      PRO  38  -9.776   3.726   5.470
  292    HD3  PRO  38           2HD      PRO  38  -9.038   4.404   6.930
  293    H    MET  39           H        MET  39  -9.704   2.187   4.447
  294    HA   MET  39           HA       MET  39 -11.343   0.238   3.152
  295    HB2  MET  39           1HB      MET  39 -11.188   2.366   2.093
  296    HB3  MET  39           2HB      MET  39  -9.438   2.361   2.194
  297    HG2  MET  39           1HG      MET  39  -9.868   0.164   0.687
  298    HG3  MET  39           2HG      MET  39 -11.212   1.190   0.196
  299    HE1  MET  39           3HE      MET  39  -8.053   3.174   1.412
  300    HE2  MET  39           1HE      MET  39  -6.908   2.803   0.130
  301    HE3  MET  39           2HE      MET  39  -7.477   1.517   1.210
  302    H    ILE  40           H        ILE  40  -7.907   0.676   3.592
  303    HA   ILE  40           HA       ILE  40  -7.152  -1.517   1.923
  304    HB   ILE  40           HB       ILE  40  -5.847   0.538   3.537
  305   HG12  ILE  40          1HG1      ILE  40  -4.605  -0.768   1.179
  306   HG13  ILE  40          2HG1      ILE  40  -6.101   0.132   0.945
  307   HG21  ILE  40          1HG2      ILE  40  -4.453  -2.112   3.150
  308   HG22  ILE  40          2HG2      ILE  40  -4.911  -1.385   4.689
  309   HG23  ILE  40          3HG2      ILE  40  -3.682  -0.620   3.687
  310   HD11  ILE  40          3HD1      ILE  40  -3.703   1.279   2.328
  311   HD12  ILE  40          1HD1      ILE  40  -5.128   2.123   1.740
  312   HD13  ILE  40          2HD1      ILE  40  -3.984   1.425   0.594
  313    H    GLU  41           H        GLU  41  -7.511  -1.050   5.460
  314    HA   GLU  41           HA       GLU  41  -6.742  -3.684   6.140
  315    HB2  GLU  41           1HB      GLU  41  -8.658  -1.777   7.517
  316    HB3  GLU  41           2HB      GLU  41  -8.169  -3.326   8.200
  317    HG2  GLU  41           1HG      GLU  41  -5.770  -2.440   7.900
  318    HG3  GLU  41           2HG      GLU  41  -6.538  -0.862   7.750
  319    H    LYS  42           H        LYS  42  -9.680  -2.318   4.919
  320    HA   LYS  42           HA       LYS  42 -11.436  -4.459   5.385
  321    HB2  LYS  42           1HB      LYS  42 -12.201  -2.219   4.816
  322    HB3  LYS  42           2HB      LYS  42 -11.451  -2.328   3.232
  323    HG2  LYS  42           1HG      LYS  42 -12.993  -4.138   2.644
  324    HG3  LYS  42           2HG      LYS  42 -13.750  -3.999   4.233
  325    HD2  LYS  42           1HD      LYS  42 -15.105  -2.794   2.674
  326    HD3  LYS  42           2HD      LYS  42 -14.274  -1.614   3.685
  327    HE2  LYS  42           1HE      LYS  42 -14.218  -0.881   1.386
  328    HE3  LYS  42           2HE      LYS  42 -12.589  -1.319   1.899
  329    HZ1  LYS  42           3HZ      LYS  42 -12.841  -3.437   0.772
  330    HZ2  LYS  42           1HZ      LYS  42 -13.102  -2.165  -0.314
  331    HZ3  LYS  42           2HZ      LYS  42 -14.413  -3.038   0.304
  332    H    PHE  43           H        PHE  43  -9.279  -3.726   2.664
  333    HA   PHE  43           HA       PHE  43 -10.140  -5.635   0.833
  334    HB2  PHE  43           1HB      PHE  43  -7.281  -4.750   1.336
  335    HB3  PHE  43           2HB      PHE  43  -7.849  -5.598  -0.110
  336    HD1  PHE  43           2HD      PHE  43 -10.507  -4.052  -0.268
  337    HD2  PHE  43           1HD      PHE  43  -6.463  -2.841   0.224
  338    HE1  PHE  43           2HE      PHE  43 -11.034  -1.890  -1.307
  339    HE2  PHE  43           1HE      PHE  43  -6.981  -0.675  -0.812
  340    HZ   PHE  43           HZ       PHE  43  -9.270  -0.198  -1.574
  341    H    SER  44           H        SER  44  -7.370  -6.065   3.125
  342    HA   SER  44           HA       SER  44  -7.282  -8.856   2.472
  343    HB2  SER  44           1HB      SER  44  -5.814  -7.471   4.712
  344    HB3  SER  44           2HB      SER  44  -5.412  -9.001   3.925
  345    HG   SER  44           HG       SER  44  -4.180  -7.732   2.762
  346    H    GLU  45           H        GLU  45  -9.040  -6.997   4.736
  347    HA   GLU  45           HA       GLU  45  -9.473  -8.963   6.715
  348    HB2  GLU  45           1HB      GLU  45 -10.186  -6.589   6.943
  349    HB3  GLU  45           2HB      GLU  45 -11.426  -6.870   5.729
  350    HG2  GLU  45           1HG      GLU  45 -12.498  -8.501   7.177
  351    HG3  GLU  45           2HG      GLU  45 -11.239  -8.267   8.389
  352    H    GLN  46           H        GLN  46 -10.756  -8.440   3.506
  353    HA   GLN  46           HA       GLN  46 -12.608 -10.648   3.747
  354    HB2  GLN  46           1HB      GLN  46 -11.858  -8.949   1.364
  355    HB3  GLN  46           2HB      GLN  46 -13.136 -10.157   1.383
  356    HG2  GLN  46           1HG      GLN  46 -13.042  -7.652   3.053
  357    HG3  GLN  46           2HG      GLN  46 -14.037  -7.913   1.621
  358   HE21  GLN  46          1HE2      GLN  46 -13.576  -8.698   4.974
  359   HE22  GLN  46          2HE2      GLN  46 -15.123  -9.422   5.229
  360    H    TYR  47           H        TYR  47  -9.550  -9.892   2.141
  361    HA   TYR  47           HA       TYR  47  -9.128 -12.766   1.801
  362    HB2  TYR  47           1HB      TYR  47  -7.905 -12.087  -0.380
  363    HB3  TYR  47           2HB      TYR  47  -9.656 -12.213  -0.363
  364    HD1  TYR  47           2HD      TYR  47  -6.860  -9.763  -0.248
  365    HD2  TYR  47           1HD      TYR  47 -11.016 -10.412  -0.884
  366    HE1  TYR  47           2HE      TYR  47  -7.080  -7.468  -1.128
  367    HE2  TYR  47           1HE      TYR  47 -11.248  -8.135  -1.743
  368    HH   TYR  47           HH       TYR  47  -8.625  -6.215  -2.615
  369    HA   PRO  48           HA       PRO  48  -5.491 -11.108   4.005
  370    HB2  PRO  48           1HB      PRO  48  -4.994 -13.326   5.426
  371    HB3  PRO  48           2HB      PRO  48  -6.227 -12.161   5.904
  372    HG2  PRO  48           1HG      PRO  48  -6.554 -14.761   4.451
  373    HG3  PRO  48           2HG      PRO  48  -7.512 -14.106   5.792
  374    HD2  PRO  48           1HD      PRO  48  -8.324 -13.958   3.213
  375    HD3  PRO  48           2HD      PRO  48  -8.725 -12.712   4.411
  376    H    GLN  49           H        GLN  49  -5.950 -13.327   1.591
  377    HA   GLN  49           HA       GLN  49  -3.515 -14.674   1.455
  378    HB2  GLN  49           1HB      GLN  49  -4.020 -14.894  -0.997
  379    HB3  GLN  49           2HB      GLN  49  -5.280 -15.459   0.089
  380    HG2  GLN  49           1HG      GLN  49  -6.513 -14.264  -1.367
  381    HG3  GLN  49           2HG      GLN  49  -6.119 -13.041  -0.167
  382   HE21  GLN  49          1HE2      GLN  49  -6.404 -11.355  -1.624
  383   HE22  GLN  49          2HE2      GLN  49  -5.271 -11.029  -2.886
  384    H    ALA  50           H        ALA  50  -4.320 -11.429   0.860
  385    HA   ALA  50           HA       ALA  50  -1.731 -10.891  -0.417
  386    HB1  ALA  50           1HB      ALA  50  -2.624  -8.626  -0.773
  387    HB2  ALA  50           2HB      ALA  50  -4.119  -9.095   0.038
  388    HB3  ALA  50           3HB      ALA  50  -3.665  -9.857  -1.488
  389    H    ASP  51           H        ASP  51  -0.354  -9.256   0.535
  390    HA   ASP  51           HA       ASP  51  -0.579  -9.359   3.431
  391    HB2  ASP  51           1HB      ASP  51   1.661  -9.199   1.594
  392    HB3  ASP  51           2HB      ASP  51   1.767  -7.991   2.865
  393    H    PHE  52           H        PHE  52  -0.546  -7.616   4.757
  394    HA   PHE  52           HA       PHE  52  -1.548  -5.164   3.494
  395    HB2  PHE  52           1HB      PHE  52  -2.548  -4.949   5.939
  396    HB3  PHE  52           2HB      PHE  52  -3.360  -5.893   4.699
  397    HD1  PHE  52           1HD      PHE  52  -0.927  -6.244   7.511
  398    HD2  PHE  52           2HD      PHE  52  -3.927  -8.090   5.129
  399    HE1  PHE  52           1HE      PHE  52  -0.878  -8.212   8.982
  400    HE2  PHE  52           2HE      PHE  52  -3.885 -10.060   6.598
  401    HZ   PHE  52           HZ       PHE  52  -2.358 -10.126   8.527
  402    H    TYR  53           H        TYR  53  -0.140  -3.501   3.596
  403    HA   TYR  53           HA       TYR  53   1.255  -3.068   6.138
  404    HB2  TYR  53           1HB      TYR  53   2.618  -3.212   3.442
  405    HB3  TYR  53           2HB      TYR  53   3.370  -2.547   4.887
  406    HD1  TYR  53           2HD      TYR  53   3.653  -4.085   6.896
  407    HD2  TYR  53           1HD      TYR  53   2.671  -5.515   3.014
  408    HE1  TYR  53           2HE      TYR  53   4.411  -6.332   7.539
  409    HE2  TYR  53           1HE      TYR  53   3.428  -7.770   3.642
  410    HH   TYR  53           HH       TYR  53   4.906  -8.824   5.263
  411    H    LYS  54           H        LYS  54   1.546  -1.027   6.716
  412    HA   LYS  54           HA       LYS  54   0.631   1.119   4.898
  413    HB2  LYS  54           1HB      LYS  54  -0.066   0.421   7.681
  414    HB3  LYS  54           2HB      LYS  54   0.102   2.132   7.342
  415    HG2  LYS  54           1HG      LYS  54  -1.614   1.807   5.535
  416    HG3  LYS  54           2HG      LYS  54  -1.848   0.175   6.153
  417    HD2  LYS  54           1HD      LYS  54  -2.254   2.749   7.675
  418    HD3  LYS  54           2HD      LYS  54  -3.520   1.676   7.079
  419    HE2  LYS  54           1HE      LYS  54  -2.824  -0.064   8.580
  420    HE3  LYS  54           2HE      LYS  54  -1.410   0.863   9.071
  421    HZ1  LYS  54           3HZ      LYS  54  -4.225   1.673   9.553
  422    HZ2  LYS  54           1HZ      LYS  54  -2.843   2.499  10.073
  423    HZ3  LYS  54           2HZ      LYS  54  -3.204   0.971  10.701
  424    H    LEU  55           H        LEU  55   1.710   3.147   5.107
  425    HA   LEU  55           HA       LEU  55   3.526   3.609   7.279
  426    HB2  LEU  55           1HB      LEU  55   4.965   2.300   5.829
  427    HB3  LEU  55           2HB      LEU  55   4.575   3.319   4.462
  428    HG   LEU  55           HG       LEU  55   5.873   4.570   6.848
  429   HD11  LEU  55          1HD1      LEU  55   7.250   2.628   6.496
  430   HD12  LEU  55          2HD1      LEU  55   8.080   4.039   5.837
  431   HD13  LEU  55          3HD1      LEU  55   7.268   2.906   4.756
  432   HD21  LEU  55          3HD2      LEU  55   6.418   6.219   5.386
  433   HD22  LEU  55          1HD2      LEU  55   4.977   5.606   4.582
  434   HD23  LEU  55          2HD2      LEU  55   6.579   5.114   4.020
  435    H    ASP  56           H        ASP  56   3.872   5.820   7.599
  436    HA   ASP  56           HA       ASP  56   2.521   7.586   5.713
  437    HB2  ASP  56           1HB      ASP  56   2.667   9.275   7.480
  438    HB3  ASP  56           2HB      ASP  56   1.787   7.853   8.007
  439    H    VAL  57           H        VAL  57   3.558   8.945   4.463
  440    HA   VAL  57           HA       VAL  57   6.390   8.841   4.231
  441    HB   VAL  57           HB       VAL  57   5.078   9.048   2.246
  442   HG11  VAL  57          1HG1      VAL  57   4.090  11.618   3.422
  443   HG12  VAL  57          2HG1      VAL  57   3.175  10.127   3.242
  444   HG13  VAL  57          3HG1      VAL  57   3.708  11.011   1.812
  445   HG21  VAL  57          3HG2      VAL  57   7.225  10.106   2.058
  446   HG22  VAL  57          1HG2      VAL  57   6.613  11.585   2.797
  447   HG23  VAL  57          2HG2      VAL  57   6.038  11.091   1.205
  448    H    ASP  58           H        ASP  58   4.227  10.740   6.022
  449    HA   ASP  58           HA       ASP  58   5.601  13.154   6.299
  450    HB2  ASP  58           1HB      ASP  58   3.369  12.927   7.192
  451    HB3  ASP  58           2HB      ASP  58   3.886  11.644   8.282
  452    H    GLU  59           H        GLU  59   5.903  10.107   8.092
  453    HA   GLU  59           HA       GLU  59   8.251  11.107   9.475
  454    HB2  GLU  59           1HB      GLU  59   6.571   9.620  10.585
  455    HB3  GLU  59           2HB      GLU  59   7.076   8.325   9.509
  456    HG2  GLU  59           1HG      GLU  59   8.138   8.093  11.662
  457    HG3  GLU  59           2HG      GLU  59   9.342   8.462  10.427
  458    H    LEU  60           H        LEU  60   7.453   8.728   6.942
  459    HA   LEU  60           HA       LEU  60  10.363   8.388   6.541
  460    HB2  LEU  60           1HB      LEU  60   8.096   6.496   6.008
  461    HB3  LEU  60           2HB      LEU  60   9.677   6.267   5.305
  462    HG   LEU  60           HG       LEU  60   9.648   4.859   7.166
  463   HD11  LEU  60          1HD1      LEU  60  11.285   5.765   8.696
  464   HD12  LEU  60          2HD1      LEU  60  10.946   7.397   8.128
  465   HD13  LEU  60          3HD1      LEU  60  11.675   6.219   7.036
  466   HD21  LEU  60          3HD2      LEU  60   7.622   5.713   8.213
  467   HD22  LEU  60          1HD2      LEU  60   8.511   7.118   8.799
  468   HD23  LEU  60          2HD2      LEU  60   8.916   5.509   9.393
  469    H    GLY  61           H        GLY  61  10.311  10.369   5.301
  470    HA2  GLY  61           1HA      GLY  61   8.876  10.602   2.869
  471    HA3  GLY  61           2HA      GLY  61  10.286  11.542   3.329
  472    H    ASP  62           H        ASP  62  12.206   9.609   3.573
  473    HA   ASP  62           HA       ASP  62  13.042   9.310   0.909
  474    HB2  ASP  62           1HB      ASP  62  14.029   7.943   3.411
  475    HB3  ASP  62           2HB      ASP  62  14.848   7.865   1.858
  476    H    VAL  63           H        VAL  63  11.323   7.198   3.033
  477    HA   VAL  63           HA       VAL  63  11.628   4.819   1.543
  478    HB   VAL  63           HB       VAL  63   9.399   5.662   3.390
  479   HG11  VAL  63          1HG1      VAL  63   8.605   3.925   1.909
  480   HG12  VAL  63          2HG1      VAL  63   8.881   3.241   3.510
  481   HG13  VAL  63          3HG1      VAL  63  10.045   2.959   2.217
  482   HG21  VAL  63          3HG2      VAL  63  11.676   5.485   4.392
  483   HG22  VAL  63          1HG2      VAL  63  11.716   3.794   3.884
  484   HG23  VAL  63          2HG2      VAL  63  10.517   4.334   5.059
  485    H    ALA  64           H        ALA  64   8.936   7.175   1.660
  486    HA   ALA  64           HA       ALA  64   7.404   6.046  -0.369
  487    HB1  ALA  64           1HB      ALA  64   6.591   7.794   1.132
  488    HB2  ALA  64           2HB      ALA  64   6.340   8.229  -0.560
  489    HB3  ALA  64           3HB      ALA  64   7.659   8.960   0.353
  490    H    GLN  65           H        GLN  65  10.147   8.243  -0.530
  491    HA   GLN  65           HA       GLN  65   9.905   8.822  -3.310
  492    HB2  GLN  65           1HB      GLN  65  12.307   8.940  -1.472
  493    HB3  GLN  65           2HB      GLN  65  12.273   9.584  -3.108
  494    HG2  GLN  65           1HG      GLN  65  10.578  11.180  -2.495
  495    HG3  GLN  65           2HG      GLN  65  10.457  10.479  -0.882
  496   HE21  GLN  65          1HE2      GLN  65  12.399  12.401  -3.035
  497   HE22  GLN  65          2HE2      GLN  65  13.434  13.069  -1.822
  498    H    LYS  66           H        LYS  66  11.396   6.277  -1.476
  499    HA   LYS  66           HA       LYS  66  12.848   5.053  -3.535
  500    HB2  LYS  66           1HB      LYS  66  13.541   4.025  -1.655
  501    HB3  LYS  66           2HB      LYS  66  12.120   4.567  -0.774
  502    HG2  LYS  66           1HG      LYS  66  11.930   2.310  -0.575
  503    HG3  LYS  66           2HG      LYS  66  10.944   2.617  -1.998
  504    HD2  LYS  66           1HD      LYS  66  12.347   0.684  -2.376
  505    HD3  LYS  66           2HD      LYS  66  12.860   2.005  -3.427
  506    HE2  LYS  66           1HE      LYS  66  14.765   2.439  -2.119
  507    HE3  LYS  66           2HE      LYS  66  14.157   1.481  -0.769
  508    HZ1  LYS  66           3HZ      LYS  66  14.955   0.392  -3.412
  509    HZ2  LYS  66           1HZ      LYS  66  14.416  -0.508  -2.081
  510    HZ3  LYS  66           2HZ      LYS  66  15.891   0.326  -2.006
  511    H    ASN  67           H        ASN  67   9.492   5.265  -2.889
  512    HA   ASN  67           HA       ASN  67   8.884   2.744  -4.282
  513    HB2  ASN  67           1HB      ASN  67   7.099   4.466  -2.591
  514    HB3  ASN  67           2HB      ASN  67   6.751   2.846  -3.166
  515   HD21  ASN  67          1HD2      ASN  67   7.121   4.284  -0.556
  516   HD22  ASN  67          2HD2      ASN  67   8.089   3.218   0.362
  517    H    GLU  68           H        GLU  68   8.848   6.092  -4.639
  518    HA   GLU  68           HA       GLU  68   8.192   7.399  -6.375
  519    HB2  GLU  68           1HB      GLU  68   8.330   5.376  -7.813
  520    HB3  GLU  68           2HB      GLU  68   6.653   5.013  -7.414
  521    HG2  GLU  68           1HG      GLU  68   6.107   7.294  -8.409
  522    HG3  GLU  68           2HG      GLU  68   7.749   7.283  -9.054
  523    H    VAL  69           H        VAL  69   6.666   6.716  -3.824
  524    HA   VAL  69           HA       VAL  69   4.074   7.816  -4.649
  525    HB   VAL  69           HB       VAL  69   3.425   6.137  -3.246
  526   HG11  VAL  69          1HG1      VAL  69   4.636   5.508  -1.122
  527   HG12  VAL  69          2HG1      VAL  69   5.961   6.538  -1.674
  528   HG13  VAL  69          3HG1      VAL  69   5.458   5.146  -2.634
  529   HG21  VAL  69          3HG2      VAL  69   2.834   7.013  -1.046
  530   HG22  VAL  69          1HG2      VAL  69   2.556   8.207  -2.313
  531   HG23  VAL  69          2HG2      VAL  69   3.970   8.343  -1.269
  532    H    SER  70           H        SER  70   3.677   9.900  -4.421
  533    HA   SER  70           HA       SER  70   5.279  11.436  -2.491
  534    HB2  SER  70           1HB      SER  70   4.617  12.373  -5.288
  535    HB3  SER  70           2HB      SER  70   5.636  13.193  -4.106
  536    HG   SER  70           HG       SER  70   6.650  10.806  -4.334
  537    H    ALA  71           H        ALA  71   2.252  10.963  -4.134
  538    HA   ALA  71           HA       ALA  71   1.046  13.229  -2.725
  539    HB1  ALA  71           1HB      ALA  71  -0.920  12.808  -4.126
  540    HB2  ALA  71           2HB      ALA  71  -0.113  11.412  -4.841
  541    HB3  ALA  71           3HB      ALA  71   0.529  13.033  -5.104
  542    H    MET  72           H        MET  72  -1.046  12.826  -1.595
  543    HA   MET  72           HA       MET  72  -1.082  10.127  -0.434
  544    HB2  MET  72           1HB      MET  72  -1.522  12.657   1.157
  545    HB3  MET  72           2HB      MET  72  -1.441  11.015   1.776
  546    HG2  MET  72           1HG      MET  72   0.626  11.807   2.327
  547    HG3  MET  72           2HG      MET  72   0.957  11.046   0.772
  548    HE1  MET  72           3HE      MET  72   3.261  12.496   0.485
  549    HE2  MET  72           1HE      MET  72   2.893  13.038   2.124
  550    HE3  MET  72           2HE      MET  72   3.303  14.215   0.877
  551    HA   PRO  73           HA       PRO  73  -2.037   8.908   0.655
  552    HB2  PRO  73           1HB      PRO  73  -4.343   7.169   0.277
  553    HB3  PRO  73           2HB      PRO  73  -3.530   7.626   1.777
  554    HG2  PRO  73           1HG      PRO  73  -6.029   8.484   1.240
  555    HG3  PRO  73           2HG      PRO  73  -4.842   9.514   2.073
  556    HD2  PRO  73           1HD      PRO  73  -5.531   9.500  -0.865
  557    HD3  PRO  73           2HD      PRO  73  -5.476  10.882   0.259
  558    H    THR  74           H        THR  74  -1.407   6.767  -0.213
  559    HA   THR  74           HA       THR  74  -1.982   6.359  -3.055
  560    HB   THR  74           HB       THR  74   0.758   6.861  -1.895
  561    HG1  THR  74           1HG      THR  74   0.090   8.712  -2.771
  562   HG21  THR  74          3HG2      THR  74   1.128   4.878  -3.123
  563   HG22  THR  74          1HG2      THR  74   1.613   6.191  -4.193
  564   HG23  THR  74          2HG2      THR  74   0.057   5.385  -4.435
  565    H    LEU  75           H        LEU  75  -2.044   4.308  -3.642
  566    HA   LEU  75           HA       LEU  75  -1.215   2.264  -1.686
  567    HB2  LEU  75           1HB      LEU  75  -3.236   2.071  -3.915
  568    HB3  LEU  75           2HB      LEU  75  -2.841   0.799  -2.776
  569    HG   LEU  75           HG       LEU  75  -3.626   2.683  -1.045
  570   HD11  LEU  75          1HD1      LEU  75  -5.517   3.917  -1.873
  571   HD12  LEU  75          2HD1      LEU  75  -5.348   3.194  -3.470
  572   HD13  LEU  75          3HD1      LEU  75  -4.112   4.302  -2.868
  573   HD21  LEU  75          3HD2      LEU  75  -5.848   1.568  -1.134
  574   HD22  LEU  75          1HD2      LEU  75  -4.471   0.465  -1.090
  575   HD23  LEU  75          2HD2      LEU  75  -5.318   0.760  -2.609
  576    H    LEU  76           H        LEU  76   0.249   0.755  -2.356
  577    HA   LEU  76           HA       LEU  76   0.861   0.653  -5.228
  578    HB2  LEU  76           1HB      LEU  76   2.635   1.303  -3.002
  579    HB3  LEU  76           2HB      LEU  76   3.244   0.003  -4.008
  580    HG   LEU  76           HG       LEU  76   2.400   2.706  -5.058
  581   HD11  LEU  76          1HD1      LEU  76   4.355   2.935  -3.628
  582   HD12  LEU  76          2HD1      LEU  76   4.798   3.155  -5.329
  583   HD13  LEU  76          3HD1      LEU  76   5.164   1.635  -4.504
  584   HD21  LEU  76          3HD2      LEU  76   3.900   0.438  -6.363
  585   HD22  LEU  76          1HD2      LEU  76   3.519   1.994  -7.098
  586   HD23  LEU  76          2HD2      LEU  76   2.222   0.875  -6.677
  587    H    LEU  77           H        LEU  77   0.400  -1.243  -5.996
  588    HA   LEU  77           HA       LEU  77   0.482  -3.605  -4.246
  589    HB2  LEU  77           1HB      LEU  77  -0.784  -3.048  -6.926
  590    HB3  LEU  77           2HB      LEU  77  -0.636  -4.667  -6.290
  591    HG   LEU  77           HG       LEU  77  -2.327  -4.371  -4.744
  592   HD11  LEU  77          1HD1      LEU  77  -1.963  -1.376  -4.918
  593   HD12  LEU  77          2HD1      LEU  77  -1.396  -2.400  -3.600
  594   HD13  LEU  77          3HD1      LEU  77  -3.124  -2.228  -3.900
  595   HD21  LEU  77          3HD2      LEU  77  -4.150  -3.332  -5.899
  596   HD22  LEU  77          1HD2      LEU  77  -3.109  -4.164  -7.060
  597   HD23  LEU  77          2HD2      LEU  77  -3.035  -2.402  -6.900
  598    H    PHE  78           H        PHE  78   2.064  -5.077  -4.493
  599    HA   PHE  78           HA       PHE  78   3.587  -5.065  -7.011
  600    HB2  PHE  78           1HB      PHE  78   4.645  -5.060  -4.200
  601    HB3  PHE  78           2HB      PHE  78   5.587  -5.718  -5.530
  602    HD1  PHE  78           1HD      PHE  78   4.023  -2.631  -4.221
  603    HD2  PHE  78           2HD      PHE  78   6.745  -4.320  -7.018
  604    HE1  PHE  78           1HE      PHE  78   4.896  -0.390  -4.734
  605    HE2  PHE  78           2HE      PHE  78   7.613  -2.081  -7.537
  606    HZ   PHE  78           HZ       PHE  78   6.688  -0.109  -6.392
  607    H    LYS  79           H        LYS  79   4.433  -7.066  -7.687
  608    HA   LYS  79           HA       LYS  79   3.729  -9.403  -6.012
  609    HB2  LYS  79           1HB      LYS  79   2.126  -9.008  -7.947
  610    HB3  LYS  79           2HB      LYS  79   3.481  -9.300  -9.023
  611    HG2  LYS  79           1HG      LYS  79   3.705 -11.567  -8.080
  612    HG3  LYS  79           2HG      LYS  79   2.277 -11.263  -7.084
  613    HD2  LYS  79           1HD      LYS  79   0.920 -10.942  -9.061
  614    HD3  LYS  79           2HD      LYS  79   2.336 -11.102 -10.096
  615    HE2  LYS  79           1HE      LYS  79   1.168 -13.168 -10.176
  616    HE3  LYS  79           2HE      LYS  79   2.614 -13.424  -9.204
  617    HZ1  LYS  79           3HZ      LYS  79  -0.143 -13.009  -8.169
  618    HZ2  LYS  79           1HZ      LYS  79   1.240 -13.191  -7.209
  619    HZ3  LYS  79           2HZ      LYS  79   0.717 -14.467  -8.184
  620    H    ASN  80           H        ASN  80   5.487 -10.581  -5.619
  621    HA   ASN  80           HA       ASN  80   7.654 -11.246  -5.574
  622    HB2  ASN  80           1HB      ASN  80   8.433 -12.373  -7.665
  623    HB3  ASN  80           2HB      ASN  80   6.869 -12.912  -7.072
  624   HD21  ASN  80          1HD2      ASN  80   5.094 -12.632  -8.351
  625   HD22  ASN  80          2HD2      ASN  80   5.167 -12.033  -9.972
  626    H    GLY  81           H        GLY  81   7.805  -8.569  -5.563
  627    HA2  GLY  81           1HA      GLY  81   9.680  -7.179  -5.565
  628    HA3  GLY  81           2HA      GLY  81  10.465  -8.290  -6.682
  629    H    LYS  82           H        LYS  82   7.599  -7.786  -8.118
  630    HA   LYS  82           HA       LYS  82   8.488  -5.305  -9.417
  631    HB2  LYS  82           1HB      LYS  82   7.505  -6.126 -11.505
  632    HB3  LYS  82           2HB      LYS  82   8.761  -7.208 -10.926
  633    HG2  LYS  82           1HG      LYS  82   7.181  -8.821 -10.200
  634    HG3  LYS  82           2HG      LYS  82   5.837  -7.697 -10.447
  635    HD2  LYS  82           1HD      LYS  82   7.624  -8.706 -12.656
  636    HD3  LYS  82           2HD      LYS  82   6.075  -9.432 -12.231
  637    HE2  LYS  82           1HE      LYS  82   6.484  -6.575 -13.117
  638    HE3  LYS  82           2HE      LYS  82   5.902  -7.885 -14.140
  639    HZ1  LYS  82           3HZ      LYS  82   4.536  -6.904 -11.687
  640    HZ2  LYS  82           1HZ      LYS  82   3.971  -8.107 -12.737
  641    HZ3  LYS  82           2HZ      LYS  82   4.099  -6.508 -13.270
  642    H    GLU  83           H        GLU  83   6.642  -4.028 -10.308
  643    HA   GLU  83           HA       GLU  83   4.633  -3.722  -8.345
  644    HB2  GLU  83           1HB      GLU  83   5.606  -1.991  -9.993
  645    HB3  GLU  83           2HB      GLU  83   4.470  -2.646 -11.157
  646    HG2  GLU  83           1HG      GLU  83   2.602  -1.973  -9.821
  647    HG3  GLU  83           2HG      GLU  83   3.670  -1.506  -8.492
  648    H    VAL  84           H        VAL  84   2.245  -3.626  -9.083
  649    HA   VAL  84           HA       VAL  84   1.561  -5.196 -11.401
  650    HB   VAL  84           HB       VAL  84  -0.384  -6.233  -9.998
  651   HG11  VAL  84          1HG1      VAL  84   1.307  -7.495 -11.270
  652   HG12  VAL  84          2HG1      VAL  84   0.869  -8.286  -9.756
  653   HG13  VAL  84          3HG1      VAL  84   2.392  -7.402  -9.878
  654   HG21  VAL  84          3HG2      VAL  84   0.346  -6.906  -7.765
  655   HG22  VAL  84          1HG2      VAL  84   0.203  -5.157  -7.920
  656   HG23  VAL  84          2HG2      VAL  84   1.792  -5.915  -7.955
  657    H    ALA  85           H        ALA  85   0.839  -2.886  -8.925
  658    HA   ALA  85           HA       ALA  85  -0.693  -1.339 -10.703
  659    HB1  ALA  85           1HB      ALA  85  -2.479  -2.875 -10.290
  660    HB2  ALA  85           2HB      ALA  85  -2.842  -1.365  -9.452
  661    HB3  ALA  85           3HB      ALA  85  -2.234  -2.753  -8.553
  662    H    LYS  86           H        LYS  86  -1.391   0.673  -9.813
  663    HA   LYS  86           HA       LYS  86  -0.444   1.351  -7.144
  664    HB2  LYS  86           1HB      LYS  86   1.509   1.729  -8.558
  665    HB3  LYS  86           2HB      LYS  86   0.552   2.717  -9.653
  666    HG2  LYS  86           1HG      LYS  86   0.149   4.272  -7.710
  667    HG3  LYS  86           2HG      LYS  86   1.367   3.347  -6.830
  668    HD2  LYS  86           1HD      LYS  86   2.984   3.829  -8.641
  669    HD3  LYS  86           2HD      LYS  86   1.766   4.836  -9.425
  670    HE2  LYS  86           1HE      LYS  86   1.680   6.187  -7.305
  671    HE3  LYS  86           2HE      LYS  86   3.080   5.272  -6.749
  672    HZ1  LYS  86           3HZ      LYS  86   2.924   7.067  -9.104
  673    HZ2  LYS  86           1HZ      LYS  86   4.236   6.038  -8.805
  674    HZ3  LYS  86           2HZ      LYS  86   3.862   7.278  -7.713
  675    H    VAL  87           H        VAL  87  -1.700   2.916  -6.213
  676    HA   VAL  87           HA       VAL  87  -3.648   4.298  -7.946
  677    HB   VAL  87           HB       VAL  87  -4.450   3.133  -5.283
  678   HG11  VAL  87          1HG1      VAL  87  -5.838   4.932  -6.084
  679   HG12  VAL  87          2HG1      VAL  87  -6.723   3.411  -6.201
  680   HG13  VAL  87          3HG1      VAL  87  -6.024   4.136  -7.647
  681   HG21  VAL  87          3HG2      VAL  87  -5.548   1.291  -6.455
  682   HG22  VAL  87          1HG2      VAL  87  -3.801   1.251  -6.697
  683   HG23  VAL  87          2HG2      VAL  87  -4.856   1.843  -7.979
  684    H    VAL  88           H        VAL  88  -4.230   6.343  -7.241
  685    HA   VAL  88           HA       VAL  88  -2.778   7.302  -4.866
  686    HB   VAL  88           HB       VAL  88  -1.840   8.203  -6.937
  687   HG11  VAL  88          1HG1      VAL  88  -4.566   9.370  -7.441
  688   HG12  VAL  88          2HG1      VAL  88  -3.794   8.075  -8.357
  689   HG13  VAL  88          3HG1      VAL  88  -3.109   9.702  -8.379
  690   HG21  VAL  88          3HG2      VAL  88  -1.745   9.594  -4.953
  691   HG22  VAL  88          1HG2      VAL  88  -3.317  10.289  -5.343
  692   HG23  VAL  88          2HG2      VAL  88  -1.935  10.588  -6.397
  693    H    GLY  89           H        GLY  89  -5.159   6.193  -4.390
  694    HA2  GLY  89           1HA      GLY  89  -6.609   8.070  -3.024
  695    HA3  GLY  89           2HA      GLY  89  -7.348   8.003  -4.617
  696    H    ALA  90           H        ALA  90  -7.861   7.015  -1.679
  697    HA   ALA  90           HA       ALA  90  -8.244   4.265  -1.729
  698    HB1  ALA  90           1HB      ALA  90  -8.309   5.828   0.225
  699    HB2  ALA  90           2HB      ALA  90  -9.558   4.577   0.203
  700    HB3  ALA  90           3HB      ALA  90  -9.954   6.236  -0.258
  701    H    ASN  91           H        ASN  91  -9.385   3.211  -3.203
  702    HA   ASN  91           HA       ASN  91 -12.096   4.176  -3.760
  703    HB2  ASN  91           1HB      ASN  91 -10.030   3.602  -5.567
  704    HB3  ASN  91           2HB      ASN  91 -11.164   2.257  -5.690
  705   HD21  ASN  91          1HD2      ASN  91 -12.160   5.450  -4.739
  706   HD22  ASN  91          2HD2      ASN  91 -13.054   5.812  -6.173
  707    HA   PRO  92           HA       PRO  92 -12.840   0.867  -0.720
  708    HB2  PRO  92           1HB      PRO  92 -15.465   1.438  -2.045
  709    HB3  PRO  92           2HB      PRO  92 -15.113   1.128  -0.340
  710    HG2  PRO  92           1HG      PRO  92 -15.423   3.625  -1.336
  711    HG3  PRO  92           2HG      PRO  92 -14.362   3.255   0.029
  712    HD2  PRO  92           1HD      PRO  92 -13.652   4.133  -2.646
  713    HD3  PRO  92           2HD      PRO  92 -12.617   3.979  -1.221
  714    H    ALA  93           H        ALA  93 -14.826   0.655  -3.676
  715    HA   ALA  93           HA       ALA  93 -14.657  -2.228  -3.516
  716    HB1  ALA  93           1HB      ALA  93 -16.363  -2.250  -5.232
  717    HB2  ALA  93           2HB      ALA  93 -16.180  -0.512  -5.465
  718    HB3  ALA  93           3HB      ALA  93 -16.811  -1.136  -3.941
  719    H    ALA  94           H        ALA  94 -13.727   0.308  -5.795
  720    HA   ALA  94           HA       ALA  94 -13.003  -1.405  -7.906
  721    HB1  ALA  94           1HB      ALA  94 -11.921   1.348  -7.331
  722    HB2  ALA  94           2HB      ALA  94 -13.430   1.004  -8.171
  723    HB3  ALA  94           3HB      ALA  94 -11.894   0.508  -8.880
  724    H    ILE  95           H        ILE  95 -11.197  -0.378  -5.067
  725    HA   ILE  95           HA       ILE  95  -8.742  -1.390  -6.242
  726    HB   ILE  95           HB       ILE  95  -9.189  -0.344  -3.451
  727   HG12  ILE  95          1HG1      ILE  95  -7.971   0.918  -5.915
  728   HG13  ILE  95          2HG1      ILE  95  -9.468   1.400  -5.122
  729   HG21  ILE  95          1HG2      ILE  95  -6.765  -0.308  -3.279
  730   HG22  ILE  95          2HG2      ILE  95  -6.620  -0.973  -4.905
  731   HG23  ILE  95          3HG2      ILE  95  -7.326  -1.945  -3.614
  732   HD11  ILE  95          3HD1      ILE  95  -6.678   1.637  -4.034
  733   HD12  ILE  95          1HD1      ILE  95  -8.141   1.978  -3.109
  734   HD13  ILE  95          2HD1      ILE  95  -7.752   2.945  -4.530
  735    H    LYS  96           H        LYS  96 -11.154  -2.406  -3.867
  736    HA   LYS  96           HA       LYS  96  -9.866  -4.770  -3.066
  737    HB2  LYS  96           1HB      LYS  96 -11.765  -4.415  -1.812
  738    HB3  LYS  96           2HB      LYS  96 -12.724  -3.898  -3.206
  739    HG2  LYS  96           1HG      LYS  96 -12.823  -6.244  -3.957
  740    HG3  LYS  96           2HG      LYS  96 -11.914  -6.713  -2.527
  741    HD2  LYS  96           1HD      LYS  96 -14.142  -7.128  -1.954
  742    HD3  LYS  96           2HD      LYS  96 -13.773  -5.582  -1.191
  743    HE2  LYS  96           1HE      LYS  96 -15.927  -5.418  -2.225
  744    HE3  LYS  96           2HE      LYS  96 -14.790  -4.440  -3.150
  745    HZ1  LYS  96           3HZ      LYS  96 -14.610  -6.243  -4.759
  746    HZ2  LYS  96           1HZ      LYS  96 -16.215  -5.733  -4.601
  747    HZ3  LYS  96           2HZ      LYS  96 -15.709  -7.170  -3.870
  748    H    GLN  97           H        GLN  97 -11.825  -3.975  -5.865
  749    HA   GLN  97           HA       GLN  97 -11.715  -6.481  -7.144
  750    HB2  GLN  97           1HB      GLN  97 -13.246  -4.596  -7.737
  751    HB3  GLN  97           2HB      GLN  97 -11.876  -3.711  -8.380
  752    HG2  GLN  97           1HG      GLN  97 -12.594  -6.416  -9.442
  753    HG3  GLN  97           2HG      GLN  97 -13.440  -4.972  -9.989
  754   HE21  GLN  97          1HE2      GLN  97 -11.753  -6.808 -11.476
  755   HE22  GLN  97          2HE2      GLN  97 -10.473  -5.856 -12.143
  756    H    ALA  98           H        ALA  98  -9.473  -3.788  -6.957
  757    HA   ALA  98           HA       ALA  98  -7.736  -4.615  -9.031
  758    HB1  ALA  98           1HB      ALA  98  -7.697  -2.345  -8.129
  759    HB2  ALA  98           2HB      ALA  98  -6.115  -3.113  -8.037
  760    HB3  ALA  98           3HB      ALA  98  -7.111  -2.970  -6.588
  761    H    ILE  99           H        ILE  99  -7.426  -4.882  -5.500
  762    HA   ILE  99           HA       ILE  99  -5.104  -6.357  -5.393
  763    HB   ILE  99           HB       ILE  99  -7.350  -6.952  -3.465
  764   HG12  ILE  99          1HG1      ILE  99  -7.501  -4.603  -3.549
  765   HG13  ILE  99          2HG1      ILE  99  -6.463  -4.945  -2.164
  766   HG21  ILE  99          1HG2      ILE  99  -5.363  -8.211  -3.107
  767   HG22  ILE  99          2HG2      ILE  99  -5.411  -6.950  -1.873
  768   HG23  ILE  99          3HG2      ILE  99  -4.353  -6.776  -3.271
  769   HD11  ILE  99          3HD1      ILE  99  -5.541  -3.124  -3.360
  770   HD12  ILE  99          1HD1      ILE  99  -5.657  -4.006  -4.888
  771   HD13  ILE  99          2HD1      ILE  99  -4.512  -4.530  -3.644
  772    H    ALA 100           H        ALA 100  -8.362  -7.417  -6.126
  773    HA   ALA 100           HA       ALA 100  -7.750 -10.230  -5.907
  774    HB1  ALA 100           1HB      ALA 100 -10.024 -10.558  -6.742
  775    HB2  ALA 100           2HB      ALA 100 -10.157  -8.828  -7.055
  776    HB3  ALA 100           3HB      ALA 100  -9.983  -9.415  -5.401
  777    H    ALA 101           H        ALA 101  -7.440  -7.815  -8.347
  778    HA   ALA 101           HA       ALA 101  -7.544  -9.714 -10.550
  779    HB1  ALA 101           1HB      ALA 101  -8.551  -7.479 -10.804
  780    HB2  ALA 101           2HB      ALA 101  -7.259  -7.765 -11.971
  781    HB3  ALA 101           3HB      ALA 101  -6.960  -6.751 -10.556
  782    H    ASN 102           H        ASN 102  -5.277  -7.900  -8.628
  783    HA   ASN 102           HA       ASN 102  -3.069  -8.637 -10.372
  784    HB2  ASN 102           1HB      ASN 102  -1.762  -7.271  -8.543
  785    HB3  ASN 102           2HB      ASN 102  -2.723  -6.475  -9.748
  786   HD21  ASN 102          1HD2      ASN 102  -4.317  -5.163  -9.174
  787   HD22  ASN 102          2HD2      ASN 102  -4.775  -4.891  -7.538
  788    H    ALA 103           H        ALA 103  -4.615  -9.897  -7.667
  789    HA   ALA 103           HA       ALA 103  -2.405 -11.103  -6.362
  790    HB1  ALA 103           1HB      ALA 103  -4.572 -10.815  -5.260
  791    HB2  ALA 103           2HB      ALA 103  -4.054 -12.500  -5.241
  792    HB3  ALA 103           3HB      ALA 103  -5.292 -11.972  -6.380
  Start of MODEL    4
    1    H1   MET   1           1H       MET   1  -4.897  -7.060  11.078
    2    H2   MET   1           2H       MET   1  -6.019  -6.329  10.052
    3    H3   MET   1           3H       MET   1  -6.196  -6.191  11.726
    4    HA   MET   1           HA       MET   1  -5.343  -4.152  10.772
    5    HB2  MET   1           1HB      MET   1  -3.570  -3.800  12.284
    6    HB3  MET   1           2HB      MET   1  -4.663  -4.930  13.060
    7    HG2  MET   1           1HG      MET   1  -3.208  -6.746  12.689
    8    HG3  MET   1           2HG      MET   1  -2.212  -5.813  11.572
    9    HE1  MET   1           3HE      MET   1  -0.665  -3.146  14.015
   10    HE2  MET   1           1HE      MET   1  -2.226  -3.017  13.200
   11    HE3  MET   1           2HE      MET   1  -0.831  -3.660  12.335
   12    H    VAL   2           H        VAL   2  -3.601  -3.058   9.756
   13    HA   VAL   2           HA       VAL   2  -2.225  -4.723   7.770
   14    HB   VAL   2           HB       VAL   2  -3.006  -1.807   7.794
   15   HG11  VAL   2          1HG1      VAL   2  -1.408  -3.280   5.706
   16   HG12  VAL   2          2HG1      VAL   2  -0.794  -2.022   6.776
   17   HG13  VAL   2          3HG1      VAL   2  -2.020  -1.633   5.569
   18   HG21  VAL   2          3HG2      VAL   2  -3.793  -4.110   6.024
   19   HG22  VAL   2          1HG2      VAL   2  -4.338  -2.445   5.850
   20   HG23  VAL   2          2HG2      VAL   2  -4.785  -3.372   7.281
   21    H    THR   3           H        THR   3  -0.064  -4.839   7.720
   22    HA   THR   3           HA       THR   3   1.289  -4.348  10.146
   23    HB   THR   3           HB       THR   3   2.620  -5.089   7.548
   24    HG1  THR   3           1HG      THR   3   1.239  -6.701   7.544
   25   HG21  THR   3          3HG2      THR   3   3.164  -5.862  10.419
   26   HG22  THR   3          1HG2      THR   3   4.096  -4.705   9.469
   27   HG23  THR   3          2HG2      THR   3   4.078  -6.409   9.012
   28    H    GLN   4           H        GLN   4   3.018  -3.065  10.656
   29    HA   GLN   4           HA       GLN   4   3.073  -0.501   9.242
   30    HB2  GLN   4           1HB      GLN   4   2.530  -0.692  11.677
   31    HB3  GLN   4           2HB      GLN   4   4.175  -1.242  11.959
   32    HG2  GLN   4           1HG      GLN   4   3.910   1.112  12.497
   33    HG3  GLN   4           2HG      GLN   4   5.027   0.891  11.147
   34   HE21  GLN   4          1HE2      GLN   4   4.470   1.593   9.140
   35   HE22  GLN   4          2HE2      GLN   4   3.064   2.540   8.822
   36    H    PHE   5           H        PHE   5   4.723  -0.042   7.919
   37    HA   PHE   5           HA       PHE   5   7.311  -1.360   8.127
   38    HB2  PHE   5           1HB      PHE   5   6.269   0.868   6.378
   39    HB3  PHE   5           2HB      PHE   5   7.942   0.346   6.348
   40    HD1  PHE   5           1HD      PHE   5   7.174  -2.676   6.684
   41    HD2  PHE   5           2HD      PHE   5   5.897   0.446   4.091
   42    HE1  PHE   5           1HE      PHE   5   6.650  -4.331   4.946
   43    HE2  PHE   5           2HE      PHE   5   5.364  -1.206   2.353
   44    HZ   PHE   5           HZ       PHE   5   5.745  -3.598   2.778
   45    H    LYS   6           H        LYS   6   9.280  -0.230   8.521
   46    HA   LYS   6           HA       LYS   6   9.026   2.484   9.643
   47    HB2  LYS   6           1HB      LYS   6  11.101   0.459  10.486
   48    HB3  LYS   6           2HB      LYS   6  10.776   2.022  11.218
   49    HG2  LYS   6           1HG      LYS   6   8.625   1.231  12.000
   50    HG3  LYS   6           2HG      LYS   6   8.909  -0.322  11.207
   51    HD2  LYS   6           1HD      LYS   6  10.736  -0.815  12.661
   52    HD3  LYS   6           2HD      LYS   6  10.727   0.820  13.324
   53    HE2  LYS   6           1HE      LYS   6   8.463  -1.148  13.609
   54    HE3  LYS   6           2HE      LYS   6   9.717  -0.892  14.821
   55    HZ1  LYS   6           3HZ      LYS   6   7.822   1.173  13.839
   56    HZ2  LYS   6           1HZ      LYS   6   9.018   1.409  15.010
   57    HZ3  LYS   6           2HZ      LYS   6   7.720   0.372  15.324
   58    H    THR   7           H        THR   7  10.689   0.225   7.631
   59    HA   THR   7           HA       THR   7  12.489   2.386   6.711
   60    HB   THR   7           HB       THR   7  14.163   0.562   6.204
   61    HG1  THR   7           1HG      THR   7  12.438  -0.930   7.931
   62   HG21  THR   7          3HG2      THR   7  13.411   0.986   9.100
   63   HG22  THR   7          1HG2      THR   7  14.444   2.036   8.130
   64   HG23  THR   7          2HG2      THR   7  14.971   0.398   8.522
   65    H    ALA   8           H        ALA   8  13.329   2.120   4.515
   66    HA   ALA   8           HA       ALA   8  11.314   1.363   2.650
   67    HB1  ALA   8           1HB      ALA   8  13.009   1.912   0.936
   68    HB2  ALA   8           2HB      ALA   8  14.187   2.158   2.225
   69    HB3  ALA   8           3HB      ALA   8  12.766   3.199   2.113
   70    H    SER   9           H        SER   9  14.131  -0.159   4.001
   71    HA   SER   9           HA       SER   9  14.393  -2.311   2.220
   72    HB2  SER   9           1HB      SER   9  14.877  -2.346   5.211
   73    HB3  SER   9           2HB      SER   9  15.587  -3.430   4.013
   74    HG   SER   9           HG       SER   9  16.797  -1.433   4.818
   75    H    GLU  10           H        GLU  10  12.397  -1.853   5.109
   76    HA   GLU  10           HA       GLU  10  11.038  -4.263   5.124
   77    HB2  GLU  10           1HB      GLU  10  10.386  -1.479   5.981
   78    HB3  GLU  10           2HB      GLU  10   9.147  -2.722   6.066
   79    HG2  GLU  10           1HG      GLU  10  10.521  -4.056   7.486
   80    HG3  GLU  10           2HG      GLU  10  11.860  -2.931   7.325
   81    H    PHE  11           H        PHE  11  10.363  -1.298   3.257
   82    HA   PHE  11           HA       PHE  11   7.995  -2.164   2.055
   83    HB2  PHE  11           1HB      PHE  11   8.936   0.160   1.894
   84    HB3  PHE  11           2HB      PHE  11  10.110  -0.438   0.724
   85    HD1  PHE  11           2HD      PHE  11   9.265  -1.379  -1.454
   86    HD2  PHE  11           1HD      PHE  11   6.757   0.777   1.228
   87    HE1  PHE  11           2HE      PHE  11   7.670  -0.965  -3.276
   88    HE2  PHE  11           1HE      PHE  11   5.155   1.214  -0.613
   89    HZ   PHE  11           HZ       PHE  11   5.622   0.328  -2.856
   90    H    ASP  12           H        ASP  12  11.272  -2.326   0.696
   91    HA   ASP  12           HA       ASP  12  10.685  -3.896  -1.538
   92    HB2  ASP  12           1HB      ASP  12  13.219  -3.673   0.085
   93    HB3  ASP  12           2HB      ASP  12  13.115  -4.622  -1.390
   94    H    SER  13           H        SER  13  11.537  -4.895   1.753
   95    HA   SER  13           HA       SER  13  11.866  -7.622   1.295
   96    HB2  SER  13           1HB      SER  13  12.404  -6.435   3.431
   97    HB3  SER  13           2HB      SER  13  10.678  -6.362   3.780
   98    HG   SER  13           HG       SER  13  11.558  -8.876   3.126
   99    H    ALA  14           H        ALA  14   8.916  -5.786   2.003
  100    HA   ALA  14           HA       ALA  14   7.217  -8.049   1.981
  101    HB1  ALA  14           1HB      ALA  14   5.382  -6.467   1.954
  102    HB2  ALA  14           2HB      ALA  14   6.496  -5.159   1.529
  103    HB3  ALA  14           3HB      ALA  14   6.617  -5.945   3.105
  104    H    ILE  15           H        ILE  15   8.310  -5.744  -0.411
  105    HA   ILE  15           HA       ILE  15   6.568  -6.384  -2.513
  106    HB   ILE  15           HB       ILE  15   9.439  -5.520  -2.739
  107   HG12  ILE  15          1HG1      ILE  15   8.463  -3.812  -1.483
  108   HG13  ILE  15          2HG1      ILE  15   8.326  -3.266  -3.149
  109   HG21  ILE  15          1HG2      ILE  15   8.166  -6.436  -4.774
  110   HG22  ILE  15          2HG2      ILE  15   9.045  -4.915  -4.922
  111   HG23  ILE  15          3HG2      ILE  15   7.294  -4.905  -4.711
  112   HD11  ILE  15          3HD1      ILE  15   6.124  -4.558  -1.562
  113   HD12  ILE  15          1HD1      ILE  15   6.003  -3.934  -3.206
  114   HD13  ILE  15          2HD1      ILE  15   6.297  -2.829  -1.863
  115    H    ALA  16           H        ALA  16   9.600  -7.791  -1.464
  116    HA   ALA  16           HA       ALA  16  10.019  -9.322  -3.829
  117    HB1  ALA  16           1HB      ALA  16  11.857  -8.502  -2.434
  118    HB2  ALA  16           2HB      ALA  16  11.925 -10.249  -2.660
  119    HB3  ALA  16           3HB      ALA  16  11.340  -9.580  -1.137
  120    H    GLN  17           H        GLN  17   7.772  -9.736  -1.555
  121    HA   GLN  17           HA       GLN  17   7.926 -12.540  -1.102
  122    HB2  GLN  17           1HB      GLN  17   5.735 -10.498  -0.767
  123    HB3  GLN  17           2HB      GLN  17   5.571 -12.177  -0.311
  124    HG2  GLN  17           1HG      GLN  17   7.420 -11.951   1.255
  125    HG3  GLN  17           2HG      GLN  17   7.597 -10.261   0.793
  126   HE21  GLN  17          1HE2      GLN  17   4.731  -9.804   0.622
  127   HE22  GLN  17          2HE2      GLN  17   4.136  -9.778   2.246
  128    H    ASP  18           H        ASP  18   6.778 -14.164  -2.112
  129    HA   ASP  18           HA       ASP  18   6.222 -13.694  -4.896
  130    HB2  ASP  18           1HB      ASP  18   5.894 -16.138  -5.000
  131    HB3  ASP  18           2HB      ASP  18   7.414 -15.710  -4.223
  132    H    LYS  19           H        LYS  19   4.414 -12.384  -3.099
  133    HA   LYS  19           HA       LYS  19   1.937 -13.422  -4.200
  134    HB2  LYS  19           1HB      LYS  19   0.779 -13.070  -1.965
  135    HB3  LYS  19           2HB      LYS  19   1.783 -14.500  -2.107
  136    HG2  LYS  19           1HG      LYS  19   2.914 -11.999  -0.931
  137    HG3  LYS  19           2HG      LYS  19   1.876 -13.042   0.039
  138    HD2  LYS  19           1HD      LYS  19   4.413 -13.899  -1.361
  139    HD3  LYS  19           2HD      LYS  19   4.259 -13.554   0.361
  140    HE2  LYS  19           1HE      LYS  19   2.645 -15.375   0.583
  141    HE3  LYS  19           2HE      LYS  19   2.787 -15.718  -1.138
  142    HZ1  LYS  19           3HZ      LYS  19   4.140 -17.240   0.085
  143    HZ2  LYS  19           1HZ      LYS  19   4.929 -15.983   0.894
  144    HZ3  LYS  19           2HZ      LYS  19   5.163 -16.195  -0.768
  145    H    LEU  20           H        LEU  20   0.095 -11.817  -3.604
  146    HA   LEU  20           HA       LEU  20   0.874  -9.302  -4.656
  147    HB2  LEU  20           1HB      LEU  20  -1.357 -10.512  -4.918
  148    HB3  LEU  20           2HB      LEU  20  -1.756  -9.924  -3.318
  149    HG   LEU  20           HG       LEU  20  -2.731  -8.601  -5.200
  150   HD11  LEU  20          1HD1      LEU  20  -2.228  -6.416  -4.272
  151   HD12  LEU  20          2HD1      LEU  20  -0.825  -7.079  -3.433
  152   HD13  LEU  20          3HD1      LEU  20  -2.449  -7.605  -2.989
  153   HD21  LEU  20          3HD2      LEU  20  -1.414  -7.258  -6.601
  154   HD22  LEU  20          1HD2      LEU  20  -0.660  -8.856  -6.622
  155   HD23  LEU  20          2HD2      LEU  20   0.049  -7.563  -5.649
  156    H    VAL  21           H        VAL  21   1.646  -7.610  -3.656
  157    HA   VAL  21           HA       VAL  21   1.440  -7.446  -0.730
  158    HB   VAL  21           HB       VAL  21   3.181  -5.607  -2.298
  159   HG11  VAL  21          1HG1      VAL  21   3.020  -5.340   0.097
  160   HG12  VAL  21          2HG1      VAL  21   4.643  -5.869  -0.347
  161   HG13  VAL  21          3HG1      VAL  21   3.499  -7.019   0.342
  162   HG21  VAL  21          3HG2      VAL  21   5.010  -7.385  -2.120
  163   HG22  VAL  21          1HG2      VAL  21   3.824  -7.549  -3.418
  164   HG23  VAL  21          2HG2      VAL  21   3.690  -8.542  -1.963
  165    H    VAL  22           H        VAL  22  -0.181  -6.185  -0.042
  166    HA   VAL  22           HA       VAL  22  -0.996  -3.861  -1.618
  167    HB   VAL  22           HB       VAL  22  -2.162  -4.889   0.977
  168   HG11  VAL  22          1HG1      VAL  22  -4.077  -3.504   0.434
  169   HG12  VAL  22          2HG1      VAL  22  -3.301  -2.977  -1.060
  170   HG13  VAL  22          3HG1      VAL  22  -2.616  -2.520   0.500
  171   HG21  VAL  22          3HG2      VAL  22  -3.958  -5.830  -0.414
  172   HG22  VAL  22          1HG2      VAL  22  -2.392  -6.579  -0.734
  173   HG23  VAL  22          2HG2      VAL  22  -3.045  -5.386  -1.858
  174    H    VAL  23           H        VAL  23   0.399  -2.201  -1.316
  175    HA   VAL  23           HA       VAL  23   1.249  -1.678   1.439
  176    HB   VAL  23           HB       VAL  23   2.484  -0.631  -1.107
  177   HG11  VAL  23          1HG1      VAL  23   3.141  -0.294   1.803
  178   HG12  VAL  23          2HG1      VAL  23   2.876   0.953   0.582
  179   HG13  VAL  23          3HG1      VAL  23   4.332  -0.040   0.531
  180   HG21  VAL  23          3HG2      VAL  23   2.875  -3.009  -0.859
  181   HG22  VAL  23          1HG2      VAL  23   3.387  -2.770   0.812
  182   HG23  VAL  23          2HG2      VAL  23   4.357  -2.116  -0.511
  183    H    ALA  24           H        ALA  24   0.517  -0.080   2.478
  184    HA   ALA  24           HA       ALA  24  -1.224   1.900   1.144
  185    HB1  ALA  24           1HB      ALA  24  -0.968   1.238   4.086
  186    HB2  ALA  24           2HB      ALA  24  -2.080   0.425   2.993
  187    HB3  ALA  24           3HB      ALA  24  -2.251   2.155   3.300
  188    H    PHE  25           H        PHE  25   0.269   3.541   0.549
  189    HA   PHE  25           HA       PHE  25   1.826   4.673   2.768
  190    HB2  PHE  25           1HB      PHE  25   2.282   4.507  -0.131
  191    HB3  PHE  25           2HB      PHE  25   2.722   6.044   0.613
  192    HD1  PHE  25           1HD      PHE  25   2.920   2.496   1.690
  193    HD2  PHE  25           2HD      PHE  25   4.976   6.151   1.032
  194    HE1  PHE  25           1HE      PHE  25   4.981   1.474   2.542
  195    HE2  PHE  25           2HE      PHE  25   7.049   5.140   1.884
  196    HZ   PHE  25           HZ       PHE  25   7.050   2.794   2.643
  197    H    TYR  26           H        TYR  26   1.167   6.411   3.729
  198    HA   TYR  26           HA       TYR  26  -0.289   8.455   2.265
  199    HB2  TYR  26           1HB      TYR  26  -2.075   8.526   4.027
  200    HB3  TYR  26           2HB      TYR  26  -2.124   7.093   3.006
  201    HD1  TYR  26           1HD      TYR  26  -1.297   4.924   3.905
  202    HD2  TYR  26           2HD      TYR  26  -1.760   8.347   6.380
  203    HE1  TYR  26           1HE      TYR  26  -1.257   3.481   5.886
  204    HE2  TYR  26           2HE      TYR  26  -1.717   6.915   8.374
  205    HH   TYR  26           HH       TYR  26  -0.645   3.780   8.352
  206    H    ALA  27           H        ALA  27  -0.730  10.348   3.771
  207    HA   ALA  27           HA       ALA  27   1.562  10.643   5.593
  208    HB1  ALA  27           1HB      ALA  27   0.234  12.799   3.961
  209    HB2  ALA  27           2HB      ALA  27   1.719  11.964   3.506
  210    HB3  ALA  27           3HB      ALA  27   1.678  12.964   4.961
  211    H    THR  28           H        THR  28   1.078  11.024   7.648
  212    HA   THR  28           HA       THR  28  -1.501  10.965   8.648
  213    HB   THR  28           HB       THR  28   0.384  12.307  10.374
  214    HG1  THR  28           1HG      THR  28   1.095   9.729   9.368
  215   HG21  THR  28          3HG2      THR  28  -1.582  11.084  11.166
  216   HG22  THR  28          1HG2      THR  28  -0.096  10.377  11.801
  217   HG23  THR  28          2HG2      THR  28  -0.935   9.605  10.456
  218    H    TRP  29           H        TRP  29   0.310  13.676   7.499
  219    HA   TRP  29           HA       TRP  29  -1.357  15.610   8.865
  220    HB2  TRP  29           1HB      TRP  29   0.019  17.280   7.576
  221    HB3  TRP  29           2HB      TRP  29   0.934  16.235   8.653
  222    HD1  TRP  29           HD       TRP  29   2.860  14.856   7.613
  223    HE1  TRP  29           1HE      TRP  29   3.805  14.572   5.235
  224    HE3  TRP  29           3HE      TRP  29  -0.834  17.214   4.981
  225    HZ2  TRP  29           2HZ      TRP  29   3.071  15.251   2.597
  226    HZ3  TRP  29           3HZ      TRP  29  -0.639  17.348   2.539
  227    HH2  TRP  29           HH       TRP  29   1.277  16.390   1.370
  228    H    CYS  30           H        CYS  30  -1.664  13.765   6.104
  229    HA   CYS  30           HA       CYS  30  -2.838  15.850   4.459
  230    HB2  CYS  30           1HB      CYS  30  -1.387  14.108   3.450
  231    HB3  CYS  30           2HB      CYS  30  -2.571  12.888   3.907
  232    HG   CYS  30           HG       CYS  30  -3.225  15.472   1.759
  233    H    GLY  31           H        GLY  31  -4.991  15.570   3.512
  234    HA2  GLY  31           1HA      GLY  31  -6.946  15.255   5.502
  235    HA3  GLY  31           2HA      GLY  31  -7.259  15.424   3.786
  236    HA   PRO  32           HA       PRO  32  -8.759  11.394   3.586
  237    HB2  PRO  32           1HB      PRO  32  -7.519  10.671   1.082
  238    HB3  PRO  32           2HB      PRO  32  -9.161  11.245   1.376
  239    HG2  PRO  32           1HG      PRO  32  -7.258  12.689   0.040
  240    HG3  PRO  32           2HG      PRO  32  -8.617  13.415   0.915
  241    HD2  PRO  32           1HD      PRO  32  -5.767  13.091   1.771
  242    HD3  PRO  32           2HD      PRO  32  -6.864  14.470   2.001
  243    H    CYS  33           H        CYS  33  -5.894  11.480   4.724
  244    HA   CYS  33           HA       CYS  33  -4.634   9.045   3.984
  245    HB2  CYS  33           1HB      CYS  33  -3.442   9.298   6.174
  246    HB3  CYS  33           2HB      CYS  33  -3.368  10.732   5.157
  247    HG   CYS  33           HG       CYS  33  -4.504  12.379   6.791
  248    H    LYS  34           H        LYS  34  -7.070   9.944   6.294
  249    HA   LYS  34           HA       LYS  34  -7.223   7.486   7.681
  250    HB2  LYS  34           1HB      LYS  34  -9.319   8.337   8.578
  251    HB3  LYS  34           2HB      LYS  34  -8.087   9.588   8.611
  252    HG2  LYS  34           1HG      LYS  34  -9.058  10.545   6.546
  253    HG3  LYS  34           2HG      LYS  34 -10.339   9.335   6.629
  254    HD2  LYS  34           1HD      LYS  34  -9.744  11.430   8.719
  255    HD3  LYS  34           2HD      LYS  34 -11.070  11.477   7.559
  256    HE2  LYS  34           1HE      LYS  34 -10.674   9.380   9.692
  257    HE3  LYS  34           2HE      LYS  34 -11.804  10.728   9.778
  258    HZ1  LYS  34           3HZ      LYS  34 -13.004   9.837   7.908
  259    HZ2  LYS  34           1HZ      LYS  34 -12.862   8.642   9.096
  260    HZ3  LYS  34           2HZ      LYS  34 -11.883   8.587   7.720
  261    H    MET  35           H        MET  35  -8.027   8.220   4.493
  262    HA   MET  35           HA       MET  35 -10.344   6.476   4.355
  263    HB2  MET  35           1HB      MET  35  -9.472   8.514   2.768
  264    HB3  MET  35           2HB      MET  35  -8.877   7.122   1.871
  265    HG2  MET  35           1HG      MET  35 -11.724   7.759   2.609
  266    HG3  MET  35           2HG      MET  35 -11.012   7.699   0.999
  267    HE1  MET  35           3HE      MET  35 -13.407   4.662   0.770
  268    HE2  MET  35           1HE      MET  35 -12.678   5.973  -0.159
  269    HE3  MET  35           2HE      MET  35 -13.632   6.334   1.284
  270    H    ILE  36           H        ILE  36  -6.900   6.395   3.771
  271    HA   ILE  36           HA       ILE  36  -6.906   3.817   2.539
  272    HB   ILE  36           HB       ILE  36  -4.896   5.830   3.231
  273   HG12  ILE  36          1HG1      ILE  36  -4.079   5.328   1.039
  274   HG13  ILE  36          2HG1      ILE  36  -4.958   3.805   1.002
  275   HG21  ILE  36          1HG2      ILE  36  -3.004   4.236   3.029
  276   HG22  ILE  36          2HG2      ILE  36  -4.157   2.917   3.222
  277   HG23  ILE  36          3HG2      ILE  36  -3.918   4.077   4.528
  278   HD11  ILE  36          3HD1      ILE  36  -6.030   5.505  -0.367
  279   HD12  ILE  36          1HD1      ILE  36  -6.211   6.532   1.057
  280   HD13  ILE  36          2HD1      ILE  36  -7.060   4.990   0.975
  281    H    ALA  37           H        ALA  37  -6.692   5.025   5.779
  282    HA   ALA  37           HA       ALA  37  -5.611   2.818   7.055
  283    HB1  ALA  37           1HB      ALA  37  -7.076   3.541   9.024
  284    HB2  ALA  37           2HB      ALA  37  -7.626   4.845   7.967
  285    HB3  ALA  37           3HB      ALA  37  -5.920   4.705   8.380
  286    HA   PRO  38           HA       PRO  38  -9.670   0.547   7.590
  287    HB2  PRO  38           1HB      PRO  38 -12.077   1.503   6.959
  288    HB3  PRO  38           2HB      PRO  38 -11.222   2.058   8.405
  289    HG2  PRO  38           1HG      PRO  38 -11.487   3.379   5.737
  290    HG3  PRO  38           2HG      PRO  38 -11.588   4.094   7.356
  291    HD2  PRO  38           1HD      PRO  38  -9.339   4.152   5.757
  292    HD3  PRO  38           2HD      PRO  38  -9.330   4.315   7.521
  293    H    MET  39           H        MET  39  -9.690   2.240   4.431
  294    HA   MET  39           HA       MET  39 -11.321   0.286   3.136
  295    HB2  MET  39           1HB      MET  39 -11.095   2.433   2.073
  296    HB3  MET  39           2HB      MET  39  -9.349   2.339   2.154
  297    HG2  MET  39           1HG      MET  39  -9.773   0.198   0.650
  298    HG3  MET  39           2HG      MET  39 -11.221   1.116   0.232
  299    HE1  MET  39           3HE      MET  39  -7.032   2.989  -0.109
  300    HE2  MET  39           1HE      MET  39  -7.405   1.572   0.885
  301    HE3  MET  39           2HE      MET  39  -8.061   3.155   1.309
  302    H    ILE  40           H        ILE  40  -7.864   0.766   3.483
  303    HA   ILE  40           HA       ILE  40  -7.107  -1.457   1.870
  304    HB   ILE  40           HB       ILE  40  -5.880   0.717   3.275
  305   HG12  ILE  40          1HG1      ILE  40  -4.523  -1.052   1.277
  306   HG13  ILE  40          2HG1      ILE  40  -5.875  -0.028   0.803
  307   HG21  ILE  40          1HG2      ILE  40  -4.448  -1.923   3.549
  308   HG22  ILE  40          2HG2      ILE  40  -5.049  -0.910   4.862
  309   HG23  ILE  40          3HG2      ILE  40  -3.729  -0.341   3.843
  310   HD11  ILE  40          3HD1      ILE  40  -3.609   1.168   2.293
  311   HD12  ILE  40          1HD1      ILE  40  -4.705   1.901   1.131
  312   HD13  ILE  40          2HD1      ILE  40  -3.428   0.817   0.575
  313    H    GLU  41           H        GLU  41  -7.490  -0.939   5.363
  314    HA   GLU  41           HA       GLU  41  -6.642  -3.531   6.118
  315    HB2  GLU  41           1HB      GLU  41  -6.912  -1.765   7.775
  316    HB3  GLU  41           2HB      GLU  41  -8.638  -1.672   7.446
  317    HG2  GLU  41           1HG      GLU  41  -8.947  -3.914   8.318
  318    HG3  GLU  41           2HG      GLU  41  -7.212  -4.068   8.582
  319    H    LYS  42           H        LYS  42  -9.649  -2.256   4.901
  320    HA   LYS  42           HA       LYS  42 -11.290  -4.486   5.437
  321    HB2  LYS  42           1HB      LYS  42 -12.289  -2.348   4.990
  322    HB3  LYS  42           2HB      LYS  42 -11.524  -2.253   3.411
  323    HG2  LYS  42           1HG      LYS  42 -13.844  -2.795   3.145
  324    HG3  LYS  42           2HG      LYS  42 -12.873  -4.193   2.688
  325    HD2  LYS  42           1HD      LYS  42 -14.702  -5.001   3.977
  326    HD3  LYS  42           2HD      LYS  42 -13.263  -5.101   4.992
  327    HE2  LYS  42           1HE      LYS  42 -15.155  -4.245   6.256
  328    HE3  LYS  42           2HE      LYS  42 -13.903  -3.016   6.101
  329    HZ1  LYS  42           3HZ      LYS  42 -16.093  -2.089   5.719
  330    HZ2  LYS  42           1HZ      LYS  42 -16.376  -3.186   4.464
  331    HZ3  LYS  42           2HZ      LYS  42 -15.174  -2.007   4.305
  332    H    PHE  43           H        PHE  43  -9.201  -3.648   2.718
  333    HA   PHE  43           HA       PHE  43  -9.965  -5.497   0.802
  334    HB2  PHE  43           1HB      PHE  43  -7.117  -4.766   1.585
  335    HB3  PHE  43           2HB      PHE  43  -7.580  -5.575   0.084
  336    HD1  PHE  43           2HD      PHE  43 -10.193  -3.657   0.146
  337    HD2  PHE  43           1HD      PHE  43  -5.986  -3.138   0.111
  338    HE1  PHE  43           2HE      PHE  43 -10.483  -1.460  -0.920
  339    HE2  PHE  43           1HE      PHE  43  -6.258  -0.943  -0.953
  340    HZ   PHE  43           HZ       PHE  43  -8.507  -0.101  -1.465
  341    H    SER  44           H        SER  44  -7.438  -6.086   3.315
  342    HA   SER  44           HA       SER  44  -7.405  -8.863   2.599
  343    HB2  SER  44           1HB      SER  44  -5.725  -9.068   4.367
  344    HB3  SER  44           2HB      SER  44  -5.347  -7.767   3.249
  345    HG   SER  44           HG       SER  44  -5.580  -7.597   5.867
  346    H    GLU  45           H        GLU  45  -9.199  -6.946   4.784
  347    HA   GLU  45           HA       GLU  45  -9.995  -8.859   6.661
  348    HB2  GLU  45           1HB      GLU  45 -10.624  -6.487   6.780
  349    HB3  GLU  45           2HB      GLU  45 -11.659  -6.688   5.375
  350    HG2  GLU  45           1HG      GLU  45 -13.035  -6.694   7.313
  351    HG3  GLU  45           2HG      GLU  45 -12.990  -8.337   6.674
  352    H    GLN  46           H        GLN  46 -10.891  -8.331   3.309
  353    HA   GLN  46           HA       GLN  46 -12.858 -10.455   3.353
  354    HB2  GLN  46           1HB      GLN  46 -11.786  -9.250   0.833
  355    HB3  GLN  46           2HB      GLN  46 -13.396  -9.862   1.164
  356    HG2  GLN  46           1HG      GLN  46 -12.295  -7.342   2.372
  357    HG3  GLN  46           2HG      GLN  46 -13.190  -7.383   0.861
  358   HE21  GLN  46          1HE2      GLN  46 -13.927  -9.328   3.719
  359   HE22  GLN  46          2HE2      GLN  46 -15.434  -8.560   4.057
  360    H    TYR  47           H        TYR  47  -9.652  -9.813   2.014
  361    HA   TYR  47           HA       TYR  47  -9.294 -12.703   1.666
  362    HB2  TYR  47           1HB      TYR  47  -7.835 -11.950  -0.368
  363    HB3  TYR  47           2HB      TYR  47  -9.579 -12.096  -0.522
  364    HD1  TYR  47           2HD      TYR  47  -6.859  -9.604   0.011
  365    HD2  TYR  47           1HD      TYR  47 -10.894 -10.298  -1.168
  366    HE1  TYR  47           2HE      TYR  47  -7.030  -7.278  -0.791
  367    HE2  TYR  47           1HE      TYR  47 -11.074  -7.976  -1.950
  368    HH   TYR  47           HH       TYR  47  -8.445  -5.989  -2.426
  369    HA   PRO  48           HA       PRO  48  -5.773 -11.163   4.187
  370    HB2  PRO  48           1HB      PRO  48  -5.564 -13.373   5.727
  371    HB3  PRO  48           2HB      PRO  48  -6.702 -12.071   6.078
  372    HG2  PRO  48           1HG      PRO  48  -7.192 -14.700   4.732
  373    HG3  PRO  48           2HG      PRO  48  -8.174 -13.867   5.952
  374    HD2  PRO  48           1HD      PRO  48  -8.766 -13.816   3.303
  375    HD3  PRO  48           2HD      PRO  48  -9.146 -12.473   4.399
  376    H    GLN  49           H        GLN  49  -6.275 -13.573   1.930
  377    HA   GLN  49           HA       GLN  49  -3.793 -14.873   1.913
  378    HB2  GLN  49           1HB      GLN  49  -4.352 -15.347  -0.500
  379    HB3  GLN  49           2HB      GLN  49  -5.523 -15.892   0.688
  380    HG2  GLN  49           1HG      GLN  49  -7.017 -14.854  -0.546
  381    HG3  GLN  49           2HG      GLN  49  -6.324 -13.384   0.127
  382   HE21  GLN  49          1HE2      GLN  49  -5.039 -12.078  -1.155
  383   HE22  GLN  49          2HE2      GLN  49  -4.906 -12.294  -2.864
  384    H    ALA  50           H        ALA  50  -4.549 -11.692   1.274
  385    HA   ALA  50           HA       ALA  50  -2.152 -11.278  -0.378
  386    HB1  ALA  50           1HB      ALA  50  -2.991  -8.996  -0.686
  387    HB2  ALA  50           2HB      ALA  50  -4.359  -9.358   0.366
  388    HB3  ALA  50           3HB      ALA  50  -4.191 -10.192  -1.180
  389    H    ASP  51           H        ASP  51  -0.657  -9.560   0.290
  390    HA   ASP  51           HA       ASP  51  -0.374  -9.609   3.183
  391    HB2  ASP  51           1HB      ASP  51   1.523  -9.147   0.939
  392    HB3  ASP  51           2HB      ASP  51   1.876  -8.388   2.482
  393    H    PHE  52           H        PHE  52  -0.391  -7.907   4.474
  394    HA   PHE  52           HA       PHE  52  -1.359  -5.398   3.286
  395    HB2  PHE  52           1HB      PHE  52  -2.279  -5.215   5.783
  396    HB3  PHE  52           2HB      PHE  52  -3.183  -6.028   4.517
  397    HD1  PHE  52           2HD      PHE  52  -1.037  -6.526   7.471
  398    HD2  PHE  52           1HD      PHE  52  -3.556  -8.375   4.585
  399    HE1  PHE  52           2HE      PHE  52  -1.066  -8.583   8.818
  400    HE2  PHE  52           1HE      PHE  52  -3.591 -10.434   5.926
  401    HZ   PHE  52           HZ       PHE  52  -2.346 -10.540   8.045
  402    H    TYR  53           H        TYR  53   0.079  -3.804   3.396
  403    HA   TYR  53           HA       TYR  53   1.519  -3.410   5.915
  404    HB2  TYR  53           1HB      TYR  53   2.825  -3.373   3.187
  405    HB3  TYR  53           2HB      TYR  53   3.591  -2.851   4.678
  406    HD1  TYR  53           2HD      TYR  53   4.167  -4.524   6.419
  407    HD2  TYR  53           1HD      TYR  53   2.688  -5.692   2.606
  408    HE1  TYR  53           2HE      TYR  53   5.008  -6.801   6.799
  409    HE2  TYR  53           1HE      TYR  53   3.536  -7.974   2.969
  410    HH   TYR  53           HH       TYR  53   5.259  -9.107   4.328
  411    H    LYS  54           H        LYS  54   2.206  -1.250   6.286
  412    HA   LYS  54           HA       LYS  54   1.166   0.803   4.502
  413    HB2  LYS  54           1HB      LYS  54  -0.356   1.727   6.068
  414    HB3  LYS  54           2HB      LYS  54  -0.680  -0.003   6.032
  415    HG2  LYS  54           1HG      LYS  54   0.562  -0.298   8.104
  416    HG3  LYS  54           2HG      LYS  54   0.928   1.428   8.140
  417    HD2  LYS  54           1HD      LYS  54  -1.563   1.838   8.136
  418    HD3  LYS  54           2HD      LYS  54  -1.767   0.105   8.396
  419    HE2  LYS  54           1HE      LYS  54  -0.274   2.007  10.199
  420    HE3  LYS  54           2HE      LYS  54  -1.878   1.345  10.497
  421    HZ1  LYS  54           3HZ      LYS  54  -0.862  -0.886  10.505
  422    HZ2  LYS  54           1HZ      LYS  54  -0.273   0.112  11.737
  423    HZ3  LYS  54           2HZ      LYS  54   0.664  -0.171  10.363
  424    H    LEU  55           H        LEU  55   1.882   2.975   5.099
  425    HA   LEU  55           HA       LEU  55   3.639   3.314   7.345
  426    HB2  LEU  55           1HB      LEU  55   5.177   2.259   5.825
  427    HB3  LEU  55           2HB      LEU  55   4.711   3.333   4.527
  428    HG   LEU  55           HG       LEU  55   5.903   4.550   6.973
  429   HD11  LEU  55          1HD1      LEU  55   8.157   4.168   6.055
  430   HD12  LEU  55          2HD1      LEU  55   7.465   3.089   4.845
  431   HD13  LEU  55          3HD1      LEU  55   7.379   2.667   6.554
  432   HD21  LEU  55          3HD2      LEU  55   6.362   5.120   4.060
  433   HD22  LEU  55          1HD2      LEU  55   6.643   6.184   5.436
  434   HD23  LEU  55          2HD2      LEU  55   4.992   5.780   4.953
  435    H    ASP  56           H        ASP  56   3.971   5.470   7.860
  436    HA   ASP  56           HA       ASP  56   2.369   7.425   6.396
  437    HB2  ASP  56           1HB      ASP  56   3.681   7.430   9.116
  438    HB3  ASP  56           2HB      ASP  56   2.980   8.872   8.408
  439    H    VAL  57           H        VAL  57   3.351   8.671   4.915
  440    HA   VAL  57           HA       VAL  57   6.165   8.683   4.577
  441    HB   VAL  57           HB       VAL  57   5.834   9.990   2.695
  442   HG11  VAL  57          1HG1      VAL  57   4.053   9.005   1.528
  443   HG12  VAL  57          2HG1      VAL  57   3.060   8.881   2.976
  444   HG13  VAL  57          3HG1      VAL  57   4.466   7.833   2.778
  445   HG21  VAL  57          3HG2      VAL  57   3.859  11.477   2.386
  446   HG22  VAL  57          1HG2      VAL  57   4.911  11.953   3.718
  447   HG23  VAL  57          2HG2      VAL  57   3.393  11.122   4.048
  448    H    ASP  58           H        ASP  58   4.077  10.537   6.545
  449    HA   ASP  58           HA       ASP  58   5.592  12.890   6.841
  450    HB2  ASP  58           1HB      ASP  58   3.339  12.762   7.743
  451    HB3  ASP  58           2HB      ASP  58   3.806  11.446   8.815
  452    H    GLU  59           H        GLU  59   5.716   9.738   8.374
  453    HA   GLU  59           HA       GLU  59   7.970  10.492  10.025
  454    HB2  GLU  59           1HB      GLU  59   6.693   7.789   9.596
  455    HB3  GLU  59           2HB      GLU  59   7.897   8.173  10.818
  456    HG2  GLU  59           1HG      GLU  59   6.292   9.816  11.780
  457    HG3  GLU  59           2HG      GLU  59   5.085   9.224  10.638
  458    H    LEU  60           H        LEU  60   7.385   8.463   7.164
  459    HA   LEU  60           HA       LEU  60  10.305   8.391   6.752
  460    HB2  LEU  60           1HB      LEU  60   8.339   6.156   6.289
  461    HB3  LEU  60           2HB      LEU  60   9.968   6.150   5.661
  462    HG   LEU  60           HG       LEU  60  10.080   4.797   7.547
  463   HD11  LEU  60          1HD1      LEU  60  11.463   5.963   9.150
  464   HD12  LEU  60          2HD1      LEU  60  10.897   7.517   8.541
  465   HD13  LEU  60          3HD1      LEU  60  11.864   6.465   7.507
  466   HD21  LEU  60          3HD2      LEU  60   8.490   6.846   9.079
  467   HD22  LEU  60          1HD2      LEU  60   9.112   5.323   9.715
  468   HD23  LEU  60          2HD2      LEU  60   7.878   5.313   8.457
  469    H    GLY  61           H        GLY  61   9.712  10.341   5.471
  470    HA2  GLY  61           1HA      GLY  61   8.222  10.117   3.069
  471    HA3  GLY  61           2HA      GLY  61   9.378  11.385   3.453
  472    H    ASP  62           H        ASP  62  11.630   9.691   3.831
  473    HA   ASP  62           HA       ASP  62  12.679   9.527   1.254
  474    HB2  ASP  62           1HB      ASP  62  14.069   9.631   3.274
  475    HB3  ASP  62           2HB      ASP  62  13.528   8.022   3.728
  476    H    VAL  63           H        VAL  63  11.147   7.100   3.225
  477    HA   VAL  63           HA       VAL  63  11.546   4.903   1.508
  478    HB   VAL  63           HB       VAL  63   9.282   5.397   3.434
  479   HG11  VAL  63          1HG1      VAL  63  10.223   2.878   2.074
  480   HG12  VAL  63          2HG1      VAL  63   8.666   3.677   1.875
  481   HG13  VAL  63          3HG1      VAL  63   9.077   2.915   3.412
  482   HG21  VAL  63          3HG2      VAL  63  11.567   5.423   4.431
  483   HG22  VAL  63          1HG2      VAL  63  11.796   3.779   3.830
  484   HG23  VAL  63          2HG2      VAL  63  10.545   4.115   5.028
  485    H    ALA  64           H        ALA  64   8.743   7.089   1.883
  486    HA   ALA  64           HA       ALA  64   7.179   6.137  -0.177
  487    HB1  ALA  64           1HB      ALA  64   6.181   8.360  -0.268
  488    HB2  ALA  64           2HB      ALA  64   7.537   9.012   0.650
  489    HB3  ALA  64           3HB      ALA  64   6.443   7.852   1.401
  490    H    GLN  65           H        GLN  65   9.932   8.322  -0.292
  491    HA   GLN  65           HA       GLN  65   9.642   8.992  -3.053
  492    HB2  GLN  65           1HB      GLN  65  12.118   9.102  -1.315
  493    HB3  GLN  65           2HB      GLN  65  11.923   9.890  -2.872
  494    HG2  GLN  65           1HG      GLN  65  10.423  10.511  -0.340
  495    HG3  GLN  65           2HG      GLN  65  11.668  11.497  -1.102
  496   HE21  GLN  65          1HE2      GLN  65   8.355  10.527  -1.145
  497   HE22  GLN  65          2HE2      GLN  65   7.827  11.645  -2.350
  498    H    LYS  66           H        LYS  66  11.314   6.464  -1.298
  499    HA   LYS  66           HA       LYS  66  12.800   5.390  -3.385
  500    HB2  LYS  66           1HB      LYS  66  13.485   4.400  -1.469
  501    HB3  LYS  66           2HB      LYS  66  11.924   4.627  -0.692
  502    HG2  LYS  66           1HG      LYS  66  12.238   2.328  -0.760
  503    HG3  LYS  66           2HG      LYS  66  11.112   2.687  -2.061
  504    HD2  LYS  66           1HD      LYS  66  13.018   2.637  -3.660
  505    HD3  LYS  66           2HD      LYS  66  14.066   2.128  -2.331
  506    HE2  LYS  66           1HE      LYS  66  12.725   0.135  -2.007
  507    HE3  LYS  66           2HE      LYS  66  11.612   0.652  -3.270
  508    HZ1  LYS  66           3HZ      LYS  66  13.280   0.365  -4.907
  509    HZ2  LYS  66           1HZ      LYS  66  13.279  -1.036  -3.960
  510    HZ3  LYS  66           2HZ      LYS  66  14.491   0.127  -3.752
  511    H    ASN  67           H        ASN  67   9.399   5.253  -2.690
  512    HA   ASN  67           HA       ASN  67   9.056   2.863  -4.355
  513    HB2  ASN  67           1HB      ASN  67   6.951   4.177  -2.677
  514    HB3  ASN  67           2HB      ASN  67   7.016   2.528  -3.250
  515   HD21  ASN  67          1HD2      ASN  67   6.963   4.090  -0.614
  516   HD22  ASN  67          2HD2      ASN  67   8.064   3.221   0.362
  517    H    GLU  68           H        GLU  68   8.847   6.185  -4.443
  518    HA   GLU  68           HA       GLU  68   8.248   7.557  -6.144
  519    HB2  GLU  68           1HB      GLU  68   7.008   5.084  -7.346
  520    HB3  GLU  68           2HB      GLU  68   7.041   6.668  -8.129
  521    HG2  GLU  68           1HG      GLU  68   9.432   6.639  -8.250
  522    HG3  GLU  68           2HG      GLU  68   9.506   5.164  -7.289
  523    H    VAL  69           H        VAL  69   6.654   6.793  -3.739
  524    HA   VAL  69           HA       VAL  69   4.029   7.692  -4.670
  525    HB   VAL  69           HB       VAL  69   3.467   5.957  -3.297
  526   HG11  VAL  69          1HG1      VAL  69   5.554   6.548  -1.220
  527   HG12  VAL  69          2HG1      VAL  69   5.897   5.576  -2.643
  528   HG13  VAL  69          3HG1      VAL  69   4.660   5.048  -1.506
  529   HG21  VAL  69          3HG2      VAL  69   2.444   8.013  -2.402
  530   HG22  VAL  69          1HG2      VAL  69   3.764   8.140  -1.240
  531   HG23  VAL  69          2HG2      VAL  69   2.658   6.769  -1.172
  532    H    SER  70           H        SER  70   3.785   9.768  -4.753
  533    HA   SER  70           HA       SER  70   4.891  11.416  -2.584
  534    HB2  SER  70           1HB      SER  70   6.058  11.650  -4.834
  535    HB3  SER  70           2HB      SER  70   4.556  12.343  -5.442
  536    HG   SER  70           HG       SER  70   6.293  13.801  -4.557
  537    H    ALA  71           H        ALA  71   2.193  10.567  -4.553
  538    HA   ALA  71           HA       ALA  71   0.554  12.800  -3.754
  539    HB1  ALA  71           1HB      ALA  71   0.141  11.694  -5.893
  540    HB2  ALA  71           2HB      ALA  71  -1.270  11.579  -4.843
  541    HB3  ALA  71           3HB      ALA  71  -0.211  10.185  -5.053
  542    H    MET  72           H        MET  72  -1.254  12.641  -2.315
  543    HA   MET  72           HA       MET  72  -0.974  10.450  -0.378
  544    HB2  MET  72           1HB      MET  72  -1.298  13.375   0.308
  545    HB3  MET  72           2HB      MET  72  -1.197  12.049   1.460
  546    HG2  MET  72           1HG      MET  72   0.974  12.873  -0.452
  547    HG3  MET  72           2HG      MET  72   0.908  13.269   1.265
  548    HE1  MET  72           3HE      MET  72   3.452  12.253   0.631
  549    HE2  MET  72           1HE      MET  72   3.043  11.356  -0.830
  550    HE3  MET  72           2HE      MET  72   3.764  10.521   0.547
  551    HA   PRO  73           HA       PRO  73  -1.805   9.138   0.492
  552    HB2  PRO  73           1HB      PRO  73  -3.571   7.143   0.772
  553    HB3  PRO  73           2HB      PRO  73  -3.423   8.440   1.959
  554    HG2  PRO  73           1HG      PRO  73  -5.521   7.970  -0.078
  555    HG3  PRO  73           2HG      PRO  73  -5.653   8.762   1.510
  556    HD2  PRO  73           1HD      PRO  73  -5.428  10.008  -1.032
  557    HD3  PRO  73           2HD      PRO  73  -5.339  10.794   0.555
  558    H    THR  74           H        THR  74  -1.210   6.952  -0.320
  559    HA   THR  74           HA       THR  74  -1.981   6.450  -3.113
  560    HB   THR  74           HB       THR  74   0.807   6.884  -2.055
  561    HG1  THR  74           1HG      THR  74   0.183   8.715  -2.978
  562   HG21  THR  74          3HG2      THR  74  -0.000   5.338  -4.517
  563   HG22  THR  74          1HG2      THR  74   1.093   4.850  -3.216
  564   HG23  THR  74          2HG2      THR  74   1.582   6.111  -4.348
  565    H    LEU  75           H        LEU  75  -2.138   4.395  -3.664
  566    HA   LEU  75           HA       LEU  75  -1.341   2.334  -1.711
  567    HB2  LEU  75           1HB      LEU  75  -3.303   2.190  -3.997
  568    HB3  LEU  75           2HB      LEU  75  -2.964   0.904  -2.856
  569    HG   LEU  75           HG       LEU  75  -3.757   2.880  -1.171
  570   HD11  LEU  75          1HD1      LEU  75  -5.499   3.157  -3.643
  571   HD12  LEU  75          2HD1      LEU  75  -4.329   4.362  -3.100
  572   HD13  LEU  75          3HD1      LEU  75  -5.721   3.967  -2.091
  573   HD21  LEU  75          3HD2      LEU  75  -5.966   1.676  -1.248
  574   HD22  LEU  75          1HD2      LEU  75  -4.536   0.666  -1.028
  575   HD23  LEU  75          2HD2      LEU  75  -5.316   0.758  -2.605
  576    H    LEU  76           H        LEU  76   0.316   1.021  -2.300
  577    HA   LEU  76           HA       LEU  76   0.915   0.800  -5.176
  578    HB2  LEU  76           1HB      LEU  76   2.624   1.564  -2.960
  579    HB3  LEU  76           2HB      LEU  76   3.262   0.170  -3.809
  580    HG   LEU  76           HG       LEU  76   2.539   2.798  -5.116
  581   HD11  LEU  76          1HD1      LEU  76   5.241   1.653  -4.418
  582   HD12  LEU  76          2HD1      LEU  76   4.471   3.037  -3.646
  583   HD13  LEU  76          3HD1      LEU  76   4.962   3.135  -5.346
  584   HD21  LEU  76          3HD2      LEU  76   2.328   0.810  -6.568
  585   HD22  LEU  76          1HD2      LEU  76   4.006   0.406  -6.221
  586   HD23  LEU  76          2HD2      LEU  76   3.619   1.896  -7.080
  587    H    LEU  77           H        LEU  77   0.388  -1.118  -5.886
  588    HA   LEU  77           HA       LEU  77   0.522  -3.454  -4.109
  589    HB2  LEU  77           1HB      LEU  77  -0.793  -2.951  -6.777
  590    HB3  LEU  77           2HB      LEU  77  -0.624  -4.558  -6.114
  591    HG   LEU  77           HG       LEU  77  -2.318  -4.261  -4.583
  592   HD11  LEU  77          1HD1      LEU  77  -3.079  -2.124  -3.693
  593   HD12  LEU  77          2HD1      LEU  77  -1.920  -1.266  -4.710
  594   HD13  LEU  77          3HD1      LEU  77  -1.349  -2.321  -3.417
  595   HD21  LEU  77          3HD2      LEU  77  -4.134  -3.140  -5.703
  596   HD22  LEU  77          1HD2      LEU  77  -3.139  -4.021  -6.869
  597   HD23  LEU  77          2HD2      LEU  77  -2.996  -2.262  -6.727
  598    H    PHE  78           H        PHE  78   2.069  -4.969  -4.396
  599    HA   PHE  78           HA       PHE  78   3.566  -4.950  -6.928
  600    HB2  PHE  78           1HB      PHE  78   4.660  -5.030  -4.133
  601    HB3  PHE  78           2HB      PHE  78   5.571  -5.658  -5.499
  602    HD1  PHE  78           1HD      PHE  78   4.022  -2.594  -4.110
  603    HD2  PHE  78           2HD      PHE  78   6.753  -4.232  -6.931
  604    HE1  PHE  78           1HE      PHE  78   4.896  -0.348  -4.578
  605    HE2  PHE  78           2HE      PHE  78   7.623  -1.983  -7.402
  606    HZ   PHE  78           HZ       PHE  78   6.696  -0.035  -6.222
  607    H    LYS  79           H        LYS  79   4.509  -6.991  -7.542
  608    HA   LYS  79           HA       LYS  79   3.834  -9.264  -5.800
  609    HB2  LYS  79           1HB      LYS  79   2.145  -8.868  -7.734
  610    HB3  LYS  79           2HB      LYS  79   3.432  -9.448  -8.777
  611    HG2  LYS  79           1HG      LYS  79   3.408 -11.588  -7.780
  612    HG3  LYS  79           2HG      LYS  79   2.397 -11.030  -6.443
  613    HD2  LYS  79           1HD      LYS  79   0.574 -10.582  -8.040
  614    HD3  LYS  79           2HD      LYS  79   1.582 -11.207  -9.345
  615    HE2  LYS  79           1HE      LYS  79   0.729 -12.781  -6.921
  616    HE3  LYS  79           2HE      LYS  79  -0.071 -12.846  -8.490
  617    HZ1  LYS  79           3HZ      LYS  79   2.005 -13.650  -9.457
  618    HZ2  LYS  79           1HZ      LYS  79   1.465 -14.675  -8.224
  619    HZ3  LYS  79           2HZ      LYS  79   2.743 -13.609  -7.940
  620    H    ASN  80           H        ASN  80   5.599 -10.418  -5.452
  621    HA   ASN  80           HA       ASN  80   7.736 -11.106  -5.481
  622    HB2  ASN  80           1HB      ASN  80   8.490 -12.222  -7.603
  623    HB3  ASN  80           2HB      ASN  80   6.979 -12.802  -6.928
  624   HD21  ASN  80          1HD2      ASN  80   5.112 -12.547  -8.083
  625   HD22  ASN  80          2HD2      ASN  80   5.078 -12.008  -9.724
  626    H    GLY  81           H        GLY  81   7.935  -8.486  -5.393
  627    HA2  GLY  81           1HA      GLY  81   9.777  -7.070  -5.425
  628    HA3  GLY  81           2HA      GLY  81  10.569  -8.183  -6.536
  629    H    LYS  82           H        LYS  82   7.662  -7.622  -7.910
  630    HA   LYS  82           HA       LYS  82   8.539  -5.142  -9.188
  631    HB2  LYS  82           1HB      LYS  82   7.763  -5.985 -11.341
  632    HB3  LYS  82           2HB      LYS  82   8.996  -7.040 -10.668
  633    HG2  LYS  82           1HG      LYS  82   7.300  -8.624  -9.960
  634    HG3  LYS  82           2HG      LYS  82   6.038  -7.562 -10.597
  635    HD2  LYS  82           1HD      LYS  82   7.052  -7.769 -12.842
  636    HD3  LYS  82           2HD      LYS  82   8.224  -8.908 -12.178
  637    HE2  LYS  82           1HE      LYS  82   6.427 -10.116 -13.249
  638    HE3  LYS  82           2HE      LYS  82   6.368 -10.383 -11.508
  639    HZ1  LYS  82           3HZ      LYS  82   4.175  -9.965 -12.442
  640    HZ2  LYS  82           1HZ      LYS  82   4.680  -8.454 -13.006
  641    HZ3  LYS  82           2HZ      LYS  82   4.604  -8.754 -11.345
  642    H    GLU  83           H        GLU  83   6.670  -3.996 -10.222
  643    HA   GLU  83           HA       GLU  83   4.662  -3.641  -8.276
  644    HB2  GLU  83           1HB      GLU  83   5.616  -1.941  -9.903
  645    HB3  GLU  83           2HB      GLU  83   4.608  -2.677 -11.137
  646    HG2  GLU  83           1HG      GLU  83   2.609  -2.048  -9.950
  647    HG3  GLU  83           2HG      GLU  83   3.572  -1.437  -8.600
  648    H    VAL  84           H        VAL  84   2.277  -3.574  -8.967
  649    HA   VAL  84           HA       VAL  84   1.550  -5.173 -11.262
  650    HB   VAL  84           HB       VAL  84  -0.423  -6.127  -9.864
  651   HG11  VAL  84          1HG1      VAL  84   2.325  -7.336  -9.592
  652   HG12  VAL  84          2HG1      VAL  84   1.292  -7.470 -11.017
  653   HG13  VAL  84          3HG1      VAL  84   0.781  -8.186  -9.488
  654   HG21  VAL  84          3HG2      VAL  84   0.229  -6.708  -7.581
  655   HG22  VAL  84          1HG2      VAL  84   0.105  -4.967  -7.822
  656   HG23  VAL  84          2HG2      VAL  84   1.689  -5.737  -7.767
  657    H    ALA  85           H        ALA  85   0.825  -2.840  -8.784
  658    HA   ALA  85           HA       ALA  85  -0.682  -1.274 -10.593
  659    HB1  ALA  85           1HB      ALA  85  -2.467  -2.807 -10.148
  660    HB2  ALA  85           2HB      ALA  85  -2.826  -1.284  -9.334
  661    HB3  ALA  85           3HB      ALA  85  -2.217  -2.657  -8.412
  662    H    LYS  86           H        LYS  86  -1.157   0.805  -9.820
  663    HA   LYS  86           HA       LYS  86  -0.516   1.421  -7.050
  664    HB2  LYS  86           1HB      LYS  86   0.920   3.336  -7.707
  665    HB3  LYS  86           2HB      LYS  86   1.621   1.778  -8.113
  666    HG2  LYS  86           1HG      LYS  86   1.032   2.062 -10.427
  667    HG3  LYS  86           2HG      LYS  86   0.174   3.559 -10.058
  668    HD2  LYS  86           1HD      LYS  86   2.255   4.597  -9.349
  669    HD3  LYS  86           2HD      LYS  86   3.125   3.090  -9.643
  670    HE2  LYS  86           1HE      LYS  86   3.412   4.698 -11.474
  671    HE3  LYS  86           2HE      LYS  86   2.615   3.222 -12.005
  672    HZ1  LYS  86           3HZ      LYS  86   0.497   4.357 -11.921
  673    HZ2  LYS  86           1HZ      LYS  86   1.566   5.204 -12.919
  674    HZ3  LYS  86           2HZ      LYS  86   1.236   5.773 -11.362
  675    H    VAL  87           H        VAL  87  -1.848   2.937  -6.236
  676    HA   VAL  87           HA       VAL  87  -3.533   4.431  -8.129
  677    HB   VAL  87           HB       VAL  87  -4.604   2.909  -5.746
  678   HG11  VAL  87          1HG1      VAL  87  -6.039   4.494  -7.871
  679   HG12  VAL  87          2HG1      VAL  87  -5.802   4.990  -6.196
  680   HG13  VAL  87          3HG1      VAL  87  -6.796   3.584  -6.566
  681   HG21  VAL  87          3HG2      VAL  87  -5.759   1.509  -7.406
  682   HG22  VAL  87          1HG2      VAL  87  -4.006   1.380  -7.536
  683   HG23  VAL  87          2HG2      VAL  87  -4.907   2.354  -8.696
  684    H    VAL  88           H        VAL  88  -3.822   6.502  -7.573
  685    HA   VAL  88           HA       VAL  88  -2.683   7.341  -5.008
  686    HB   VAL  88           HB       VAL  88  -2.628   9.626  -6.034
  687   HG11  VAL  88          1HG1      VAL  88  -0.731   9.143  -7.518
  688   HG12  VAL  88          2HG1      VAL  88  -1.186   7.439  -7.533
  689   HG13  VAL  88          3HG1      VAL  88  -0.657   8.197  -6.031
  690   HG21  VAL  88          3HG2      VAL  88  -4.407   9.323  -7.690
  691   HG22  VAL  88          1HG2      VAL  88  -3.415   8.142  -8.545
  692   HG23  VAL  88          2HG2      VAL  88  -2.901   9.828  -8.459
  693    H    GLY  89           H        GLY  89  -5.099   6.276  -4.561
  694    HA2  GLY  89           1HA      GLY  89  -6.535   8.187  -3.220
  695    HA3  GLY  89           2HA      GLY  89  -7.241   8.150  -4.828
  696    H    ALA  90           H        ALA  90  -7.785   7.114  -1.872
  697    HA   ALA  90           HA       ALA  90  -8.307   4.384  -2.020
  698    HB1  ALA  90           1HB      ALA  90  -9.621   4.668  -0.081
  699    HB2  ALA  90           2HB      ALA  90  -9.956   6.356  -0.482
  700    HB3  ALA  90           3HB      ALA  90  -8.334   5.878   0.005
  701    H    ASN  91           H        ASN  91  -9.528   3.410  -3.471
  702    HA   ASN  91           HA       ASN  91 -12.155   4.594  -4.057
  703    HB2  ASN  91           1HB      ASN  91 -10.286   4.083  -5.917
  704    HB3  ASN  91           2HB      ASN  91 -11.044   2.497  -5.837
  705   HD21  ASN  91          1HD2      ASN  91 -13.645   3.668  -5.076
  706   HD22  ASN  91          2HD2      ASN  91 -14.304   4.296  -6.547
  707    HA   PRO  92           HA       PRO  92 -13.085   1.591  -0.780
  708    HB2  PRO  92           1HB      PRO  92 -15.631   1.831  -2.334
  709    HB3  PRO  92           2HB      PRO  92 -15.382   1.799  -0.586
  710    HG2  PRO  92           1HG      PRO  92 -15.645   4.099  -2.109
  711    HG3  PRO  92           2HG      PRO  92 -14.919   4.020  -0.499
  712    HD2  PRO  92           1HD      PRO  92 -13.621   4.684  -2.927
  713    HD3  PRO  92           2HD      PRO  92 -12.859   4.420  -1.360
  714    H    ALA  93           H        ALA  93 -15.196   0.643  -3.459
  715    HA   ALA  93           HA       ALA  93 -14.433  -2.101  -2.936
  716    HB1  ALA  93           1HB      ALA  93 -16.791  -1.507  -3.159
  717    HB2  ALA  93           2HB      ALA  93 -16.302  -2.693  -4.369
  718    HB3  ALA  93           3HB      ALA  93 -16.506  -1.002  -4.824
  719    H    ALA  94           H        ALA  94 -13.969   0.275  -5.433
  720    HA   ALA  94           HA       ALA  94 -13.289  -1.434  -7.554
  721    HB1  ALA  94           1HB      ALA  94 -13.767   0.975  -7.808
  722    HB2  ALA  94           2HB      ALA  94 -12.254   0.497  -8.578
  723    HB3  ALA  94           3HB      ALA  94 -12.227   1.343  -7.030
  724    H    ILE  95           H        ILE  95 -11.353  -0.167  -4.879
  725    HA   ILE  95           HA       ILE  95  -8.956  -1.279  -6.040
  726    HB   ILE  95           HB       ILE  95  -9.281  -0.148  -3.266
  727   HG12  ILE  95          1HG1      ILE  95  -9.815   1.583  -4.852
  728   HG13  ILE  95          2HG1      ILE  95  -8.191   1.878  -4.250
  729   HG21  ILE  95          1HG2      ILE  95  -6.862   0.066  -3.333
  730   HG22  ILE  95          2HG2      ILE  95  -6.827  -0.637  -4.947
  731   HG23  ILE  95          3HG2      ILE  95  -7.346  -1.611  -3.569
  732   HD11  ILE  95          3HD1      ILE  95  -7.268   0.896  -6.292
  733   HD12  ILE  95          1HD1      ILE  95  -8.310   2.277  -6.633
  734   HD13  ILE  95          2HD1      ILE  95  -8.903   0.638  -6.898
  735    H    LYS  96           H        LYS  96 -11.300  -2.212  -3.559
  736    HA   LYS  96           HA       LYS  96  -9.946  -4.489  -2.620
  737    HB2  LYS  96           1HB      LYS  96 -12.919  -4.542  -3.156
  738    HB3  LYS  96           2HB      LYS  96 -12.005  -5.367  -1.885
  739    HG2  LYS  96           1HG      LYS  96 -11.737  -3.355  -0.676
  740    HG3  LYS  96           2HG      LYS  96 -12.369  -2.389  -2.004
  741    HD2  LYS  96           1HD      LYS  96 -14.068  -2.639  -0.303
  742    HD3  LYS  96           2HD      LYS  96 -14.546  -3.531  -1.746
  743    HE2  LYS  96           1HE      LYS  96 -13.731  -5.606  -0.704
  744    HE3  LYS  96           2HE      LYS  96 -13.323  -4.697   0.750
  745    HZ1  LYS  96           3HZ      LYS  96 -15.698  -4.067   0.900
  746    HZ2  LYS  96           1HZ      LYS  96 -15.441  -5.735   1.052
  747    HZ3  LYS  96           2HZ      LYS  96 -16.029  -5.095  -0.401
  748    H    GLN  97           H        GLN  97 -11.914  -3.892  -5.462
  749    HA   GLN  97           HA       GLN  97 -11.733  -6.468  -6.604
  750    HB2  GLN  97           1HB      GLN  97 -13.401  -4.827  -7.322
  751    HB3  GLN  97           2HB      GLN  97 -12.136  -3.757  -7.906
  752    HG2  GLN  97           1HG      GLN  97 -13.179  -4.912  -9.749
  753    HG3  GLN  97           2HG      GLN  97 -11.507  -5.443  -9.576
  754   HE21  GLN  97          1HE2      GLN  97 -11.078  -7.528  -8.875
  755   HE22  GLN  97          2HE2      GLN  97 -12.290  -8.763  -8.857
  756    H    ALA  98           H        ALA  98  -9.600  -3.684  -6.603
  757    HA   ALA  98           HA       ALA  98  -7.925  -4.443  -8.744
  758    HB1  ALA  98           1HB      ALA  98  -7.259  -2.823  -6.296
  759    HB2  ALA  98           2HB      ALA  98  -7.882  -2.194  -7.821
  760    HB3  ALA  98           3HB      ALA  98  -6.285  -2.937  -7.761
  761    H    ILE  99           H        ILE  99  -7.454  -4.762  -5.247
  762    HA   ILE  99           HA       ILE  99  -5.107  -6.190  -5.245
  763    HB   ILE  99           HB       ILE  99  -7.298  -6.884  -3.291
  764   HG12  ILE  99          1HG1      ILE  99  -7.491  -4.543  -3.289
  765   HG13  ILE  99          2HG1      ILE  99  -6.400  -4.898  -1.952
  766   HG21  ILE  99          1HG2      ILE  99  -5.245  -8.118  -3.081
  767   HG22  ILE  99          2HG2      ILE  99  -5.374  -6.981  -1.739
  768   HG23  ILE  99          3HG2      ILE  99  -4.307  -6.627  -3.095
  769   HD11  ILE  99          3HD1      ILE  99  -5.698  -3.868  -4.675
  770   HD12  ILE  99          1HD1      ILE  99  -4.509  -4.383  -3.471
  771   HD13  ILE  99          2HD1      ILE  99  -5.573  -3.018  -3.128
  772    H    ALA 100           H        ALA 100  -8.400  -7.349  -5.721
  773    HA   ALA 100           HA       ALA 100  -7.716 -10.131  -5.632
  774    HB1  ALA 100           1HB      ALA 100  -9.943  -9.325  -5.023
  775    HB2  ALA 100           2HB      ALA 100 -10.012 -10.516  -6.321
  776    HB3  ALA 100           3HB      ALA 100 -10.207  -8.802  -6.687
  777    H    ALA 101           H        ALA 101  -7.498  -7.703  -8.056
  778    HA   ALA 101           HA       ALA 101  -7.666  -9.601 -10.259
  779    HB1  ALA 101           1HB      ALA 101  -7.104  -6.635 -10.265
  780    HB2  ALA 101           2HB      ALA 101  -8.684  -7.383 -10.520
  781    HB3  ALA 101           3HB      ALA 101  -7.387  -7.641 -11.687
  782    H    ASN 102           H        ASN 102  -5.363  -7.648  -8.487
  783    HA   ASN 102           HA       ASN 102  -3.190  -8.432 -10.225
  784    HB2  ASN 102           1HB      ASN 102  -1.846  -7.112  -8.390
  785    HB3  ASN 102           2HB      ASN 102  -2.811  -6.295  -9.575
  786   HD21  ASN 102          1HD2      ASN 102  -4.453  -5.022  -8.981
  787   HD22  ASN 102          2HD2      ASN 102  -4.850  -4.729  -7.330
  788    H    ALA 103           H        ALA 103  -4.690  -9.735  -7.500
  789    HA   ALA 103           HA       ALA 103  -2.347 -11.205  -6.630
  790    HB1  ALA 103           1HB      ALA 103  -5.231 -11.513  -5.799
  791    HB2  ALA 103           2HB      ALA 103  -4.022 -10.532  -4.972
  792    HB3  ALA 103           3HB      ALA 103  -3.842 -12.285  -5.035
  Start of MODEL    5
    1    H1   MET   1           1H       MET   1  -6.630  -5.885   9.559
    2    H2   MET   1           2H       MET   1  -6.798  -6.033  11.230
    3    H3   MET   1           3H       MET   1  -5.632  -6.945  10.413
    4    HA   MET   1           HA       MET   1  -5.654  -3.994  10.644
    5    HB2  MET   1           1HB      MET   1  -3.892  -4.175  12.193
    6    HB3  MET   1           2HB      MET   1  -5.119  -5.303  12.738
    7    HG2  MET   1           1HG      MET   1  -3.875  -7.161  12.112
    8    HG3  MET   1           2HG      MET   1  -2.851  -6.225  11.023
    9    HE1  MET   1           3HE      MET   1  -0.998  -4.520  11.841
   10    HE2  MET   1           1HE      MET   1  -0.708  -4.136  13.538
   11    HE3  MET   1           2HE      MET   1  -2.238  -3.690  12.778
   12    H    VAL   2           H        VAL   2  -3.586  -3.064   9.949
   13    HA   VAL   2           HA       VAL   2  -2.312  -4.617   7.803
   14    HB   VAL   2           HB       VAL   2  -3.115  -1.710   7.858
   15   HG11  VAL   2          1HG1      VAL   2  -1.982  -1.471   5.697
   16   HG12  VAL   2          2HG1      VAL   2  -1.342  -3.107   5.856
   17   HG13  VAL   2          3HG1      VAL   2  -0.841  -1.852   6.987
   18   HG21  VAL   2          3HG2      VAL   2  -4.357  -2.260   5.874
   19   HG22  VAL   2          1HG2      VAL   2  -4.807  -3.359   7.173
   20   HG23  VAL   2          2HG2      VAL   2  -3.730  -3.902   5.889
   21    H    THR   3           H        THR   3  -0.139  -4.709   7.834
   22    HA   THR   3           HA       THR   3   1.079  -4.153  10.349
   23    HB   THR   3           HB       THR   3   2.437  -5.169   7.850
   24    HG1  THR   3           1HG      THR   3   1.273  -6.805   9.853
   25   HG21  THR   3          3HG2      THR   3   3.943  -4.589   9.699
   26   HG22  THR   3          1HG2      THR   3   3.895  -6.333   9.442
   27   HG23  THR   3          2HG2      THR   3   3.007  -5.616  10.786
   28    H    GLN   4           H        GLN   4   2.803  -2.882  10.854
   29    HA   GLN   4           HA       GLN   4   3.007  -0.414   9.312
   30    HB2  GLN   4           1HB      GLN   4   2.552  -0.525  11.790
   31    HB3  GLN   4           2HB      GLN   4   4.199  -1.100  12.005
   32    HG2  GLN   4           1HG      GLN   4   4.128   1.244  12.460
   33    HG3  GLN   4           2HG      GLN   4   5.011   0.988  10.953
   34   HE21  GLN   4          1HE2      GLN   4   4.081   1.606   9.016
   35   HE22  GLN   4          2HE2      GLN   4   2.712   2.651   8.940
   36    H    PHE   5           H        PHE   5   4.628  -0.156   7.895
   37    HA   PHE   5           HA       PHE   5   7.026  -1.700   7.868
   38    HB2  PHE   5           1HB      PHE   5   6.136   0.807   6.486
   39    HB3  PHE   5           2HB      PHE   5   7.815   0.296   6.389
   40    HD1  PHE   5           2HD      PHE   5   7.115  -2.738   6.323
   41    HD2  PHE   5           1HD      PHE   5   5.696   0.645   4.166
   42    HE1  PHE   5           2HE      PHE   5   6.569  -4.185   4.417
   43    HE2  PHE   5           1HE      PHE   5   5.148  -0.801   2.256
   44    HZ   PHE   5           HZ       PHE   5   5.586  -3.219   2.377
   45    H    LYS   6           H        LYS   6   9.212  -0.613   7.948
   46    HA   LYS   6           HA       LYS   6   9.297   1.375  10.100
   47    HB2  LYS   6           1HB      LYS   6  11.397  -0.757   9.839
   48    HB3  LYS   6           2HB      LYS   6  11.021   0.250  11.229
   49    HG2  LYS   6           1HG      LYS   6   8.831  -0.959  11.392
   50    HG3  LYS   6           2HG      LYS   6   9.438  -2.067  10.163
   51    HD2  LYS   6           1HD      LYS   6   9.859  -3.090  12.260
   52    HD3  LYS   6           2HD      LYS   6  11.412  -2.483  11.678
   53    HE2  LYS   6           1HE      LYS   6  11.102  -2.002  14.054
   54    HE3  LYS   6           2HE      LYS   6  11.191  -0.518  13.107
   55    HZ1  LYS   6           3HZ      LYS   6   8.655  -1.790  13.983
   56    HZ2  LYS   6           1HZ      LYS   6   8.827  -0.285  13.227
   57    HZ3  LYS   6           2HZ      LYS   6   9.412  -0.514  14.795
   58    H    THR   7           H        THR   7  10.899  -0.012   7.285
   59    HA   THR   7           HA       THR   7  12.049   2.616   6.720
   60    HB   THR   7           HB       THR   7  14.221   1.668   6.064
   61    HG1  THR   7           1HG      THR   7  13.307  -0.745   7.289
   62   HG21  THR   7          3HG2      THR   7  13.466   1.055   8.922
   63   HG22  THR   7          1HG2      THR   7  14.093   2.580   8.300
   64   HG23  THR   7          2HG2      THR   7  15.119   1.146   8.312
   65    H    ALA   8           H        ALA   8  13.184   2.434   4.419
   66    HA   ALA   8           HA       ALA   8  11.276   1.540   2.532
   67    HB1  ALA   8           1HB      ALA   8  13.078   1.953   0.861
   68    HB2  ALA   8           2HB      ALA   8  14.162   2.326   2.200
   69    HB3  ALA   8           3HB      ALA   8  12.734   3.322   1.912
   70    H    SER   9           H        SER   9  14.031   0.091   4.053
   71    HA   SER   9           HA       SER   9  14.487  -2.112   2.420
   72    HB2  SER   9           1HB      SER   9  14.587  -2.130   5.443
   73    HB3  SER   9           2HB      SER   9  15.551  -3.097   4.327
   74    HG   SER   9           HG       SER   9  16.063  -0.658   5.304
   75    H    GLU  10           H        GLU  10  12.307  -1.786   5.226
   76    HA   GLU  10           HA       GLU  10  11.011  -4.200   5.092
   77    HB2  GLU  10           1HB      GLU  10  10.198  -1.465   5.972
   78    HB3  GLU  10           2HB      GLU  10   9.019  -2.766   5.962
   79    HG2  GLU  10           1HG      GLU  10  10.023  -2.515   8.132
   80    HG3  GLU  10           2HG      GLU  10  10.424  -4.074   7.432
   81    H    PHE  11           H        PHE  11  10.303  -1.210   3.244
   82    HA   PHE  11           HA       PHE  11   7.926  -2.135   2.074
   83    HB2  PHE  11           1HB      PHE  11   8.753   0.229   1.953
   84    HB3  PHE  11           2HB      PHE  11   9.944  -0.285   0.762
   85    HD1  PHE  11           1HD      PHE  11   9.001  -1.431  -1.369
   86    HD2  PHE  11           2HD      PHE  11   6.666   0.974   1.251
   87    HE1  PHE  11           1HE      PHE  11   7.375  -1.053  -3.169
   88    HE2  PHE  11           2HE      PHE  11   5.023   1.365  -0.563
   89    HZ   PHE  11           HZ       PHE  11   5.389   0.338  -2.765
   90    H    ASP  12           H        ASP  12  11.171  -2.115   0.667
   91    HA   ASP  12           HA       ASP  12  10.595  -3.594  -1.640
   92    HB2  ASP  12           1HB      ASP  12  12.641  -2.339  -1.476
   93    HB3  ASP  12           2HB      ASP  12  13.165  -3.272  -0.077
   94    H    SER  13           H        SER  13  11.584  -4.687   1.580
   95    HA   SER  13           HA       SER  13  12.048  -7.378   0.956
   96    HB2  SER  13           1HB      SER  13  12.692  -6.333   3.103
   97    HB3  SER  13           2HB      SER  13  10.990  -6.222   3.550
   98    HG   SER  13           HG       SER  13  12.535  -8.569   3.133
   99    H    ALA  14           H        ALA  14   9.068  -5.779   2.091
  100    HA   ALA  14           HA       ALA  14   7.458  -8.070   2.033
  101    HB1  ALA  14           1HB      ALA  14   5.551  -6.553   2.074
  102    HB2  ALA  14           2HB      ALA  14   6.607  -5.201   1.649
  103    HB3  ALA  14           3HB      ALA  14   6.801  -6.017   3.200
  104    H    ILE  15           H        ILE  15   8.407  -5.785  -0.430
  105    HA   ILE  15           HA       ILE  15   6.598  -6.440  -2.449
  106    HB   ILE  15           HB       ILE  15   9.474  -5.641  -2.779
  107   HG12  ILE  15          1HG1      ILE  15   8.516  -3.894  -1.550
  108   HG13  ILE  15          2HG1      ILE  15   8.391  -3.384  -3.229
  109   HG21  ILE  15          1HG2      ILE  15   7.254  -5.159  -4.718
  110   HG22  ILE  15          2HG2      ILE  15   8.259  -6.603  -4.777
  111   HG23  ILE  15          3HG2      ILE  15   8.992  -5.008  -4.970
  112   HD11  ILE  15          3HD1      ILE  15   6.054  -4.067  -3.267
  113   HD12  ILE  15          1HD1      ILE  15   6.359  -2.883  -1.998
  114   HD13  ILE  15          2HD1      ILE  15   6.177  -4.588  -1.587
  115    H    ALA  16           H        ALA  16   9.528  -8.011  -1.396
  116    HA   ALA  16           HA       ALA  16   9.860  -9.597  -3.757
  117    HB1  ALA  16           1HB      ALA  16  11.705 -10.632  -2.533
  118    HB2  ALA  16           2HB      ALA  16  11.201  -9.785  -1.070
  119    HB3  ALA  16           3HB      ALA  16  11.768  -8.872  -2.466
  120    H    GLN  17           H        GLN  17   7.419  -9.923  -1.789
  121    HA   GLN  17           HA       GLN  17   7.591 -12.713  -1.141
  122    HB2  GLN  17           1HB      GLN  17   5.393 -12.402  -0.249
  123    HB3  GLN  17           2HB      GLN  17   6.380 -11.045   0.234
  124    HG2  GLN  17           1HG      GLN  17   5.383  -9.736  -1.618
  125    HG3  GLN  17           2HG      GLN  17   4.313 -11.094  -1.949
  126   HE21  GLN  17          1HE2      GLN  17   5.309 -10.025   1.238
  127   HE22  GLN  17          2HE2      GLN  17   3.746  -9.520   1.759
  128    H    ASP  18           H        ASP  18   6.182 -14.332  -2.037
  129    HA   ASP  18           HA       ASP  18   5.781 -13.958  -4.894
  130    HB2  ASP  18           1HB      ASP  18   6.896 -16.003  -3.960
  131    HB3  ASP  18           2HB      ASP  18   5.361 -16.455  -3.230
  132    H    LYS  19           H        LYS  19   4.050 -12.451  -3.303
  133    HA   LYS  19           HA       LYS  19   1.513 -13.396  -4.298
  134    HB2  LYS  19           1HB      LYS  19   0.350 -13.088  -2.121
  135    HB3  LYS  19           2HB      LYS  19   1.447 -14.459  -2.144
  136    HG2  LYS  19           1HG      LYS  19   3.026 -13.350  -0.796
  137    HG3  LYS  19           2HG      LYS  19   2.243 -11.787  -1.031
  138    HD2  LYS  19           1HD      LYS  19   1.774 -12.717   1.190
  139    HD3  LYS  19           2HD      LYS  19   0.304 -12.546   0.229
  140    HE2  LYS  19           1HE      LYS  19   0.467 -14.945  -0.359
  141    HE3  LYS  19           2HE      LYS  19   1.861 -15.084   0.711
  142    HZ1  LYS  19           3HZ      LYS  19  -0.216 -15.788   1.760
  143    HZ2  LYS  19           1HZ      LYS  19  -0.851 -14.233   1.561
  144    HZ3  LYS  19           2HZ      LYS  19   0.485 -14.480   2.569
  145    H    LEU  20           H        LEU  20  -0.221 -11.655  -3.397
  146    HA   LEU  20           HA       LEU  20   0.677  -9.217  -4.599
  147    HB2  LEU  20           1HB      LEU  20  -1.628 -10.320  -4.792
  148    HB3  LEU  20           2HB      LEU  20  -1.953  -9.659  -3.201
  149    HG   LEU  20           HG       LEU  20  -2.884  -8.321  -5.103
  150   HD11  LEU  20          1HD1      LEU  20  -2.372  -7.320  -2.882
  151   HD12  LEU  20          2HD1      LEU  20  -2.309  -6.180  -4.225
  152   HD13  LEU  20          3HD1      LEU  20  -0.814  -6.806  -3.529
  153   HD21  LEU  20          3HD2      LEU  20  -1.370  -6.960  -6.428
  154   HD22  LEU  20          1HD2      LEU  20  -1.062  -8.679  -6.681
  155   HD23  LEU  20          2HD2      LEU  20   0.016  -7.730  -5.657
  156    H    VAL  21           H        VAL  21   1.629  -7.617  -3.592
  157    HA   VAL  21           HA       VAL  21   1.435  -7.383  -0.682
  158    HB   VAL  21           HB       VAL  21   3.071  -5.472  -2.254
  159   HG11  VAL  21          1HG1      VAL  21   4.639  -5.813  -0.395
  160   HG12  VAL  21          2HG1      VAL  21   3.551  -7.023   0.284
  161   HG13  VAL  21          3HG1      VAL  21   3.032  -5.342   0.157
  162   HG21  VAL  21          3HG2      VAL  21   3.671  -7.364  -3.510
  163   HG22  VAL  21          1HG2      VAL  21   3.705  -8.402  -2.080
  164   HG23  VAL  21          2HG2      VAL  21   4.946  -7.176  -2.306
  165    H    VAL  22           H        VAL  22  -0.143  -6.113   0.089
  166    HA   VAL  22           HA       VAL  22  -1.047  -3.833  -1.520
  167    HB   VAL  22           HB       VAL  22  -2.217  -4.950   1.040
  168   HG11  VAL  22          1HG1      VAL  22  -4.150  -3.532   0.519
  169   HG12  VAL  22          2HG1      VAL  22  -3.285  -2.867  -0.866
  170   HG13  VAL  22          3HG1      VAL  22  -2.689  -2.577   0.768
  171   HG21  VAL  22          3HG2      VAL  22  -4.026  -5.769  -0.429
  172   HG22  VAL  22          1HG2      VAL  22  -2.469  -6.528  -0.764
  173   HG23  VAL  22          2HG2      VAL  22  -3.080  -5.262  -1.832
  174    H    VAL  23           H        VAL  23   0.303  -2.163  -1.232
  175    HA   VAL  23           HA       VAL  23   1.185  -1.610   1.505
  176    HB   VAL  23           HB       VAL  23   2.344  -0.506  -1.051
  177   HG11  VAL  23          1HG1      VAL  23   2.744   1.011   0.706
  178   HG12  VAL  23          2HG1      VAL  23   4.225   0.069   0.538
  179   HG13  VAL  23          3HG1      VAL  23   3.099  -0.283   1.847
  180   HG21  VAL  23          3HG2      VAL  23   2.760  -2.887  -0.915
  181   HG22  VAL  23          1HG2      VAL  23   3.302  -2.718   0.756
  182   HG23  VAL  23          2HG2      VAL  23   4.246  -2.004  -0.554
  183    H    ALA  24           H        ALA  24   0.490   0.008   2.550
  184    HA   ALA  24           HA       ALA  24  -1.294   1.965   1.232
  185    HB1  ALA  24           1HB      ALA  24  -1.015   1.314   4.174
  186    HB2  ALA  24           2HB      ALA  24  -2.137   0.497   3.093
  187    HB3  ALA  24           3HB      ALA  24  -2.305   2.229   3.394
  188    H    PHE  25           H        PHE  25   0.117   3.662   0.647
  189    HA   PHE  25           HA       PHE  25   1.767   4.750   2.822
  190    HB2  PHE  25           1HB      PHE  25   2.074   4.672  -0.095
  191    HB3  PHE  25           2HB      PHE  25   2.509   6.210   0.651
  192    HD1  PHE  25           2HD      PHE  25   2.859   2.649   1.639
  193    HD2  PHE  25           1HD      PHE  25   4.776   6.378   0.979
  194    HE1  PHE  25           2HE      PHE  25   4.986   1.674   2.382
  195    HE2  PHE  25           1HE      PHE  25   6.910   5.419   1.730
  196    HZ   PHE  25           HZ       PHE  25   7.015   3.060   2.432
  197    H    TYR  26           H        TYR  26   1.142   6.434   3.879
  198    HA   TYR  26           HA       TYR  26  -0.354   8.566   2.607
  199    HB2  TYR  26           1HB      TYR  26  -2.128   8.520   4.355
  200    HB3  TYR  26           2HB      TYR  26  -2.168   7.109   3.306
  201    HD1  TYR  26           1HD      TYR  26  -1.422   4.918   4.154
  202    HD2  TYR  26           2HD      TYR  26  -1.676   8.307   6.710
  203    HE1  TYR  26           1HE      TYR  26  -1.341   3.438   6.105
  204    HE2  TYR  26           2HE      TYR  26  -1.586   6.835   8.677
  205    HH   TYR  26           HH       TYR  26  -0.553   3.760   8.617
  206    H    ALA  27           H        ALA  27  -0.547  10.451   4.102
  207    HA   ALA  27           HA       ALA  27   1.660  10.435   6.049
  208    HB1  ALA  27           1HB      ALA  27   1.881  12.821   5.670
  209    HB2  ALA  27           2HB      ALA  27   0.511  12.793   4.562
  210    HB3  ALA  27           3HB      ALA  27   2.000  11.949   4.141
  211    H    THR  28           H        THR  28   1.254  10.930   8.097
  212    HA   THR  28           HA       THR  28  -1.360  10.756   9.083
  213    HB   THR  28           HB       THR  28  -0.225  11.570  11.265
  214    HG1  THR  28           1HG      THR  28   2.196  10.836  10.072
  215   HG21  THR  28          3HG2      THR  28  -0.754   9.226  10.748
  216   HG22  THR  28          1HG2      THR  28   0.782   9.370  11.601
  217   HG23  THR  28          2HG2      THR  28   0.764   9.084   9.861
  218    H    TRP  29           H        TRP  29   0.492  13.558   8.154
  219    HA   TRP  29           HA       TRP  29  -1.271  15.375   9.547
  220    HB2  TRP  29           1HB      TRP  29   0.028  17.165   8.464
  221    HB3  TRP  29           2HB      TRP  29   1.070  16.015   9.288
  222    HD1  TRP  29           HD       TRP  29   2.895  14.820   7.865
  223    HE1  TRP  29           1HE      TRP  29   3.634  14.964   5.405
  224    HE3  TRP  29           3HE      TRP  29  -0.988  17.580   6.004
  225    HZ2  TRP  29           2HZ      TRP  29   2.700  16.096   3.000
  226    HZ3  TRP  29           3HZ      TRP  29  -0.985  18.152   3.614
  227    HH2  TRP  29           HH       TRP  29   0.824  17.428   2.144
  228    H    CYS  30           H        CYS  30  -1.299  13.703   6.608
  229    HA   CYS  30           HA       CYS  30  -2.635  15.673   5.015
  230    HB2  CYS  30           1HB      CYS  30  -1.262  13.918   3.987
  231    HB3  CYS  30           2HB      CYS  30  -2.343  12.685   4.622
  232    HG   CYS  30           HG       CYS  30  -2.920  14.896   2.091
  233    H    GLY  31           H        GLY  31  -4.844  15.539   4.270
  234    HA2  GLY  31           1HA      GLY  31  -6.637  15.126   6.428
  235    HA3  GLY  31           2HA      GLY  31  -7.078  15.551   4.784
  236    HA   PRO  32           HA       PRO  32  -8.868  11.674   4.168
  237    HB2  PRO  32           1HB      PRO  32  -8.342  11.036   1.607
  238    HB3  PRO  32           2HB      PRO  32  -9.353  12.417   2.051
  239    HG2  PRO  32           1HG      PRO  32  -6.475  12.360   1.233
  240    HG3  PRO  32           2HG      PRO  32  -7.753  13.489   0.751
  241    HD2  PRO  32           1HD      PRO  32  -5.895  14.048   2.669
  242    HD3  PRO  32           2HD      PRO  32  -7.523  14.751   2.649
  243    H    CYS  33           H        CYS  33  -5.820  11.540   4.930
  244    HA   CYS  33           HA       CYS  33  -4.883   9.069   3.896
  245    HB2  CYS  33           1HB      CYS  33  -3.348   9.084   5.836
  246    HB3  CYS  33           2HB      CYS  33  -3.369  10.637   5.008
  247    HG   CYS  33           HG       CYS  33  -4.111  12.082   7.012
  248    H    LYS  34           H        LYS  34  -7.078   9.991   6.375
  249    HA   LYS  34           HA       LYS  34  -7.161   7.560   7.805
  250    HB2  LYS  34           1HB      LYS  34  -9.254   8.436   8.769
  251    HB3  LYS  34           2HB      LYS  34  -7.943   9.603   8.829
  252    HG2  LYS  34           1HG      LYS  34  -8.878  10.783   6.917
  253    HG3  LYS  34           2HG      LYS  34 -10.174   9.591   6.805
  254    HD2  LYS  34           1HD      LYS  34 -10.957  10.223   9.031
  255    HD3  LYS  34           2HD      LYS  34  -9.648  11.398   9.165
  256    HE2  LYS  34           1HE      LYS  34 -11.714  12.511   8.559
  257    HE3  LYS  34           2HE      LYS  34 -10.560  12.610   7.233
  258    HZ1  LYS  34           3HZ      LYS  34 -12.805  12.071   6.479
  259    HZ2  LYS  34           1HZ      LYS  34 -12.788  10.659   7.407
  260    HZ3  LYS  34           2HZ      LYS  34 -11.716  10.833   6.113
  261    H    MET  35           H        MET  35  -8.215   8.251   4.655
  262    HA   MET  35           HA       MET  35 -10.450   6.384   4.794
  263    HB2  MET  35           1HB      MET  35 -10.403   8.362   3.178
  264    HB3  MET  35           2HB      MET  35  -9.194   7.448   2.264
  265    HG2  MET  35           1HG      MET  35 -10.764   5.614   1.992
  266    HG3  MET  35           2HG      MET  35 -11.974   6.489   2.924
  267    HE1  MET  35           3HE      MET  35 -12.229   5.134   0.055
  268    HE2  MET  35           1HE      MET  35 -13.154   6.311  -0.881
  269    HE3  MET  35           2HE      MET  35 -13.634   5.925   0.772
  270    H    ILE  36           H        ILE  36  -7.079   6.427   4.107
  271    HA   ILE  36           HA       ILE  36  -7.077   3.869   2.798
  272    HB   ILE  36           HB       ILE  36  -5.072   5.906   3.451
  273   HG12  ILE  36          1HG1      ILE  36  -4.326   5.366   1.195
  274   HG13  ILE  36          2HG1      ILE  36  -5.374   3.955   1.172
  275   HG21  ILE  36          1HG2      ILE  36  -4.278   3.010   3.279
  276   HG22  ILE  36          2HG2      ILE  36  -4.037   4.091   4.650
  277   HG23  ILE  36          3HG2      ILE  36  -3.167   4.371   3.142
  278   HD11  ILE  36          3HD1      ILE  36  -6.239   6.826   1.288
  279   HD12  ILE  36          1HD1      ILE  36  -7.324   5.443   1.416
  280   HD13  ILE  36          2HD1      ILE  36  -6.404   5.712  -0.070
  281    H    ALA  37           H        ALA  37  -6.775   5.096   6.022
  282    HA   ALA  37           HA       ALA  37  -5.764   2.871   7.302
  283    HB1  ALA  37           1HB      ALA  37  -6.396   5.102   8.332
  284    HB2  ALA  37           2HB      ALA  37  -6.697   3.661   9.303
  285    HB3  ALA  37           3HB      ALA  37  -8.031   4.458   8.477
  286    HA   PRO  38           HA       PRO  38  -9.886   0.695   7.726
  287    HB2  PRO  38           1HB      PRO  38 -12.168   2.020   6.659
  288    HB3  PRO  38           2HB      PRO  38 -11.719   1.850   8.356
  289    HG2  PRO  38           1HG      PRO  38 -11.768   4.241   6.956
  290    HG3  PRO  38           2HG      PRO  38 -10.868   3.954   8.456
  291    HD2  PRO  38           1HD      PRO  38  -9.900   3.898   5.622
  292    HD3  PRO  38           2HD      PRO  38  -9.111   4.563   7.065
  293    H    MET  39           H        MET  39  -9.886   2.354   4.552
  294    HA   MET  39           HA       MET  39 -11.461   0.371   3.237
  295    HB2  MET  39           1HB      MET  39 -11.256   2.538   2.186
  296    HB3  MET  39           2HB      MET  39  -9.511   2.460   2.282
  297    HG2  MET  39           1HG      MET  39  -9.920   0.312   0.774
  298    HG3  MET  39           2HG      MET  39 -11.351   1.245   0.337
  299    HE1  MET  39           3HE      MET  39  -8.215   3.291   1.457
  300    HE2  MET  39           1HE      MET  39  -7.162   3.131   0.055
  301    HE3  MET  39           2HE      MET  39  -7.532   1.714   1.054
  302    H    ILE  40           H        ILE  40  -8.021   0.900   3.658
  303    HA   ILE  40           HA       ILE  40  -7.226  -1.286   2.008
  304    HB   ILE  40           HB       ILE  40  -6.016   0.888   3.425
  305   HG12  ILE  40          1HG1      ILE  40  -4.690  -0.859   1.380
  306   HG13  ILE  40          2HG1      ILE  40  -6.030   0.199   0.949
  307   HG21  ILE  40          1HG2      ILE  40  -3.854  -0.148   3.969
  308   HG22  ILE  40          2HG2      ILE  40  -4.549  -1.738   3.651
  309   HG23  ILE  40          3HG2      ILE  40  -5.161  -0.758   4.984
  310   HD11  ILE  40          3HD1      ILE  40  -3.633   1.044   0.643
  311   HD12  ILE  40          1HD1      ILE  40  -3.651   1.264   2.389
  312   HD13  ILE  40          2HD1      ILE  40  -4.821   2.114   1.384
  313    H    GLU  41           H        GLU  41  -7.619  -0.794   5.511
  314    HA   GLU  41           HA       GLU  41  -6.821  -3.402   6.254
  315    HB2  GLU  41           1HB      GLU  41  -8.680  -1.387   7.486
  316    HB3  GLU  41           2HB      GLU  41  -8.541  -3.001   8.164
  317    HG2  GLU  41           1HG      GLU  41  -6.140  -2.654   8.481
  318    HG3  GLU  41           2HG      GLU  41  -6.300  -1.024   7.830
  319    H    LYS  42           H        LYS  42  -9.720  -2.142   4.810
  320    HA   LYS  42           HA       LYS  42 -11.363  -4.381   5.435
  321    HB2  LYS  42           1HB      LYS  42 -12.264  -2.112   5.085
  322    HB3  LYS  42           2HB      LYS  42 -11.813  -2.199   3.386
  323    HG2  LYS  42           1HG      LYS  42 -13.353  -4.028   3.041
  324    HG3  LYS  42           2HG      LYS  42 -13.730  -4.073   4.764
  325    HD2  LYS  42           1HD      LYS  42 -14.522  -1.691   4.530
  326    HD3  LYS  42           2HD      LYS  42 -14.380  -1.902   2.784
  327    HE2  LYS  42           1HE      LYS  42 -16.663  -2.307   3.512
  328    HE3  LYS  42           2HE      LYS  42 -15.935  -3.787   2.888
  329    HZ1  LYS  42           3HZ      LYS  42 -16.250  -3.072   5.754
  330    HZ2  LYS  42           1HZ      LYS  42 -15.501  -4.478   5.182
  331    HZ3  LYS  42           2HZ      LYS  42 -17.152  -4.227   4.911
  332    H    PHE  43           H        PHE  43  -9.285  -3.512   2.749
  333    HA   PHE  43           HA       PHE  43 -10.171  -5.354   0.845
  334    HB2  PHE  43           1HB      PHE  43  -7.310  -4.517   1.422
  335    HB3  PHE  43           2HB      PHE  43  -7.846  -5.360  -0.043
  336    HD1  PHE  43           1HD      PHE  43 -10.488  -3.775  -0.261
  337    HD2  PHE  43           2HD      PHE  43  -6.438  -2.623   0.318
  338    HE1  PHE  43           1HE      PHE  43 -10.958  -1.614  -1.328
  339    HE2  PHE  43           2HE      PHE  43  -6.902  -0.458  -0.746
  340    HZ   PHE  43           HZ       PHE  43  -9.163   0.050  -1.566
  341    H    SER  44           H        SER  44  -7.584  -5.841   3.319
  342    HA   SER  44           HA       SER  44  -7.487  -8.647   2.692
  343    HB2  SER  44           1HB      SER  44  -5.852  -8.775   4.500
  344    HB3  SER  44           2HB      SER  44  -5.468  -7.478   3.377
  345    HG   SER  44           HG       SER  44  -5.254  -6.574   5.354
  346    H    GLU  45           H        GLU  45  -9.376  -6.670   4.723
  347    HA   GLU  45           HA       GLU  45 -10.251  -8.500   6.661
  348    HB2  GLU  45           1HB      GLU  45 -10.848  -6.117   6.690
  349    HB3  GLU  45           2HB      GLU  45 -11.792  -6.326   5.224
  350    HG2  GLU  45           1HG      GLU  45 -13.272  -7.880   6.469
  351    HG3  GLU  45           2HG      GLU  45 -12.375  -7.484   7.935
  352    H    GLN  46           H        GLN  46 -11.009  -8.087   3.273
  353    HA   GLN  46           HA       GLN  46 -12.979 -10.207   3.301
  354    HB2  GLN  46           1HB      GLN  46 -11.785  -8.645   1.001
  355    HB3  GLN  46           2HB      GLN  46 -13.117  -9.787   0.870
  356    HG2  GLN  46           1HG      GLN  46 -13.146  -7.234   2.464
  357    HG3  GLN  46           2HG      GLN  46 -13.883  -7.469   0.880
  358   HE21  GLN  46          1HE2      GLN  46 -14.778 -10.166   1.485
  359   HE22  GLN  46          2HE2      GLN  46 -16.125  -9.997   2.556
  360    H    TYR  47           H        TYR  47  -9.743  -9.589   1.996
  361    HA   TYR  47           HA       TYR  47  -9.361 -12.488   1.772
  362    HB2  TYR  47           1HB      TYR  47  -7.874 -11.838  -0.259
  363    HB3  TYR  47           2HB      TYR  47  -9.618 -11.936  -0.445
  364    HD1  TYR  47           2HD      TYR  47  -6.860  -9.485   0.138
  365    HD2  TYR  47           1HD      TYR  47 -10.830 -10.149  -1.248
  366    HE1  TYR  47           2HE      TYR  47  -6.938  -7.184  -0.745
  367    HE2  TYR  47           1HE      TYR  47 -10.920  -7.851  -2.112
  368    HH   TYR  47           HH       TYR  47  -8.199  -5.899  -2.434
  369    HA   PRO  48           HA       PRO  48  -5.908 -10.892   4.320
  370    HB2  PRO  48           1HB      PRO  48  -5.655 -13.087   5.859
  371    HB3  PRO  48           2HB      PRO  48  -6.872 -11.848   6.176
  372    HG2  PRO  48           1HG      PRO  48  -7.181 -14.487   4.791
  373    HG3  PRO  48           2HG      PRO  48  -8.235 -13.729   5.999
  374    HD2  PRO  48           1HD      PRO  48  -8.765 -13.661   3.337
  375    HD3  PRO  48           2HD      PRO  48  -9.243 -12.358   4.443
  376    H    GLN  49           H        GLN  49  -6.271 -13.242   1.989
  377    HA   GLN  49           HA       GLN  49  -3.827 -14.601   2.141
  378    HB2  GLN  49           1HB      GLN  49  -4.222 -15.130  -0.275
  379    HB3  GLN  49           2HB      GLN  49  -5.494 -15.604   0.832
  380    HG2  GLN  49           1HG      GLN  49  -6.769 -14.661  -0.732
  381    HG3  GLN  49           2HG      GLN  49  -6.352 -13.222   0.190
  382   HE21  GLN  49          1HE2      GLN  49  -5.128 -11.642  -0.748
  383   HE22  GLN  49          2HE2      GLN  49  -4.620 -11.679  -2.398
  384    H    ALA  50           H        ALA  50  -4.439 -11.410   1.429
  385    HA   ALA  50           HA       ALA  50  -1.968 -11.095  -0.145
  386    HB1  ALA  50           1HB      ALA  50  -4.143  -9.106   0.520
  387    HB2  ALA  50           2HB      ALA  50  -3.933  -9.940  -1.021
  388    HB3  ALA  50           3HB      ALA  50  -2.723  -8.778  -0.472
  389    H    ASP  51           H        ASP  51  -0.373  -9.523   0.598
  390    HA   ASP  51           HA       ASP  51  -0.292  -9.501   3.504
  391    HB2  ASP  51           1HB      ASP  51   1.777  -9.277   1.396
  392    HB3  ASP  51           2HB      ASP  51   2.064  -8.383   2.879
  393    H    PHE  52           H        PHE  52  -0.605  -7.844   4.696
  394    HA   PHE  52           HA       PHE  52  -1.321  -5.333   3.383
  395    HB2  PHE  52           1HB      PHE  52  -2.324  -5.034   5.831
  396    HB3  PHE  52           2HB      PHE  52  -3.190  -5.909   4.576
  397    HD1  PHE  52           1HD      PHE  52  -1.081  -6.294   7.589
  398    HD2  PHE  52           2HD      PHE  52  -3.640  -8.221   4.792
  399    HE1  PHE  52           1HE      PHE  52  -1.167  -8.276   9.040
  400    HE2  PHE  52           2HE      PHE  52  -3.731 -10.208   6.238
  401    HZ   PHE  52           HZ       PHE  52  -2.494 -10.238   8.366
  402    H    TYR  53           H        TYR  53   0.164  -3.766   3.469
  403    HA   TYR  53           HA       TYR  53   1.500  -3.307   6.031
  404    HB2  TYR  53           1HB      TYR  53   2.928  -3.407   3.363
  405    HB3  TYR  53           2HB      TYR  53   3.631  -2.805   4.856
  406    HD1  TYR  53           2HD      TYR  53   3.988  -4.404   6.761
  407    HD2  TYR  53           1HD      TYR  53   2.926  -5.714   2.857
  408    HE1  TYR  53           2HE      TYR  53   4.784  -6.662   7.309
  409    HE2  TYR  53           1HE      TYR  53   3.730  -7.978   3.388
  410    HH   TYR  53           HH       TYR  53   5.322  -9.037   4.981
  411    H    LYS  54           H        LYS  54   2.253  -1.182   6.354
  412    HA   LYS  54           HA       LYS  54   1.348   0.844   4.474
  413    HB2  LYS  54           1HB      LYS  54  -0.144   1.900   6.019
  414    HB3  LYS  54           2HB      LYS  54  -0.592   0.203   5.892
  415    HG2  LYS  54           1HG      LYS  54   0.595  -0.242   8.004
  416    HG3  LYS  54           2HG      LYS  54   0.922   1.488   8.151
  417    HD2  LYS  54           1HD      LYS  54  -1.473   1.951   8.169
  418    HD3  LYS  54           2HD      LYS  54  -1.816   0.230   7.981
  419    HE2  LYS  54           1HE      LYS  54  -0.693  -0.198  10.131
  420    HE3  LYS  54           2HE      LYS  54  -0.433   1.537  10.320
  421    HZ1  LYS  54           3HZ      LYS  54  -3.076   0.199  10.113
  422    HZ2  LYS  54           1HZ      LYS  54  -2.826   1.859  10.312
  423    HZ3  LYS  54           2HZ      LYS  54  -2.380   0.784  11.538
  424    H    LEU  55           H        LEU  55   2.040   3.034   5.109
  425    HA   LEU  55           HA       LEU  55   3.909   3.297   7.284
  426    HB2  LEU  55           1HB      LEU  55   5.319   2.270   5.602
  427    HB3  LEU  55           2HB      LEU  55   4.799   3.434   4.405
  428    HG   LEU  55           HG       LEU  55   6.166   4.483   6.836
  429   HD11  LEU  55          1HD1      LEU  55   7.599   2.632   6.304
  430   HD12  LEU  55          2HD1      LEU  55   8.354   4.104   5.687
  431   HD13  LEU  55          3HD1      LEU  55   7.522   3.008   4.585
  432   HD21  LEU  55          3HD2      LEU  55   6.880   6.167   5.341
  433   HD22  LEU  55          1HD2      LEU  55   5.190   5.846   4.946
  434   HD23  LEU  55          2HD2      LEU  55   6.476   5.188   3.931
  435    H    ASP  56           H        ASP  56   4.443   5.471   7.708
  436    HA   ASP  56           HA       ASP  56   2.544   7.379   6.556
  437    HB2  ASP  56           1HB      ASP  56   2.446   7.226   8.948
  438    HB3  ASP  56           2HB      ASP  56   4.190   7.404   9.088
  439    H    VAL  57           H        VAL  57   3.202   8.751   5.069
  440    HA   VAL  57           HA       VAL  57   5.872   8.926   4.154
  441    HB   VAL  57           HB       VAL  57   3.645  10.903   3.624
  442   HG11  VAL  57          1HG1      VAL  57   5.828  11.669   2.885
  443   HG12  VAL  57          2HG1      VAL  57   4.805  11.279   1.502
  444   HG13  VAL  57          3HG1      VAL  57   6.075  10.161   2.003
  445   HG21  VAL  57          3HG2      VAL  57   2.819   8.682   3.166
  446   HG22  VAL  57          1HG2      VAL  57   4.263   8.306   2.224
  447   HG23  VAL  57          2HG2      VAL  57   3.125   9.523   1.646
  448    H    ASP  58           H        ASP  58   4.062  10.731   6.524
  449    HA   ASP  58           HA       ASP  58   5.715  13.040   6.636
  450    HB2  ASP  58           1HB      ASP  58   3.509  13.068   7.644
  451    HB3  ASP  58           2HB      ASP  58   3.952  11.763   8.735
  452    H    GLU  59           H        GLU  59   5.818   9.883   8.097
  453    HA   GLU  59           HA       GLU  59   7.992  10.518   9.877
  454    HB2  GLU  59           1HB      GLU  59   6.218   8.869  10.441
  455    HB3  GLU  59           2HB      GLU  59   6.788   7.843   9.136
  456    HG2  GLU  59           1HG      GLU  59   8.927   7.574  10.264
  457    HG3  GLU  59           2HG      GLU  59   8.382   8.635  11.562
  458    H    LEU  60           H        LEU  60   7.536   8.738   6.842
  459    HA   LEU  60           HA       LEU  60  10.444   8.849   6.448
  460    HB2  LEU  60           1HB      LEU  60   8.679   6.445   6.026
  461    HB3  LEU  60           2HB      LEU  60  10.344   6.554   5.492
  462    HG   LEU  60           HG       LEU  60   9.522   6.826   8.380
  463   HD11  LEU  60          1HD1      LEU  60   8.880   4.627   7.604
  464   HD12  LEU  60          2HD1      LEU  60  10.300   4.514   8.644
  465   HD13  LEU  60          3HD1      LEU  60  10.475   4.387   6.894
  466   HD21  LEU  60          3HD2      LEU  60  11.888   6.359   8.796
  467   HD22  LEU  60          1HD2      LEU  60  11.680   7.808   7.813
  468   HD23  LEU  60          2HD2      LEU  60  12.182   6.296   7.059
  469    H    GLY  61           H        GLY  61  10.068  10.600   5.052
  470    HA2  GLY  61           1HA      GLY  61   8.323  10.385   2.790
  471    HA3  GLY  61           2HA      GLY  61   9.484  11.667   3.094
  472    H    ASP  62           H        ASP  62  11.752   9.868   3.344
  473    HA   ASP  62           HA       ASP  62  12.518   9.768   0.622
  474    HB2  ASP  62           1HB      ASP  62  14.153  10.094   2.425
  475    HB3  ASP  62           2HB      ASP  62  13.823   8.470   3.012
  476    H    VAL  63           H        VAL  63  11.267   7.425   2.856
  477    HA   VAL  63           HA       VAL  63  11.567   5.118   1.242
  478    HB   VAL  63           HB       VAL  63   9.453   5.764   3.297
  479   HG11  VAL  63          1HG1      VAL  63   9.076   3.313   3.352
  480   HG12  VAL  63          2HG1      VAL  63  10.139   3.150   1.956
  481   HG13  VAL  63          3HG1      VAL  63   8.629   4.049   1.816
  482   HG21  VAL  63          3HG2      VAL  63  11.846   5.639   4.078
  483   HG22  VAL  63          1HG2      VAL  63  11.846   3.952   3.560
  484   HG23  VAL  63          2HG2      VAL  63  10.750   4.481   4.834
  485    H    ALA  64           H        ALA  64   8.770   7.337   1.653
  486    HA   ALA  64           HA       ALA  64   7.115   6.286  -0.277
  487    HB1  ALA  64           1HB      ALA  64   6.460   8.108   1.198
  488    HB2  ALA  64           2HB      ALA  64   6.162   8.529  -0.490
  489    HB3  ALA  64           3HB      ALA  64   7.558   9.200   0.353
  490    H    GLN  65           H        GLN  65   9.871   8.431  -0.670
  491    HA   GLN  65           HA       GLN  65   9.517   8.865  -3.472
  492    HB2  GLN  65           1HB      GLN  65  11.986   9.125  -1.746
  493    HB3  GLN  65           2HB      GLN  65  11.838   9.727  -3.392
  494    HG2  GLN  65           1HG      GLN  65  10.154  11.296  -2.732
  495    HG3  GLN  65           2HG      GLN  65  10.089  10.606  -1.110
  496   HE21  GLN  65          1HE2      GLN  65  10.562  12.593  -0.183
  497   HE22  GLN  65          2HE2      GLN  65  12.155  13.263  -0.219
  498    H    LYS  66           H        LYS  66  11.180   6.488  -1.543
  499    HA   LYS  66           HA       LYS  66  12.689   5.262  -3.540
  500    HB2  LYS  66           1HB      LYS  66  13.453   4.537  -1.541
  501    HB3  LYS  66           2HB      LYS  66  11.907   4.814  -0.755
  502    HG2  LYS  66           1HG      LYS  66  11.740   2.636  -0.567
  503    HG3  LYS  66           2HG      LYS  66  11.458   2.598  -2.297
  504    HD2  LYS  66           1HD      LYS  66  14.221   2.499  -1.103
  505    HD3  LYS  66           2HD      LYS  66  13.270   1.046  -1.407
  506    HE2  LYS  66           1HE      LYS  66  13.968   3.075  -3.523
  507    HE3  LYS  66           2HE      LYS  66  14.921   1.628  -3.198
  508    HZ1  LYS  66           3HZ      LYS  66  13.418   1.228  -5.013
  509    HZ2  LYS  66           1HZ      LYS  66  12.088   1.709  -4.084
  510    HZ3  LYS  66           2HZ      LYS  66  12.931   0.298  -3.688
  511    H    ASN  67           H        ASN  67   9.319   5.256  -2.918
  512    HA   ASN  67           HA       ASN  67   8.942   2.716  -4.345
  513    HB2  ASN  67           1HB      ASN  67   6.891   4.170  -2.723
  514    HB3  ASN  67           2HB      ASN  67   6.902   2.493  -3.207
  515   HD21  ASN  67          1HD2      ASN  67   6.943   4.196  -0.675
  516   HD22  ASN  67          2HD2      ASN  67   8.035   3.358   0.337
  517    H    GLU  68           H        GLU  68   8.712   6.036  -4.668
  518    HA   GLU  68           HA       GLU  68   8.051   7.304  -6.435
  519    HB2  GLU  68           1HB      GLU  68   8.249   5.239  -7.830
  520    HB3  GLU  68           2HB      GLU  68   6.554   4.901  -7.489
  521    HG2  GLU  68           1HG      GLU  68   6.038   7.144  -8.526
  522    HG3  GLU  68           2HG      GLU  68   7.719   7.198  -9.051
  523    H    VAL  69           H        VAL  69   6.573   6.711  -3.901
  524    HA   VAL  69           HA       VAL  69   3.951   7.695  -4.774
  525    HB   VAL  69           HB       VAL  69   3.400   5.925  -3.406
  526   HG11  VAL  69          1HG1      VAL  69   5.478   6.651  -1.349
  527   HG12  VAL  69          2HG1      VAL  69   5.731   5.482  -2.638
  528   HG13  VAL  69          3HG1      VAL  69   4.486   5.191  -1.429
  529   HG21  VAL  69          3HG2      VAL  69   2.547   6.814  -1.301
  530   HG22  VAL  69          1HG2      VAL  69   2.273   7.940  -2.630
  531   HG23  VAL  69          2HG2      VAL  69   3.577   8.235  -1.478
  532    H    SER  70           H        SER  70   3.962   9.803  -4.944
  533    HA   SER  70           HA       SER  70   5.092  11.372  -2.726
  534    HB2  SER  70           1HB      SER  70   4.695  12.248  -5.596
  535    HB3  SER  70           2HB      SER  70   5.443  13.194  -4.311
  536    HG   SER  70           HG       SER  70   6.946  11.300  -4.173
  537    H    ALA  71           H        ALA  71   2.331  10.719  -4.718
  538    HA   ALA  71           HA       ALA  71   0.722  12.819  -3.585
  539    HB1  ALA  71           1HB      ALA  71  -0.083  10.360  -5.141
  540    HB2  ALA  71           2HB      ALA  71   0.216  11.961  -5.816
  541    HB3  ALA  71           3HB      ALA  71  -1.145  11.705  -4.724
  542    H    MET  72           H        MET  72  -1.181  12.343  -2.226
  543    HA   MET  72           HA       MET  72  -1.043   9.897  -0.687
  544    HB2  MET  72           1HB      MET  72  -0.853  11.154   1.478
  545    HB3  MET  72           2HB      MET  72   0.606  11.147   0.499
  546    HG2  MET  72           1HG      MET  72   0.039  13.402  -0.312
  547    HG3  MET  72           2HG      MET  72  -1.371  13.402   0.746
  548    HE1  MET  72           3HE      MET  72   2.511  13.174   0.560
  549    HE2  MET  72           1HE      MET  72   2.184  11.846   1.675
  550    HE3  MET  72           2HE      MET  72   2.993  13.302   2.252
  551    HA   PRO  73           HA       PRO  73  -1.945   8.901   0.766
  552    HB2  PRO  73           1HB      PRO  73  -3.995   7.154   0.930
  553    HB3  PRO  73           2HB      PRO  73  -3.649   8.342   2.186
  554    HG2  PRO  73           1HG      PRO  73  -5.745   8.369   0.068
  555    HG3  PRO  73           2HG      PRO  73  -5.837   8.948   1.750
  556    HD2  PRO  73           1HD      PRO  73  -5.461  10.559  -0.479
  557    HD3  PRO  73           2HD      PRO  73  -5.012  11.002   1.179
  558    H    THR  74           H        THR  74  -1.337   6.896  -0.165
  559    HA   THR  74           HA       THR  74  -2.211   6.413  -2.934
  560    HB   THR  74           HB       THR  74   0.598   6.886  -1.952
  561    HG1  THR  74           1HG      THR  74   0.164   8.688  -2.943
  562   HG21  THR  74          3HG2      THR  74   0.860   4.852  -3.144
  563   HG22  THR  74          1HG2      THR  74   1.365   6.141  -4.232
  564   HG23  THR  74          2HG2      THR  74  -0.219   5.380  -4.443
  565    H    LEU  75           H        LEU  75  -2.190   4.349  -3.594
  566    HA   LEU  75           HA       LEU  75  -1.406   2.294  -1.628
  567    HB2  LEU  75           1HB      LEU  75  -3.408   2.106  -3.871
  568    HB3  LEU  75           2HB      LEU  75  -3.067   0.866  -2.681
  569    HG   LEU  75           HG       LEU  75  -3.826   2.879  -1.053
  570   HD11  LEU  75          1HD1      LEU  75  -4.336   4.370  -2.971
  571   HD12  LEU  75          2HD1      LEU  75  -5.756   4.009  -1.992
  572   HD13  LEU  75          3HD1      LEU  75  -5.528   3.199  -3.541
  573   HD21  LEU  75          3HD2      LEU  75  -4.651   0.642  -0.969
  574   HD22  LEU  75          1HD2      LEU  75  -5.539   0.863  -2.477
  575   HD23  LEU  75          2HD2      LEU  75  -6.025   1.748  -1.033
  576    H    LEU  76           H        LEU  76   0.192   0.931  -2.260
  577    HA   LEU  76           HA       LEU  76   0.779   0.762  -5.143
  578    HB2  LEU  76           1HB      LEU  76   2.504   1.476  -2.922
  579    HB3  LEU  76           2HB      LEU  76   3.133   0.105  -3.813
  580    HG   LEU  76           HG       LEU  76   2.351   2.721  -5.101
  581   HD11  LEU  76          1HD1      LEU  76   5.087   1.726  -4.310
  582   HD12  LEU  76          2HD1      LEU  76   4.221   3.073  -3.573
  583   HD13  LEU  76          3HD1      LEU  76   4.755   3.181  -5.258
  584   HD21  LEU  76          3HD2      LEU  76   2.310   0.685  -6.523
  585   HD22  LEU  76          1HD2      LEU  76   4.013   0.434  -6.149
  586   HD23  LEU  76          2HD2      LEU  76   3.508   1.876  -7.030
  587    H    LEU  77           H        LEU  77   0.367  -1.128  -5.930
  588    HA   LEU  77           HA       LEU  77   0.440  -3.512  -4.211
  589    HB2  LEU  77           1HB      LEU  77  -0.798  -2.953  -6.907
  590    HB3  LEU  77           2HB      LEU  77  -0.652  -4.569  -6.263
  591    HG   LEU  77           HG       LEU  77  -2.341  -4.231  -4.671
  592   HD11  LEU  77          1HD1      LEU  77  -2.124  -1.251  -5.142
  593   HD12  LEU  77          2HD1      LEU  77  -1.522  -2.109  -3.724
  594   HD13  LEU  77          3HD1      LEU  77  -3.254  -2.057  -4.054
  595   HD21  LEU  77          3HD2      LEU  77  -3.120  -4.299  -6.997
  596   HD22  LEU  77          1HD2      LEU  77  -3.079  -2.535  -7.051
  597   HD23  LEU  77          2HD2      LEU  77  -4.193  -3.356  -5.960
  598    H    PHE  78           H        PHE  78   2.064  -4.939  -4.464
  599    HA   PHE  78           HA       PHE  78   3.523  -4.937  -7.027
  600    HB2  PHE  78           1HB      PHE  78   4.652  -5.102  -4.232
  601    HB3  PHE  78           2HB      PHE  78   5.542  -5.667  -5.639
  602    HD1  PHE  78           1HD      PHE  78   3.975  -2.669  -4.128
  603    HD2  PHE  78           2HD      PHE  78   6.729  -4.183  -6.992
  604    HE1  PHE  78           1HE      PHE  78   4.832  -0.399  -4.509
  605    HE2  PHE  78           2HE      PHE  78   7.586  -1.913  -7.377
  606    HZ   PHE  78           HZ       PHE  78   6.635  -0.016  -6.134
  607    H    LYS  79           H        LYS  79   4.462  -7.064  -7.605
  608    HA   LYS  79           HA       LYS  79   3.797  -9.226  -5.733
  609    HB2  LYS  79           1HB      LYS  79   2.065  -9.045  -7.694
  610    HB3  LYS  79           2HB      LYS  79   3.379  -9.734  -8.655
  611    HG2  LYS  79           1HG      LYS  79   3.415 -11.714  -7.417
  612    HG3  LYS  79           2HG      LYS  79   2.449 -11.022  -6.116
  613    HD2  LYS  79           1HD      LYS  79   1.080 -12.536  -7.386
  614    HD3  LYS  79           2HD      LYS  79   0.524 -10.889  -7.673
  615    HE2  LYS  79           1HE      LYS  79   2.511 -12.048  -9.556
  616    HE3  LYS  79           2HE      LYS  79   0.851 -12.632  -9.641
  617    HZ1  LYS  79           3HZ      LYS  79   0.148 -10.279  -9.857
  618    HZ2  LYS  79           1HZ      LYS  79   1.099 -10.826 -11.148
  619    HZ3  LYS  79           2HZ      LYS  79   1.780  -9.833  -9.964
  620    H    ASN  80           H        ASN  80   5.707 -10.055  -5.245
  621    HA   ASN  80           HA       ASN  80   7.657 -11.181  -5.499
  622    HB2  ASN  80           1HB      ASN  80   6.413 -12.599  -6.972
  623    HB3  ASN  80           2HB      ASN  80   6.557 -11.450  -8.287
  624   HD21  ASN  80          1HD2      ASN  80   7.367 -12.929  -9.640
  625   HD22  ASN  80          2HD2      ASN  80   8.981 -13.563  -9.512
  626    H    GLY  81           H        GLY  81   8.042  -8.587  -5.312
  627    HA2  GLY  81           1HA      GLY  81   9.881  -7.195  -5.445
  628    HA3  GLY  81           2HA      GLY  81  10.621  -8.358  -6.543
  629    H    LYS  82           H        LYS  82   7.648  -7.619  -7.787
  630    HA   LYS  82           HA       LYS  82   8.616  -5.246  -9.195
  631    HB2  LYS  82           1HB      LYS  82   7.883  -6.129 -11.319
  632    HB3  LYS  82           2HB      LYS  82   8.993  -7.271 -10.575
  633    HG2  LYS  82           1HG      LYS  82   7.054  -8.597  -9.804
  634    HG3  LYS  82           2HG      LYS  82   5.998  -7.498 -10.694
  635    HD2  LYS  82           1HD      LYS  82   6.413  -9.471 -12.024
  636    HD3  LYS  82           2HD      LYS  82   7.204  -8.084 -12.772
  637    HE2  LYS  82           1HE      LYS  82   8.655 -10.044 -12.810
  638    HE3  LYS  82           2HE      LYS  82   9.340  -8.771 -11.805
  639    HZ1  LYS  82           3HZ      LYS  82   7.817 -11.090 -10.756
  640    HZ2  LYS  82           1HZ      LYS  82   8.644  -9.931  -9.842
  641    HZ3  LYS  82           2HZ      LYS  82   9.503 -11.011 -10.822
  642    H    GLU  83           H        GLU  83   6.800  -4.079 -10.243
  643    HA   GLU  83           HA       GLU  83   4.761  -3.617  -8.354
  644    HB2  GLU  83           1HB      GLU  83   5.779  -1.997 -10.027
  645    HB3  GLU  83           2HB      GLU  83   4.784  -2.765 -11.253
  646    HG2  GLU  83           1HG      GLU  83   2.767  -2.086 -10.081
  647    HG3  GLU  83           2HG      GLU  83   3.749  -1.373  -8.795
  648    H    VAL  84           H        VAL  84   2.392  -3.575  -9.022
  649    HA   VAL  84           HA       VAL  84   1.711  -5.123 -11.363
  650    HB   VAL  84           HB       VAL  84  -0.330  -6.060 -10.079
  651   HG11  VAL  84          1HG1      VAL  84   1.367  -7.454 -11.135
  652   HG12  VAL  84          2HG1      VAL  84   0.866  -8.132  -9.587
  653   HG13  VAL  84          3HG1      VAL  84   2.403  -7.277  -9.718
  654   HG21  VAL  84          3HG2      VAL  84   0.084  -4.926  -7.995
  655   HG22  VAL  84          1HG2      VAL  84   1.654  -5.709  -7.854
  656   HG23  VAL  84          2HG2      VAL  84   0.178  -6.671  -7.763
  657    H    ALA  85           H        ALA  85   0.818  -2.898  -8.799
  658    HA   ALA  85           HA       ALA  85  -0.574  -1.263 -10.666
  659    HB1  ALA  85           1HB      ALA  85  -2.163  -2.785  -8.631
  660    HB2  ALA  85           2HB      ALA  85  -2.399  -2.728 -10.375
  661    HB3  ALA  85           3HB      ALA  85  -2.752  -1.308  -9.392
  662    H    LYS  86           H        LYS  86  -1.122   0.792  -9.857
  663    HA   LYS  86           HA       LYS  86  -0.492   1.399  -7.088
  664    HB2  LYS  86           1HB      LYS  86   0.962   3.334  -7.821
  665    HB3  LYS  86           2HB      LYS  86   1.664   1.737  -8.003
  666    HG2  LYS  86           1HG      LYS  86   0.988   1.810 -10.413
  667    HG3  LYS  86           2HG      LYS  86   0.552   3.503 -10.163
  668    HD2  LYS  86           1HD      LYS  86   2.829   4.010  -9.480
  669    HD3  LYS  86           2HD      LYS  86   3.274   2.311  -9.637
  670    HE2  LYS  86           1HE      LYS  86   2.637   2.470 -12.058
  671    HE3  LYS  86           2HE      LYS  86   2.467   4.211 -11.831
  672    HZ1  LYS  86           3HZ      LYS  86   4.642   3.665 -12.700
  673    HZ2  LYS  86           1HZ      LYS  86   4.940   2.633 -11.393
  674    HZ3  LYS  86           2HZ      LYS  86   4.792   4.300 -11.134
  675    H    VAL  87           H        VAL  87  -1.854   2.881  -6.290
  676    HA   VAL  87           HA       VAL  87  -3.419   4.490  -8.189
  677    HB   VAL  87           HB       VAL  87  -4.636   2.898  -5.924
  678   HG11  VAL  87          1HG1      VAL  87  -6.777   3.667  -6.817
  679   HG12  VAL  87          2HG1      VAL  87  -5.932   4.623  -8.032
  680   HG13  VAL  87          3HG1      VAL  87  -5.767   5.025  -6.323
  681   HG21  VAL  87          3HG2      VAL  87  -3.998   1.434  -7.755
  682   HG22  VAL  87          1HG2      VAL  87  -4.824   2.482  -8.907
  683   HG23  VAL  87          2HG2      VAL  87  -5.753   1.604  -7.693
  684    H    VAL  88           H        VAL  88  -3.800   6.528  -7.522
  685    HA   VAL  88           HA       VAL  88  -2.795   7.227  -4.857
  686    HB   VAL  88           HB       VAL  88  -2.678   9.572  -5.769
  687   HG11  VAL  88          1HG1      VAL  88  -0.631   9.162  -7.057
  688   HG12  VAL  88          2HG1      VAL  88  -1.066   7.458  -7.199
  689   HG13  VAL  88          3HG1      VAL  88  -0.704   8.146  -5.616
  690   HG21  VAL  88          3HG2      VAL  88  -4.270   9.318  -7.611
  691   HG22  VAL  88          1HG2      VAL  88  -3.185   8.172  -8.397
  692   HG23  VAL  88          2HG2      VAL  88  -2.698   9.856  -8.202
  693    H    GLY  89           H        GLY  89  -5.189   6.150  -4.621
  694    HA2  GLY  89           1HA      GLY  89  -6.785   8.109  -3.450
  695    HA3  GLY  89           2HA      GLY  89  -7.414   7.816  -5.065
  696    H    ALA  90           H        ALA  90  -8.019   7.095  -2.039
  697    HA   ALA  90           HA       ALA  90  -8.315   4.311  -1.932
  698    HB1  ALA  90           1HB      ALA  90  -9.671   4.690  -0.018
  699    HB2  ALA  90           2HB      ALA  90 -10.038   6.338  -0.546
  700    HB3  ALA  90           3HB      ALA  90  -8.406   5.927  -0.030
  701    H    ASN  91           H        ASN  91  -9.355   3.311  -3.584
  702    HA   ASN  91           HA       ASN  91 -12.130   4.171  -4.045
  703    HB2  ASN  91           1HB      ASN  91 -10.173   4.001  -5.936
  704    HB3  ASN  91           2HB      ASN  91 -10.897   2.400  -6.048
  705   HD21  ASN  91          1HD2      ASN  91 -12.700   5.249  -5.104
  706   HD22  ASN  91          2HD2      ASN  91 -13.691   5.316  -6.516
  707    HA   PRO  92           HA       PRO  92 -12.490   0.603  -1.224
  708    HB2  PRO  92           1HB      PRO  92 -15.268   1.155  -2.200
  709    HB3  PRO  92           2HB      PRO  92 -14.717   0.719  -0.578
  710    HG2  PRO  92           1HG      PRO  92 -15.240   3.263  -1.245
  711    HG3  PRO  92           2HG      PRO  92 -13.936   2.838  -0.125
  712    HD2  PRO  92           1HD      PRO  92 -13.768   3.897  -2.857
  713    HD3  PRO  92           2HD      PRO  92 -12.530   3.847  -1.591
  714    H    ALA  93           H        ALA  93 -14.790   0.508  -3.964
  715    HA   ALA  93           HA       ALA  93 -14.657  -2.359  -3.914
  716    HB1  ALA  93           1HB      ALA  93 -16.776  -1.164  -4.271
  717    HB2  ALA  93           2HB      ALA  93 -16.415  -2.298  -5.572
  718    HB3  ALA  93           3HB      ALA  93 -16.160  -0.570  -5.813
  719    H    ALA  94           H        ALA  94 -13.378   0.174  -5.948
  720    HA   ALA  94           HA       ALA  94 -12.728  -1.560  -8.134
  721    HB1  ALA  94           1HB      ALA  94 -13.054   0.845  -8.463
  722    HB2  ALA  94           2HB      ALA  94 -11.458   0.331  -9.008
  723    HB3  ALA  94           3HB      ALA  94 -11.636   1.176  -7.469
  724    H    ILE  95           H        ILE  95 -11.096  -0.519  -5.218
  725    HA   ILE  95           HA       ILE  95  -8.581  -1.604  -6.183
  726    HB   ILE  95           HB       ILE  95  -9.168  -0.458  -3.457
  727   HG12  ILE  95          1HG1      ILE  95  -9.503   1.260  -5.133
  728   HG13  ILE  95          2HG1      ILE  95  -7.973   1.554  -4.316
  729   HG21  ILE  95          1HG2      ILE  95  -7.233  -1.974  -3.573
  730   HG22  ILE  95          2HG2      ILE  95  -6.762  -0.313  -3.231
  731   HG23  ILE  95          3HG2      ILE  95  -6.543  -0.973  -4.850
  732   HD11  ILE  95          3HD1      ILE  95  -6.783   0.560  -6.203
  733   HD12  ILE  95          1HD1      ILE  95  -7.777   1.930  -6.699
  734   HD13  ILE  95          2HD1      ILE  95  -8.321   0.286  -7.022
  735    H    LYS  96           H        LYS  96 -11.100  -2.404  -3.820
  736    HA   LYS  96           HA       LYS  96  -9.943  -4.769  -2.863
  737    HB2  LYS  96           1HB      LYS  96 -11.851  -4.189  -1.704
  738    HB3  LYS  96           2HB      LYS  96 -12.762  -3.802  -3.164
  739    HG2  LYS  96           1HG      LYS  96 -12.767  -6.302  -3.622
  740    HG3  LYS  96           2HG      LYS  96 -12.166  -6.492  -1.975
  741    HD2  LYS  96           1HD      LYS  96 -14.124  -5.349  -1.101
  742    HD3  LYS  96           2HD      LYS  96 -14.721  -5.089  -2.741
  743    HE2  LYS  96           1HE      LYS  96 -14.785  -7.550  -3.048
  744    HE3  LYS  96           2HE      LYS  96 -14.323  -7.737  -1.358
  745    HZ1  LYS  96           3HZ      LYS  96 -16.792  -6.421  -2.350
  746    HZ2  LYS  96           1HZ      LYS  96 -16.348  -6.564  -0.724
  747    HZ3  LYS  96           2HZ      LYS  96 -16.701  -7.948  -1.630
  748    H    GLN  97           H        GLN  97 -11.693  -4.049  -5.816
  749    HA   GLN  97           HA       GLN  97 -11.561  -6.694  -6.868
  750    HB2  GLN  97           1HB      GLN  97 -13.196  -5.128  -7.740
  751    HB3  GLN  97           2HB      GLN  97 -11.930  -4.001  -8.214
  752    HG2  GLN  97           1HG      GLN  97 -11.083  -5.750  -9.786
  753    HG3  GLN  97           2HG      GLN  97 -12.509  -6.710  -9.395
  754   HE21  GLN  97          1HE2      GLN  97 -11.619  -5.534 -11.921
  755   HE22  GLN  97          2HE2      GLN  97 -12.921  -4.536 -12.461
  756    H    ALA  98           H        ALA  98  -9.386  -3.969  -6.771
  757    HA   ALA  98           HA       ALA  98  -7.711  -4.789  -8.911
  758    HB1  ALA  98           1HB      ALA  98  -7.768  -2.475  -8.130
  759    HB2  ALA  98           2HB      ALA  98  -6.138  -3.144  -8.086
  760    HB3  ALA  98           3HB      ALA  98  -7.065  -2.983  -6.595
  761    H    ILE  99           H        ILE  99  -7.401  -4.972  -5.393
  762    HA   ILE  99           HA       ILE  99  -4.979  -6.316  -5.278
  763    HB   ILE  99           HB       ILE  99  -7.207  -6.941  -3.329
  764   HG12  ILE  99          1HG1      ILE  99  -7.341  -4.597  -3.376
  765   HG13  ILE  99          2HG1      ILE  99  -6.242  -4.942  -2.042
  766   HG21  ILE  99          1HG2      ILE  99  -4.214  -6.778  -3.197
  767   HG22  ILE  99          2HG2      ILE  99  -5.222  -8.218  -3.043
  768   HG23  ILE  99          3HG2      ILE  99  -5.247  -6.983  -1.782
  769   HD11  ILE  99          3HD1      ILE  99  -4.358  -4.522  -3.594
  770   HD12  ILE  99          1HD1      ILE  99  -5.385  -3.118  -3.289
  771   HD13  ILE  99          2HD1      ILE  99  -5.553  -4.020  -4.801
  772    H    ALA 100           H        ALA 100  -8.243  -7.554  -5.753
  773    HA   ALA 100           HA       ALA 100  -7.541 -10.319  -5.605
  774    HB1  ALA 100           1HB      ALA 100  -9.817  -9.518  -5.196
  775    HB2  ALA 100           2HB      ALA 100  -9.777 -10.717  -6.490
  776    HB3  ALA 100           3HB      ALA 100  -9.938  -9.004  -6.878
  777    H    ALA 101           H        ALA 101  -7.649  -7.933  -8.147
  778    HA   ALA 101           HA       ALA 101  -7.485  -9.785 -10.326
  779    HB1  ALA 101           1HB      ALA 101  -6.892  -6.823 -10.281
  780    HB2  ALA 101           2HB      ALA 101  -8.490  -7.536 -10.530
  781    HB3  ALA 101           3HB      ALA 101  -7.208  -7.815 -11.709
  782    H    ASN 102           H        ASN 102  -5.187  -7.734  -8.595
  783    HA   ASN 102           HA       ASN 102  -3.051  -8.288 -10.436
  784    HB2  ASN 102           1HB      ASN 102  -3.016  -6.859  -7.783
  785    HB3  ASN 102           2HB      ASN 102  -1.682  -6.897  -8.922
  786   HD21  ASN 102          1HD2      ASN 102  -4.560  -5.404  -8.008
  787   HD22  ASN 102          2HD2      ASN 102  -4.736  -4.319  -9.345
  788    H    ALA 103           H        ALA 103  -4.264  -9.788  -7.628
  789    HA   ALA 103           HA       ALA 103  -1.834 -11.048  -6.794
  790    HB1  ALA 103           1HB      ALA 103  -3.710 -10.709  -5.248
  791    HB2  ALA 103           2HB      ALA 103  -3.265 -12.412  -5.363
  792    HB3  ALA 103           3HB      ALA 103  -4.694 -11.814  -6.207
  Start of MODEL    6
    1    H1   MET   1           1H       MET   1  -6.191  -7.416   9.679
    2    H2   MET   1           2H       MET   1  -7.000  -5.979   9.329
    3    H3   MET   1           3H       MET   1  -7.164  -6.684  10.853
    4    HA   MET   1           HA       MET   1  -5.692  -4.782  10.913
    5    HB2  MET   1           1HB      MET   1  -3.805  -5.846  12.024
    6    HB3  MET   1           2HB      MET   1  -5.333  -6.564  12.501
    7    HG2  MET   1           1HG      MET   1  -4.915  -8.441  10.984
    8    HG3  MET   1           2HG      MET   1  -3.361  -7.725  10.548
    9    HE1  MET   1           3HE      MET   1  -4.726  -7.252  14.093
   10    HE2  MET   1           1HE      MET   1  -4.299  -8.753  14.919
   11    HE3  MET   1           2HE      MET   1  -5.526  -8.760  13.650
   12    H    VAL   2           H        VAL   2  -4.004  -3.631  10.069
   13    HA   VAL   2           HA       VAL   2  -2.562  -4.840   7.815
   14    HB   VAL   2           HB       VAL   2  -3.507  -1.984   8.112
   15   HG11  VAL   2          1HG1      VAL   2  -1.324  -2.018   7.070
   16   HG12  VAL   2          2HG1      VAL   2  -2.555  -1.664   5.854
   17   HG13  VAL   2          3HG1      VAL   2  -1.846  -3.276   5.954
   18   HG21  VAL   2          3HG2      VAL   2  -4.223  -4.051   6.051
   19   HG22  VAL   2          1HG2      VAL   2  -4.929  -2.451   6.250
   20   HG23  VAL   2          2HG2      VAL   2  -5.200  -3.691   7.474
   21    H    THR   3           H        THR   3  -0.392  -4.686   7.848
   22    HA   THR   3           HA       THR   3   0.737  -4.087  10.438
   23    HB   THR   3           HB       THR   3   2.124  -5.175   7.986
   24    HG1  THR   3           1HG      THR   3   0.319  -6.295   9.773
   25   HG21  THR   3          3HG2      THR   3   3.668  -6.168   9.619
   26   HG22  THR   3          1HG2      THR   3   2.785  -5.386  10.929
   27   HG23  THR   3          2HG2      THR   3   3.651  -4.408   9.743
   28    H    GLN   4           H        GLN   4   2.388  -2.700  10.916
   29    HA   GLN   4           HA       GLN   4   2.548  -0.314   9.241
   30    HB2  GLN   4           1HB      GLN   4   2.124  -0.399  11.775
   31    HB3  GLN   4           2HB      GLN   4   3.837  -0.763  11.930
   32    HG2  GLN   4           1HG      GLN   4   3.634   1.557  12.255
   33    HG3  GLN   4           2HG      GLN   4   4.279   1.351  10.625
   34   HE21  GLN   4          1HE2      GLN   4   2.926   1.713   8.855
   35   HE22  GLN   4          2HE2      GLN   4   1.471   2.628   8.996
   36    H    PHE   5           H        PHE   5   4.337   0.247   8.081
   37    HA   PHE   5           HA       PHE   5   6.810  -1.305   8.259
   38    HB2  PHE   5           1HB      PHE   5   5.895   0.992   6.535
   39    HB3  PHE   5           2HB      PHE   5   7.562   0.449   6.542
   40    HD1  PHE   5           1HD      PHE   5   6.596  -2.579   6.867
   41    HD2  PHE   5           2HD      PHE   5   5.733   0.597   4.170
   42    HE1  PHE   5           1HE      PHE   5   6.109  -4.213   5.099
   43    HE2  PHE   5           2HE      PHE   5   5.238  -1.034   2.402
   44    HZ   PHE   5           HZ       PHE   5   5.429  -3.442   2.863
   45    H    LYS   6           H        LYS   6   8.877  -0.087   8.404
   46    HA   LYS   6           HA       LYS   6   8.677   2.391   9.942
   47    HB2  LYS   6           1HB      LYS   6  10.585   1.625  11.364
   48    HB3  LYS   6           2HB      LYS   6   9.100   0.716  11.607
   49    HG2  LYS   6           1HG      LYS   6   9.981  -1.065  10.161
   50    HG3  LYS   6           2HG      LYS   6  11.486  -0.160   9.995
   51    HD2  LYS   6           1HD      LYS   6  11.919  -0.352  12.353
   52    HD3  LYS   6           2HD      LYS   6  10.342  -1.095  12.624
   53    HE2  LYS   6           1HE      LYS   6  11.011  -2.999  11.234
   54    HE3  LYS   6           2HE      LYS   6  12.589  -2.258  10.981
   55    HZ1  LYS   6           3HZ      LYS   6  12.686  -3.924  12.704
   56    HZ2  LYS   6           1HZ      LYS   6  11.480  -3.136  13.588
   57    HZ3  LYS   6           2HZ      LYS   6  12.984  -2.398  13.364
   58    H    THR   7           H        THR   7  10.225   0.540   7.499
   59    HA   THR   7           HA       THR   7  11.940   2.807   6.838
   60    HB   THR   7           HB       THR   7  13.838   1.194   6.362
   61    HG1  THR   7           1HG      THR   7  13.371  -0.637   8.160
   62   HG21  THR   7          3HG2      THR   7  13.903   2.716   8.282
   63   HG22  THR   7          1HG2      THR   7  14.660   1.171   8.666
   64   HG23  THR   7          2HG2      THR   7  13.036   1.527   9.254
   65    H    ALA   8           H        ALA   8  13.085   2.350   4.659
   66    HA   ALA   8           HA       ALA   8  11.193   1.465   2.721
   67    HB1  ALA   8           1HB      ALA   8  12.944   3.192   2.292
   68    HB2  ALA   8           2HB      ALA   8  12.862   1.918   1.081
   69    HB3  ALA   8           3HB      ALA   8  14.142   1.900   2.293
   70    H    SER   9           H        SER   9  13.842   0.022   4.443
   71    HA   SER   9           HA       SER   9  14.149  -2.339   2.986
   72    HB2  SER   9           1HB      SER   9  15.615  -1.638   4.879
   73    HB3  SER   9           2HB      SER   9  14.306  -2.018   5.996
   74    HG   SER   9           HG       SER   9  14.833  -4.041   5.876
   75    H    GLU  10           H        GLU  10  11.893  -1.516   5.630
   76    HA   GLU  10           HA       GLU  10  10.454  -3.864   5.741
   77    HB2  GLU  10           1HB      GLU  10   9.786  -1.011   6.218
   78    HB3  GLU  10           2HB      GLU  10   8.484  -2.195   6.198
   79    HG2  GLU  10           1HG      GLU  10  10.935  -2.435   7.868
   80    HG3  GLU  10           2HG      GLU  10   9.439  -1.724   8.432
   81    H    PHE  11           H        PHE  11  10.012  -1.081   3.586
   82    HA   PHE  11           HA       PHE  11   7.696  -1.966   2.282
   83    HB2  PHE  11           1HB      PHE  11   8.808   0.351   2.190
   84    HB3  PHE  11           2HB      PHE  11   9.867  -0.326   0.959
   85    HD1  PHE  11           1HD      PHE  11   8.794  -1.234  -1.168
   86    HD2  PHE  11           2HD      PHE  11   6.691   1.177   1.640
   87    HE1  PHE  11           1HE      PHE  11   7.118  -0.677  -2.890
   88    HE2  PHE  11           2HE      PHE  11   5.016   1.730  -0.092
   89    HZ   PHE  11           HZ       PHE  11   5.239   0.800  -2.342
   90    H    ASP  12           H        ASP  12  11.064  -2.166   1.258
   91    HA   ASP  12           HA       ASP  12  10.633  -3.580  -1.131
   92    HB2  ASP  12           1HB      ASP  12  12.689  -2.301  -0.503
   93    HB3  ASP  12           2HB      ASP  12  13.116  -3.601   0.603
   94    H    SER  13           H        SER  13  11.367  -4.754   2.147
   95    HA   SER  13           HA       SER  13  11.767  -7.448   1.468
   96    HB2  SER  13           1HB      SER  13  10.719  -6.289   4.059
   97    HB3  SER  13           2HB      SER  13  11.345  -7.923   3.849
   98    HG   SER  13           HG       SER  13  12.690  -5.480   3.927
   99    H    ALA  14           H        ALA  14   8.812  -5.688   2.347
  100    HA   ALA  14           HA       ALA  14   7.098  -7.914   2.243
  101    HB1  ALA  14           1HB      ALA  14   6.421  -5.021   1.702
  102    HB2  ALA  14           2HB      ALA  14   6.447  -5.780   3.292
  103    HB3  ALA  14           3HB      ALA  14   5.272  -6.304   2.084
  104    H    ILE  15           H        ILE  15   8.180  -5.572  -0.132
  105    HA   ILE  15           HA       ILE  15   6.514  -6.260  -2.266
  106    HB   ILE  15           HB       ILE  15   9.335  -5.232  -2.390
  107   HG12  ILE  15          1HG1      ILE  15   8.302  -3.529  -1.244
  108   HG13  ILE  15          2HG1      ILE  15   7.984  -3.069  -2.911
  109   HG21  ILE  15          1HG2      ILE  15   8.132  -6.211  -4.480
  110   HG22  ILE  15          2HG2      ILE  15   9.069  -4.719  -4.579
  111   HG23  ILE  15          3HG2      ILE  15   7.312  -4.651  -4.468
  112   HD11  ILE  15          3HD1      ILE  15   5.746  -3.961  -2.764
  113   HD12  ILE  15          1HD1      ILE  15   6.025  -2.795  -1.474
  114   HD13  ILE  15          2HD1      ILE  15   6.053  -4.523  -1.121
  115    H    ALA  16           H        ALA  16   9.594  -7.603  -1.226
  116    HA   ALA  16           HA       ALA  16  10.101  -9.001  -3.668
  117    HB1  ALA  16           1HB      ALA  16  11.902  -8.190  -2.222
  118    HB2  ALA  16           2HB      ALA  16  12.029  -9.923  -2.520
  119    HB3  ALA  16           3HB      ALA  16  11.411  -9.338  -0.976
  120    H    GLN  17           H        GLN  17   7.755  -9.641  -1.619
  121    HA   GLN  17           HA       GLN  17   8.112 -12.472  -1.267
  122    HB2  GLN  17           1HB      GLN  17   5.871 -10.546  -0.715
  123    HB3  GLN  17           2HB      GLN  17   5.744 -12.264  -0.425
  124    HG2  GLN  17           1HG      GLN  17   7.529 -12.190   1.172
  125    HG3  GLN  17           2HG      GLN  17   7.811 -10.490   0.816
  126   HE21  GLN  17          1HE2      GLN  17   5.057  -9.739   0.693
  127   HE22  GLN  17          2HE2      GLN  17   4.412  -9.823   2.300
  128    H    ASP  18           H        ASP  18   6.885 -14.075  -2.294
  129    HA   ASP  18           HA       ASP  18   6.052 -13.423  -4.991
  130    HB2  ASP  18           1HB      ASP  18   7.388 -15.485  -4.400
  131    HB3  ASP  18           2HB      ASP  18   5.946 -16.115  -3.612
  132    H    LYS  19           H        LYS  19   4.475 -12.148  -3.186
  133    HA   LYS  19           HA       LYS  19   1.873 -13.318  -3.804
  134    HB2  LYS  19           1HB      LYS  19   1.020 -12.879  -1.540
  135    HB3  LYS  19           2HB      LYS  19   2.324 -14.054  -1.505
  136    HG2  LYS  19           1HG      LYS  19   3.876 -12.303  -0.797
  137    HG3  LYS  19           2HG      LYS  19   2.563 -11.133  -0.821
  138    HD2  LYS  19           1HD      LYS  19   2.703 -11.720   1.423
  139    HD3  LYS  19           2HD      LYS  19   1.395 -12.736   0.827
  140    HE2  LYS  19           1HE      LYS  19   4.259 -13.641   1.109
  141    HE3  LYS  19           2HE      LYS  19   3.020 -13.896   2.331
  142    HZ1  LYS  19           3HZ      LYS  19   3.143 -15.053  -0.394
  143    HZ2  LYS  19           1HZ      LYS  19   1.746 -15.106   0.560
  144    HZ3  LYS  19           2HZ      LYS  19   3.156 -15.866   1.084
  145    H    LEU  20           H        LEU  20   0.124 -11.629  -3.346
  146    HA   LEU  20           HA       LEU  20   1.004  -9.160  -4.536
  147    HB2  LEU  20           1HB      LEU  20  -1.177 -10.401  -5.020
  148    HB3  LEU  20           2HB      LEU  20  -1.754  -9.785  -3.487
  149    HG   LEU  20           HG       LEU  20  -2.531  -8.500  -5.476
  150   HD11  LEU  20          1HD1      LEU  20  -2.179  -6.314  -4.552
  151   HD12  LEU  20          2HD1      LEU  20  -0.784  -6.884  -3.637
  152   HD13  LEU  20          3HD1      LEU  20  -2.398  -7.468  -3.236
  153   HD21  LEU  20          3HD2      LEU  20   0.354  -7.678  -5.676
  154   HD22  LEU  20          1HD2      LEU  20  -0.987  -7.047  -6.631
  155   HD23  LEU  20          2HD2      LEU  20  -0.495  -8.735  -6.805
  156    H    VAL  21           H        VAL  21   1.777  -7.547  -3.421
  157    HA   VAL  21           HA       VAL  21   1.041  -7.288  -0.585
  158    HB   VAL  21           HB       VAL  21   3.439  -6.129  -2.011
  159   HG11  VAL  21          1HG1      VAL  21   2.795  -6.334   0.929
  160   HG12  VAL  21          2HG1      VAL  21   2.750  -4.861  -0.038
  161   HG13  VAL  21          3HG1      VAL  21   4.283  -5.689   0.238
  162   HG21  VAL  21          3HG2      VAL  21   4.733  -7.867  -0.875
  163   HG22  VAL  21          1HG2      VAL  21   3.544  -8.558  -1.979
  164   HG23  VAL  21          2HG2      VAL  21   3.240  -8.562  -0.242
  165    H    VAL  22           H        VAL  22  -0.257  -5.668  -0.068
  166    HA   VAL  22           HA       VAL  22  -0.463  -3.384  -1.918
  167    HB   VAL  22           HB       VAL  22  -2.392  -4.144   0.277
  168   HG11  VAL  22          1HG1      VAL  22  -2.465  -1.795  -0.336
  169   HG12  VAL  22          2HG1      VAL  22  -3.922  -2.621  -0.887
  170   HG13  VAL  22          3HG1      VAL  22  -2.643  -2.227  -2.036
  171   HG21  VAL  22          3HG2      VAL  22  -2.353  -5.914  -1.371
  172   HG22  VAL  22          1HG2      VAL  22  -2.551  -4.739  -2.670
  173   HG23  VAL  22          2HG2      VAL  22  -3.850  -4.992  -1.505
  174    H    VAL  23           H        VAL  23   0.738  -1.720  -1.285
  175    HA   VAL  23           HA       VAL  23   1.200  -1.421   1.587
  176    HB   VAL  23           HB       VAL  23   2.676  -0.072  -0.670
  177   HG11  VAL  23          1HG1      VAL  23   3.077  -0.096   2.321
  178   HG12  VAL  23          2HG1      VAL  23   2.710   1.297   1.303
  179   HG13  VAL  23          3HG1      VAL  23   4.275   0.493   1.171
  180   HG21  VAL  23          3HG2      VAL  23   3.131  -2.447  -0.652
  181   HG22  VAL  23          1HG2      VAL  23   3.401  -2.408   1.092
  182   HG23  VAL  23          2HG2      VAL  23   4.523  -1.585   0.008
  183    H    ALA  24           H        ALA  24   0.180  -0.048   2.656
  184    HA   ALA  24           HA       ALA  24  -1.493   1.967   1.409
  185    HB1  ALA  24           1HB      ALA  24  -2.196   2.360   3.784
  186    HB2  ALA  24           2HB      ALA  24  -1.025   1.144   4.300
  187    HB3  ALA  24           3HB      ALA  24  -2.379   0.685   3.275
  188    H    PHE  25           H        PHE  25  -0.116   3.571   0.649
  189    HA   PHE  25           HA       PHE  25   1.800   4.745   2.515
  190    HB2  PHE  25           1HB      PHE  25   1.927   4.252  -0.202
  191    HB3  PHE  25           2HB      PHE  25   1.592   5.981  -0.122
  192    HD1  PHE  25           2HD      PHE  25   3.928   3.328   0.776
  193    HD2  PHE  25           1HD      PHE  25   3.205   7.515   0.749
  194    HE1  PHE  25           2HE      PHE  25   6.297   3.733   1.273
  195    HE2  PHE  25           1HE      PHE  25   5.574   7.926   1.249
  196    HZ   PHE  25           HZ       PHE  25   7.124   6.039   1.510
  197    H    TYR  26           H        TYR  26   1.359   6.551   3.591
  198    HA   TYR  26           HA       TYR  26  -0.537   8.466   2.510
  199    HB2  TYR  26           1HB      TYR  26  -1.765   8.489   4.743
  200    HB3  TYR  26           2HB      TYR  26  -2.093   7.127   3.678
  201    HD1  TYR  26           1HD      TYR  26   0.044   8.099   6.590
  202    HD2  TYR  26           2HD      TYR  26  -1.921   4.976   4.493
  203    HE1  TYR  26           1HE      TYR  26   0.612   6.533   8.401
  204    HE2  TYR  26           2HE      TYR  26  -1.365   3.398   6.277
  205    HH   TYR  26           HH       TYR  26  -0.230   4.397   9.320
  206    H    ALA  27           H        ALA  27  -0.852  10.172   4.472
  207    HA   ALA  27           HA       ALA  27   1.782  10.680   5.654
  208    HB1  ALA  27           1HB      ALA  27   0.072  12.760   4.298
  209    HB2  ALA  27           2HB      ALA  27   1.537  12.053   3.621
  210    HB3  ALA  27           3HB      ALA  27   1.625  13.031   5.085
  211    H    THR  28           H        THR  28   1.683  11.186   7.732
  212    HA   THR  28           HA       THR  28  -0.756  10.987   9.137
  213    HB   THR  28           HB       THR  28   0.687  11.858  11.089
  214    HG1  THR  28           1HG      THR  28   2.924  11.175   9.563
  215   HG21  THR  28          3HG2      THR  28   1.837   9.696  11.271
  216   HG22  THR  28          1HG2      THR  28   1.496   9.375   9.572
  217   HG23  THR  28          2HG2      THR  28   0.171   9.497  10.729
  218    H    TRP  29           H        TRP  29   0.817  13.690   7.698
  219    HA   TRP  29           HA       TRP  29  -0.656  15.627   9.259
  220    HB2  TRP  29           1HB      TRP  29   0.360  17.299   7.738
  221    HB3  TRP  29           2HB      TRP  29   1.558  16.258   8.491
  222    HD1  TRP  29           HD       TRP  29   3.196  14.988   6.895
  223    HE1  TRP  29           1HE      TRP  29   3.465  14.842   4.341
  224    HE3  TRP  29           3HE      TRP  29  -1.155  17.284   5.476
  225    HZ2  TRP  29           2HZ      TRP  29   2.022  15.590   2.036
  226    HZ3  TRP  29           3HZ      TRP  29  -1.633  17.523   3.081
  227    HH2  TRP  29           HH       TRP  29  -0.072  16.698   1.395
  228    H    CYS  30           H        CYS  30  -1.327  13.608   6.684
  229    HA   CYS  30           HA       CYS  30  -3.047  15.472   5.254
  230    HB2  CYS  30           1HB      CYS  30  -1.546  13.917   4.024
  231    HB3  CYS  30           2HB      CYS  30  -2.451  12.560   4.683
  232    HG   CYS  30           HG       CYS  30  -3.908  14.962   2.740
  233    H    GLY  31           H        GLY  31  -5.212  15.425   5.260
  234    HA2  GLY  31           1HA      GLY  31  -6.558  14.181   7.441
  235    HA3  GLY  31           2HA      GLY  31  -7.300  15.133   6.166
  236    HA   PRO  32           HA       PRO  32  -8.880  11.589   4.008
  237    HB2  PRO  32           1HB      PRO  32  -6.915  11.724   1.793
  238    HB3  PRO  32           2HB      PRO  32  -8.679  11.779   1.739
  239    HG2  PRO  32           1HG      PRO  32  -7.246  13.982   1.345
  240    HG3  PRO  32           2HG      PRO  32  -8.756  14.036   2.277
  241    HD2  PRO  32           1HD      PRO  32  -5.923  14.041   3.251
  242    HD3  PRO  32           2HD      PRO  32  -7.313  14.986   3.825
  243    H    CYS  33           H        CYS  33  -5.776  11.437   5.176
  244    HA   CYS  33           HA       CYS  33  -4.820   8.942   4.333
  245    HB2  CYS  33           1HB      CYS  33  -3.389  10.340   5.638
  246    HB3  CYS  33           2HB      CYS  33  -4.561  10.434   6.946
  247    HG   CYS  33           HG       CYS  33  -4.120   7.350   6.903
  248    H    LYS  34           H        LYS  34  -7.345   9.845   6.523
  249    HA   LYS  34           HA       LYS  34  -7.607   7.383   7.890
  250    HB2  LYS  34           1HB      LYS  34  -9.703   8.245   8.705
  251    HB3  LYS  34           2HB      LYS  34  -8.512   9.537   8.715
  252    HG2  LYS  34           1HG      LYS  34  -9.457  10.488   6.716
  253    HG3  LYS  34           2HG      LYS  34 -10.585   9.139   6.574
  254    HD2  LYS  34           1HD      LYS  34 -11.543   9.788   8.774
  255    HD3  LYS  34           2HD      LYS  34 -10.493  11.207   8.765
  256    HE2  LYS  34           1HE      LYS  34 -11.542  11.988   6.715
  257    HE3  LYS  34           2HE      LYS  34 -12.561  10.552   6.672
  258    HZ1  LYS  34           3HZ      LYS  34 -13.765  12.414   7.573
  259    HZ2  LYS  34           1HZ      LYS  34 -12.590  12.651   8.765
  260    HZ3  LYS  34           2HZ      LYS  34 -13.538  11.252   8.780
  261    H    MET  35           H        MET  35  -8.273   8.174   4.670
  262    HA   MET  35           HA       MET  35 -10.543   6.421   4.356
  263    HB2  MET  35           1HB      MET  35  -9.435   8.406   2.811
  264    HB3  MET  35           2HB      MET  35  -8.887   6.951   1.978
  265    HG2  MET  35           1HG      MET  35 -11.717   7.814   2.536
  266    HG3  MET  35           2HG      MET  35 -10.925   7.642   0.972
  267    HE1  MET  35           3HE      MET  35 -12.670   6.120  -0.176
  268    HE2  MET  35           1HE      MET  35 -13.712   6.401   1.220
  269    HE3  MET  35           2HE      MET  35 -13.463   4.762   0.620
  270    H    ILE  36           H        ILE  36  -7.063   6.273   4.006
  271    HA   ILE  36           HA       ILE  36  -7.041   3.694   2.787
  272    HB   ILE  36           HB       ILE  36  -5.097   5.727   3.503
  273   HG12  ILE  36          1HG1      ILE  36  -4.055   5.030   1.468
  274   HG13  ILE  36          2HG1      ILE  36  -4.911   3.493   1.493
  275   HG21  ILE  36          1HG2      ILE  36  -4.083   4.283   5.023
  276   HG22  ILE  36          2HG2      ILE  36  -3.182   4.041   3.525
  277   HG23  ILE  36          3HG2      ILE  36  -4.397   2.868   4.023
  278   HD11  ILE  36          3HD1      ILE  36  -5.820   5.121  -0.125
  279   HD12  ILE  36          1HD1      ILE  36  -6.257   6.166   1.229
  280   HD13  ILE  36          2HD1      ILE  36  -6.990   4.569   1.077
  281    H    ALA  37           H        ALA  37  -6.992   4.908   6.033
  282    HA   ALA  37           HA       ALA  37  -6.015   2.693   7.373
  283    HB1  ALA  37           1HB      ALA  37  -8.038   4.756   8.165
  284    HB2  ALA  37           2HB      ALA  37  -6.361   4.586   8.677
  285    HB3  ALA  37           3HB      ALA  37  -7.579   3.448   9.254
  286    HA   PRO  38           HA       PRO  38 -10.139   0.474   7.678
  287    HB2  PRO  38           1HB      PRO  38 -12.491   1.486   6.954
  288    HB3  PRO  38           2HB      PRO  38 -11.686   2.017   8.437
  289    HG2  PRO  38           1HG      PRO  38 -11.813   3.351   5.768
  290    HG3  PRO  38           2HG      PRO  38 -11.964   4.064   7.384
  291    HD2  PRO  38           1HD      PRO  38  -9.651   4.069   5.871
  292    HD3  PRO  38           2HD      PRO  38  -9.714   4.248   7.632
  293    H    MET  39           H        MET  39  -9.883   2.164   4.561
  294    HA   MET  39           HA       MET  39 -11.491   0.238   3.152
  295    HB2  MET  39           1HB      MET  39 -11.365   2.451   2.228
  296    HB3  MET  39           2HB      MET  39  -9.614   2.441   2.279
  297    HG2  MET  39           1HG      MET  39 -11.111   0.527   0.535
  298    HG3  MET  39           2HG      MET  39 -10.807   2.184   0.022
  299    HE1  MET  39           3HE      MET  39  -8.255   3.154   0.627
  300    HE2  MET  39           1HE      MET  39  -6.810   2.160   0.421
  301    HE3  MET  39           2HE      MET  39  -7.755   2.031   1.904
  302    H    ILE  40           H        ILE  40  -8.089   0.706   3.779
  303    HA   ILE  40           HA       ILE  40  -7.303  -1.495   2.119
  304    HB   ILE  40           HB       ILE  40  -5.989   0.582   3.697
  305   HG12  ILE  40          1HG1      ILE  40  -5.143  -0.902   1.216
  306   HG13  ILE  40          2HG1      ILE  40  -6.223   0.486   1.228
  307   HG21  ILE  40          1HG2      ILE  40  -4.965  -1.141   4.935
  308   HG22  ILE  40          2HG2      ILE  40  -3.793  -0.688   3.702
  309   HG23  ILE  40          3HG2      ILE  40  -4.753  -2.153   3.510
  310   HD11  ILE  40          3HD1      ILE  40  -4.259   1.514   0.769
  311   HD12  ILE  40          1HD1      ILE  40  -3.306   0.346   1.683
  312   HD13  ILE  40          2HD1      ILE  40  -4.223   1.589   2.531
  313    H    GLU  41           H        GLU  41  -7.861  -0.943   5.559
  314    HA   GLU  41           HA       GLU  41  -7.133  -3.546   6.391
  315    HB2  GLU  41           1HB      GLU  41  -7.557  -1.721   7.984
  316    HB3  GLU  41           2HB      GLU  41  -9.244  -1.665   7.495
  317    HG2  GLU  41           1HG      GLU  41  -9.534  -3.960   8.354
  318    HG3  GLU  41           2HG      GLU  41  -7.863  -3.928   8.921
  319    H    LYS  42           H        LYS  42  -9.885  -2.263   4.731
  320    HA   LYS  42           HA       LYS  42 -11.631  -4.438   5.240
  321    HB2  LYS  42           1HB      LYS  42 -12.467  -2.208   4.688
  322    HB3  LYS  42           2HB      LYS  42 -11.754  -2.317   3.087
  323    HG2  LYS  42           1HG      LYS  42 -14.135  -2.734   2.990
  324    HG3  LYS  42           2HG      LYS  42 -13.246  -4.197   2.566
  325    HD2  LYS  42           1HD      LYS  42 -15.145  -4.693   4.030
  326    HD3  LYS  42           2HD      LYS  42 -13.613  -5.089   4.807
  327    HE2  LYS  42           1HE      LYS  42 -13.701  -3.053   6.102
  328    HE3  LYS  42           2HE      LYS  42 -15.159  -2.539   5.257
  329    HZ1  LYS  42           3HZ      LYS  42 -14.956  -4.979   6.948
  330    HZ2  LYS  42           1HZ      LYS  42 -16.358  -4.362   6.225
  331    HZ3  LYS  42           2HZ      LYS  42 -15.600  -3.498   7.462
  332    H    PHE  43           H        PHE  43  -9.370  -3.686   2.567
  333    HA   PHE  43           HA       PHE  43 -10.346  -5.640   0.811
  334    HB2  PHE  43           1HB      PHE  43  -8.433  -5.403  -0.526
  335    HB3  PHE  43           2HB      PHE  43  -8.591  -3.840   0.265
  336    HD1  PHE  43           1HD      PHE  43  -6.775  -7.092   0.691
  337    HD2  PHE  43           2HD      PHE  43  -6.696  -2.866   1.091
  338    HE1  PHE  43           1HE      PHE  43  -4.406  -7.204   1.323
  339    HE2  PHE  43           2HE      PHE  43  -4.330  -2.972   1.749
  340    HZ   PHE  43           HZ       PHE  43  -3.184  -5.145   1.867
  341    H    SER  44           H        SER  44  -7.808  -6.025   3.366
  342    HA   SER  44           HA       SER  44  -7.629  -8.819   2.611
  343    HB2  SER  44           1HB      SER  44  -5.867  -8.996   4.243
  344    HB3  SER  44           2HB      SER  44  -5.592  -7.597   3.212
  345    HG   SER  44           HG       SER  44  -5.244  -7.014   5.358
  346    H    GLU  45           H        GLU  45  -9.434  -6.920   4.786
  347    HA   GLU  45           HA       GLU  45 -10.097  -8.872   6.706
  348    HB2  GLU  45           1HB      GLU  45 -10.714  -6.437   6.812
  349    HB3  GLU  45           2HB      GLU  45 -11.923  -6.744   5.573
  350    HG2  GLU  45           1HG      GLU  45 -12.961  -8.410   7.113
  351    HG3  GLU  45           2HG      GLU  45 -11.840  -7.861   8.359
  352    H    GLN  46           H        GLN  46 -11.033  -8.334   3.400
  353    HA   GLN  46           HA       GLN  46 -13.018 -10.442   3.456
  354    HB2  GLN  46           1HB      GLN  46 -11.949  -8.839   1.126
  355    HB3  GLN  46           2HB      GLN  46 -13.330  -9.924   1.081
  356    HG2  GLN  46           1HG      GLN  46 -13.157  -7.427   2.753
  357    HG3  GLN  46           2HG      GLN  46 -13.953  -7.542   1.187
  358   HE21  GLN  46          1HE2      GLN  46 -15.933  -6.947   2.068
  359   HE22  GLN  46          2HE2      GLN  46 -16.864  -8.029   3.048
  360    H    TYR  47           H        TYR  47  -9.788  -9.821   2.189
  361    HA   TYR  47           HA       TYR  47  -9.408 -12.692   1.896
  362    HB2  TYR  47           1HB      TYR  47  -8.118 -12.170  -0.256
  363    HB3  TYR  47           2HB      TYR  47  -9.873 -12.167  -0.304
  364    HD1  TYR  47           1HD      TYR  47  -6.911  -9.920  -0.141
  365    HD2  TYR  47           2HD      TYR  47 -11.067 -10.301  -0.984
  366    HE1  TYR  47           1HE      TYR  47  -6.919  -7.662  -1.144
  367    HE2  TYR  47           2HE      TYR  47 -11.082  -8.046  -1.952
  368    HH   TYR  47           HH       TYR  47  -8.297  -6.377  -2.741
  369    HA   PRO  48           HA       PRO  48  -5.764 -11.091   4.150
  370    HB2  PRO  48           1HB      PRO  48  -5.284 -13.386   5.478
  371    HB3  PRO  48           2HB      PRO  48  -6.461 -12.196   6.031
  372    HG2  PRO  48           1HG      PRO  48  -6.920 -14.729   4.496
  373    HG3  PRO  48           2HG      PRO  48  -7.818 -14.088   5.886
  374    HD2  PRO  48           1HD      PRO  48  -8.710 -13.822   3.352
  375    HD3  PRO  48           2HD      PRO  48  -8.998 -12.581   4.588
  376    H    GLN  49           H        GLN  49  -6.291 -13.151   1.644
  377    HA   GLN  49           HA       GLN  49  -3.922 -14.633   1.378
  378    HB2  GLN  49           1HB      GLN  49  -5.818 -15.141   0.003
  379    HB3  GLN  49           2HB      GLN  49  -5.867 -13.506  -0.635
  380    HG2  GLN  49           1HG      GLN  49  -3.424 -14.196  -1.445
  381    HG3  GLN  49           2HG      GLN  49  -4.167 -15.794  -1.394
  382   HE21  GLN  49          1HE2      GLN  49  -4.219 -12.645  -2.863
  383   HE22  GLN  49          2HE2      GLN  49  -5.221 -13.073  -4.210
  384    H    ALA  50           H        ALA  50  -4.588 -11.279   0.916
  385    HA   ALA  50           HA       ALA  50  -2.044 -10.898  -0.504
  386    HB1  ALA  50           1HB      ALA  50  -2.851  -8.621  -0.938
  387    HB2  ALA  50           2HB      ALA  50  -4.323  -8.982  -0.036
  388    HB3  ALA  50           3HB      ALA  50  -3.974  -9.847  -1.539
  389    H    ASP  51           H        ASP  51  -0.634  -9.134   0.252
  390    HA   ASP  51           HA       ASP  51  -0.562  -9.285   3.152
  391    HB2  ASP  51           1HB      ASP  51   1.474  -9.371   1.213
  392    HB3  ASP  51           2HB      ASP  51   1.695  -7.867   2.089
  393    H    PHE  52           H        PHE  52  -0.620  -7.635   4.496
  394    HA   PHE  52           HA       PHE  52  -1.651  -5.130   3.363
  395    HB2  PHE  52           1HB      PHE  52  -2.665  -5.070   5.810
  396    HB3  PHE  52           2HB      PHE  52  -3.454  -5.966   4.520
  397    HD1  PHE  52           2HD      PHE  52  -1.123  -6.357   7.399
  398    HD2  PHE  52           1HD      PHE  52  -3.849  -8.252   4.738
  399    HE1  PHE  52           2HE      PHE  52  -1.018  -8.405   8.754
  400    HE2  PHE  52           1HE      PHE  52  -3.747 -10.303   6.091
  401    HZ   PHE  52           HZ       PHE  52  -2.330 -10.382   8.102
  402    H    TYR  53           H        TYR  53  -0.238  -3.486   3.545
  403    HA   TYR  53           HA       TYR  53   1.073  -3.132   6.141
  404    HB2  TYR  53           1HB      TYR  53   2.559  -3.031   3.497
  405    HB3  TYR  53           2HB      TYR  53   3.209  -2.538   5.056
  406    HD1  TYR  53           1HD      TYR  53   3.714  -4.232   6.778
  407    HD2  TYR  53           2HD      TYR  53   2.356  -5.331   2.900
  408    HE1  TYR  53           1HE      TYR  53   4.468  -6.537   7.174
  409    HE2  TYR  53           2HE      TYR  53   3.103  -7.642   3.280
  410    HH   TYR  53           HH       TYR  53   4.321  -8.985   4.623
  411    H    LYS  54           H        LYS  54   1.886  -1.019   6.520
  412    HA   LYS  54           HA       LYS  54   0.637   1.137   4.957
  413    HB2  LYS  54           1HB      LYS  54   0.282   0.446   7.836
  414    HB3  LYS  54           2HB      LYS  54   0.157   2.123   7.345
  415    HG2  LYS  54           1HG      LYS  54  -1.719   1.542   5.909
  416    HG3  LYS  54           2HG      LYS  54  -1.547  -0.151   6.359
  417    HD2  LYS  54           1HD      LYS  54  -2.253   2.141   8.189
  418    HD3  LYS  54           2HD      LYS  54  -3.340   0.868   7.635
  419    HE2  LYS  54           1HE      LYS  54  -1.867  -0.791   8.775
  420    HE3  LYS  54           2HE      LYS  54  -0.935   0.555   9.429
  421    HZ1  LYS  54           3HZ      LYS  54  -2.932   1.342  10.544
  422    HZ2  LYS  54           1HZ      LYS  54  -2.556  -0.236  11.021
  423    HZ3  LYS  54           2HZ      LYS  54  -3.815   0.041   9.928
  424    H    LEU  55           H        LEU  55   1.752   3.143   5.085
  425    HA   LEU  55           HA       LEU  55   3.819   3.495   7.052
  426    HB2  LEU  55           1HB      LEU  55   5.023   2.193   5.398
  427    HB3  LEU  55           2HB      LEU  55   4.506   3.271   4.121
  428    HG   LEU  55           HG       LEU  55   6.097   4.442   6.358
  429   HD11  LEU  55          1HD1      LEU  55   7.231   2.746   4.137
  430   HD12  LEU  55          2HD1      LEU  55   7.362   2.443   5.869
  431   HD13  LEU  55          3HD1      LEU  55   8.173   3.835   5.152
  432   HD21  LEU  55          3HD2      LEU  55   5.057   5.686   4.424
  433   HD22  LEU  55          1HD2      LEU  55   6.228   4.873   3.390
  434   HD23  LEU  55          2HD2      LEU  55   6.785   5.945   4.674
  435    H    ASP  56           H        ASP  56   4.502   5.626   7.244
  436    HA   ASP  56           HA       ASP  56   2.760   7.595   5.939
  437    HB2  ASP  56           1HB      ASP  56   2.476   7.684   8.283
  438    HB3  ASP  56           2HB      ASP  56   4.202   7.535   8.582
  439    H    VAL  57           H        VAL  57   3.596   8.940   4.487
  440    HA   VAL  57           HA       VAL  57   6.344   8.851   3.761
  441    HB   VAL  57           HB       VAL  57   4.596   9.212   2.111
  442   HG11  VAL  57          1HG1      VAL  57   3.456  11.369   2.002
  443   HG12  VAL  57          2HG1      VAL  57   4.200  11.807   3.540
  444   HG13  VAL  57          3HG1      VAL  57   3.073  10.455   3.460
  445   HG21  VAL  57          3HG2      VAL  57   6.423  11.604   2.321
  446   HG22  VAL  57          1HG2      VAL  57   5.617  11.032   0.861
  447   HG23  VAL  57          2HG2      VAL  57   6.860  10.043   1.628
  448    H    ASP  58           H        ASP  58   4.483  10.852   5.893
  449    HA   ASP  58           HA       ASP  58   6.182  13.132   5.887
  450    HB2  ASP  58           1HB      ASP  58   3.872  13.188   6.756
  451    HB3  ASP  58           2HB      ASP  58   4.363  12.146   8.088
  452    H    GLU  59           H        GLU  59   6.296  10.028   7.354
  453    HA   GLU  59           HA       GLU  59   8.541  10.791   9.069
  454    HB2  GLU  59           1HB      GLU  59   6.612   9.365   9.905
  455    HB3  GLU  59           2HB      GLU  59   7.208   8.088   8.856
  456    HG2  GLU  59           1HG      GLU  59   8.003   7.676  11.060
  457    HG3  GLU  59           2HG      GLU  59   9.372   8.182  10.071
  458    H    LEU  60           H        LEU  60   7.716   8.611   6.379
  459    HA   LEU  60           HA       LEU  60  10.605   8.185   5.971
  460    HB2  LEU  60           1HB      LEU  60   8.297   6.309   5.629
  461    HB3  LEU  60           2HB      LEU  60   9.808   6.040   4.798
  462    HG   LEU  60           HG       LEU  60   9.930   4.668   6.673
  463   HD11  LEU  60          1HD1      LEU  60  11.943   6.041   6.371
  464   HD12  LEU  60          2HD1      LEU  60  11.696   5.549   8.045
  465   HD13  LEU  60          3HD1      LEU  60  11.310   7.195   7.547
  466   HD21  LEU  60          3HD2      LEU  60   9.367   5.346   8.941
  467   HD22  LEU  60          1HD2      LEU  60   7.991   5.530   7.855
  468   HD23  LEU  60          2HD2      LEU  60   8.914   6.946   8.356
  469    H    GLY  61           H        GLY  61  10.475  10.159   4.644
  470    HA2  GLY  61           1HA      GLY  61   8.989  10.161   2.202
  471    HA3  GLY  61           2HA      GLY  61  10.291  11.260   2.627
  472    H    ASP  62           H        ASP  62  12.212   9.112   3.104
  473    HA   ASP  62           HA       ASP  62  13.217   8.824   0.463
  474    HB2  ASP  62           1HB      ASP  62  14.968   7.415   1.522
  475    HB3  ASP  62           2HB      ASP  62  14.754   8.957   2.339
  476    H    VAL  63           H        VAL  63  11.245   6.849   2.477
  477    HA   VAL  63           HA       VAL  63  11.388   4.497   0.874
  478    HB   VAL  63           HB       VAL  63   9.097   5.452   2.596
  479   HG11  VAL  63          1HG1      VAL  63   8.495   3.068   2.675
  480   HG12  VAL  63          2HG1      VAL  63   9.800   2.711   1.546
  481   HG13  VAL  63          3HG1      VAL  63   8.440   3.706   1.034
  482   HG21  VAL  63          3HG2      VAL  63  11.264   5.262   3.795
  483   HG22  VAL  63          1HG2      VAL  63  11.341   3.573   3.307
  484   HG23  VAL  63          2HG2      VAL  63  10.045   4.121   4.364
  485    H    ALA  64           H        ALA  64   9.023   7.191   1.018
  486    HA   ALA  64           HA       ALA  64   7.508   6.585  -1.208
  487    HB1  ALA  64           1HB      ALA  64   8.396   9.367  -0.439
  488    HB2  ALA  64           2HB      ALA  64   7.154   8.454   0.411
  489    HB3  ALA  64           3HB      ALA  64   6.915   8.901  -1.276
  490    H    GLN  65           H        GLN  65  10.814   7.702  -1.164
  491    HA   GLN  65           HA       GLN  65  10.763   8.302  -4.005
  492    HB2  GLN  65           1HB      GLN  65  13.105   8.125  -2.097
  493    HB3  GLN  65           2HB      GLN  65  13.177   8.719  -3.751
  494    HG2  GLN  65           1HG      GLN  65  11.648   9.954  -1.472
  495    HG3  GLN  65           2HG      GLN  65  13.139  10.563  -2.191
  496   HE21  GLN  65          1HE2      GLN  65  13.069  11.495  -4.244
  497   HE22  GLN  65          2HE2      GLN  65  11.590  12.038  -4.955
  498    H    LYS  66           H        LYS  66  11.515   5.647  -1.922
  499    HA   LYS  66           HA       LYS  66  12.962   4.134  -3.816
  500    HB2  LYS  66           1HB      LYS  66  13.444   3.668  -1.590
  501    HB3  LYS  66           2HB      LYS  66  11.759   3.697  -1.112
  502    HG2  LYS  66           1HG      LYS  66  12.497   1.482  -0.954
  503    HG3  LYS  66           2HG      LYS  66  11.454   1.598  -2.364
  504    HD2  LYS  66           1HD      LYS  66  13.304   1.528  -3.858
  505    HD3  LYS  66           2HD      LYS  66  14.455   1.790  -2.550
  506    HE2  LYS  66           1HE      LYS  66  14.653  -0.489  -3.050
  507    HE3  LYS  66           2HE      LYS  66  13.636  -0.443  -1.615
  508    HZ1  LYS  66           3HZ      LYS  66  11.689  -0.662  -3.100
  509    HZ2  LYS  66           1HZ      LYS  66  12.735  -1.995  -3.178
  510    HZ3  LYS  66           2HZ      LYS  66  12.735  -0.839  -4.416
  511    H    ASN  67           H        ASN  67   9.602   4.641  -3.110
  512    HA   ASN  67           HA       ASN  67   8.827   2.299  -4.736
  513    HB2  ASN  67           1HB      ASN  67   6.534   2.901  -3.621
  514    HB3  ASN  67           2HB      ASN  67   7.744   2.033  -2.695
  515   HD21  ASN  67          1HD2      ASN  67   7.438   2.755  -0.703
  516   HD22  ASN  67          2HD2      ASN  67   7.484   4.422  -0.272
  517    H    GLU  68           H        GLU  68   8.956   5.685  -4.723
  518    HA   GLU  68           HA       GLU  68   8.534   7.127  -6.416
  519    HB2  GLU  68           1HB      GLU  68   8.697   5.136  -7.907
  520    HB3  GLU  68           2HB      GLU  68   6.947   4.951  -7.772
  521    HG2  GLU  68           1HG      GLU  68   6.717   7.237  -8.742
  522    HG3  GLU  68           2HG      GLU  68   8.464   7.271  -8.982
  523    H    VAL  69           H        VAL  69   6.575   6.269  -4.145
  524    HA   VAL  69           HA       VAL  69   4.177   7.532  -5.228
  525    HB   VAL  69           HB       VAL  69   3.336   5.957  -3.811
  526   HG11  VAL  69          1HG1      VAL  69   5.473   5.101  -2.987
  527   HG12  VAL  69          2HG1      VAL  69   4.279   5.244  -1.694
  528   HG13  VAL  69          3HG1      VAL  69   5.570   6.446  -1.840
  529   HG21  VAL  69          3HG2      VAL  69   2.587   6.960  -1.718
  530   HG22  VAL  69          1HG2      VAL  69   2.454   8.092  -3.063
  531   HG23  VAL  69          2HG2      VAL  69   3.778   8.246  -1.907
  532    H    SER  70           H        SER  70   3.599   9.584  -4.965
  533    HA   SER  70           HA       SER  70   5.274  11.265  -3.217
  534    HB2  SER  70           1HB      SER  70   4.122  12.105  -5.883
  535    HB3  SER  70           2HB      SER  70   5.263  13.003  -4.883
  536    HG   SER  70           HG       SER  70   6.614  10.976  -5.194
  537    H    ALA  71           H        ALA  71   2.112  10.507  -4.424
  538    HA   ALA  71           HA       ALA  71   0.911  12.777  -3.021
  539    HB1  ALA  71           1HB      ALA  71  -1.151  12.151  -4.169
  540    HB2  ALA  71           2HB      ALA  71  -0.351  10.736  -4.853
  541    HB3  ALA  71           3HB      ALA  71   0.172  12.354  -5.317
  542    H    MET  72           H        MET  72  -1.129  12.273  -1.769
  543    HA   MET  72           HA       MET  72  -1.179   9.630  -0.573
  544    HB2  MET  72           1HB      MET  72  -1.079  10.514   1.734
  545    HB3  MET  72           2HB      MET  72   0.423  10.747   0.856
  546    HG2  MET  72           1HG      MET  72  -1.651  12.903   1.111
  547    HG3  MET  72           2HG      MET  72  -0.382  12.659   2.306
  548    HE1  MET  72           3HE      MET  72   2.084  11.775   0.438
  549    HE2  MET  72           1HE      MET  72   2.197  12.897   1.794
  550    HE3  MET  72           2HE      MET  72   2.857  13.346   0.220
  551    HA   PRO  73           HA       PRO  73  -2.155   8.597   0.842
  552    HB2  PRO  73           1HB      PRO  73  -4.227   6.889   0.937
  553    HB3  PRO  73           2HB      PRO  73  -3.917   8.073   2.209
  554    HG2  PRO  73           1HG      PRO  73  -5.952   8.105   0.042
  555    HG3  PRO  73           2HG      PRO  73  -6.065   8.727   1.702
  556    HD2  PRO  73           1HD      PRO  73  -5.576  10.252  -0.591
  557    HD3  PRO  73           2HD      PRO  73  -5.273  10.765   1.078
  558    H    THR  74           H        THR  74  -1.455   6.732  -0.169
  559    HA   THR  74           HA       THR  74  -2.344   6.257  -2.934
  560    HB   THR  74           HB       THR  74   0.487   6.706  -1.970
  561    HG1  THR  74           1HG      THR  74  -0.031   8.595  -2.758
  562   HG21  THR  74          3HG2      THR  74  -0.400   5.489  -4.591
  563   HG22  THR  74          1HG2      THR  74   0.582   4.726  -3.338
  564   HG23  THR  74          2HG2      THR  74   1.231   6.084  -4.254
  565    H    LEU  75           H        LEU  75  -2.480   4.189  -3.485
  566    HA   LEU  75           HA       LEU  75  -1.467   2.167  -1.587
  567    HB2  LEU  75           1HB      LEU  75  -3.490   1.898  -3.809
  568    HB3  LEU  75           2HB      LEU  75  -3.023   0.637  -2.682
  569    HG   LEU  75           HG       LEU  75  -3.921   2.525  -0.963
  570   HD11  LEU  75          1HD1      LEU  75  -5.728   2.759  -3.377
  571   HD12  LEU  75          2HD1      LEU  75  -4.606   4.011  -2.840
  572   HD13  LEU  75          3HD1      LEU  75  -5.945   3.527  -1.802
  573   HD21  LEU  75          3HD2      LEU  75  -5.393   0.347  -2.411
  574   HD22  LEU  75          1HD2      LEU  75  -6.042   1.191  -1.007
  575   HD23  LEU  75          2HD2      LEU  75  -4.554   0.258  -0.859
  576    H    LEU  76           H        LEU  76   0.350   1.114  -2.283
  577    HA   LEU  76           HA       LEU  76   0.708   0.883  -5.194
  578    HB2  LEU  76           1HB      LEU  76   2.437   2.046  -3.417
  579    HB3  LEU  76           2HB      LEU  76   3.117   0.443  -3.592
  580    HG   LEU  76           HG       LEU  76   2.556   2.395  -5.835
  581   HD11  LEU  76          1HD1      LEU  76   4.460   2.992  -4.371
  582   HD12  LEU  76          2HD1      LEU  76   4.945   2.638  -6.034
  583   HD13  LEU  76          3HD1      LEU  76   5.205   1.438  -4.752
  584   HD21  LEU  76          3HD2      LEU  76   2.238   0.115  -6.594
  585   HD22  LEU  76          1HD2      LEU  76   3.787  -0.366  -5.902
  586   HD23  LEU  76          2HD2      LEU  76   3.737   0.763  -7.256
  587    H    LEU  77           H        LEU  77   0.367  -0.985  -5.926
  588    HA   LEU  77           HA       LEU  77   0.455  -3.357  -4.199
  589    HB2  LEU  77           1HB      LEU  77  -0.721  -2.829  -6.934
  590    HB3  LEU  77           2HB      LEU  77  -0.582  -4.441  -6.274
  591    HG   LEU  77           HG       LEU  77  -2.292  -4.090  -4.704
  592   HD11  LEU  77          1HD1      LEU  77  -3.235  -1.913  -4.143
  593   HD12  LEU  77          2HD1      LEU  77  -2.105  -1.118  -5.239
  594   HD13  LEU  77          3HD1      LEU  77  -1.507  -1.935  -3.795
  595   HD21  LEU  77          3HD2      LEU  77  -4.140  -3.272  -6.016
  596   HD22  LEU  77          1HD2      LEU  77  -3.043  -4.206  -7.036
  597   HD23  LEU  77          2HD2      LEU  77  -3.033  -2.441  -7.111
  598    H    PHE  78           H        PHE  78   2.094  -4.770  -4.382
  599    HA   PHE  78           HA       PHE  78   3.710  -4.666  -6.846
  600    HB2  PHE  78           1HB      PHE  78   4.608  -4.873  -3.981
  601    HB3  PHE  78           2HB      PHE  78   5.611  -5.459  -5.300
  602    HD1  PHE  78           1HD      PHE  78   4.181  -2.502  -3.700
  603    HD2  PHE  78           2HD      PHE  78   6.714  -3.946  -6.791
  604    HE1  PHE  78           1HE      PHE  78   5.118  -0.257  -3.983
  605    HE2  PHE  78           2HE      PHE  78   7.654  -1.696  -7.085
  606    HZ   PHE  78           HZ       PHE  78   6.858   0.157  -5.675
  607    H    LYS  79           H        LYS  79   4.541  -6.701  -7.583
  608    HA   LYS  79           HA       LYS  79   3.928  -9.019  -5.872
  609    HB2  LYS  79           1HB      LYS  79   2.249  -8.808  -7.737
  610    HB3  LYS  79           2HB      LYS  79   3.574  -9.038  -8.869
  611    HG2  LYS  79           1HG      LYS  79   3.995 -11.245  -7.999
  612    HG3  LYS  79           2HG      LYS  79   2.768 -11.017  -6.750
  613    HD2  LYS  79           1HD      LYS  79   1.044 -10.824  -8.462
  614    HD3  LYS  79           2HD      LYS  79   2.264 -11.005  -9.724
  615    HE2  LYS  79           1HE      LYS  79   2.786 -13.247  -8.891
  616    HE3  LYS  79           2HE      LYS  79   1.567 -13.061  -7.630
  617    HZ1  LYS  79           3HZ      LYS  79   1.014 -12.989 -10.544
  618    HZ2  LYS  79           1HZ      LYS  79  -0.139 -12.905  -9.305
  619    HZ3  LYS  79           2HZ      LYS  79   0.754 -14.326  -9.544
  620    H    ASN  80           H        ASN  80   5.655 -10.175  -5.484
  621    HA   ASN  80           HA       ASN  80   7.806 -10.842  -5.404
  622    HB2  ASN  80           1HB      ASN  80   8.645 -11.993  -7.432
  623    HB3  ASN  80           2HB      ASN  80   7.030 -12.486  -6.954
  624   HD21  ASN  80          1HD2      ASN  80   8.991 -11.013  -9.369
  625   HD22  ASN  80          2HD2      ASN  80   7.770 -10.887 -10.589
  626    H    GLY  81           H        GLY  81   8.001  -8.242  -5.245
  627    HA2  GLY  81           1HA      GLY  81   9.716  -6.682  -5.302
  628    HA3  GLY  81           2HA      GLY  81  10.640  -7.812  -6.290
  629    H    LYS  82           H        LYS  82   7.671  -7.397  -7.677
  630    HA   LYS  82           HA       LYS  82   8.611  -5.173  -9.366
  631    HB2  LYS  82           1HB      LYS  82   6.833  -7.478 -10.201
  632    HB3  LYS  82           2HB      LYS  82   7.440  -6.195 -11.238
  633    HG2  LYS  82           1HG      LYS  82   9.726  -7.022 -10.897
  634    HG3  LYS  82           2HG      LYS  82   9.086  -8.332  -9.893
  635    HD2  LYS  82           1HD      LYS  82   7.829  -9.200 -11.760
  636    HD3  LYS  82           2HD      LYS  82   8.321  -7.843 -12.772
  637    HE2  LYS  82           1HE      LYS  82  10.211  -9.853 -11.557
  638    HE3  LYS  82           2HE      LYS  82   9.594  -9.930 -13.206
  639    HZ1  LYS  82           3HZ      LYS  82  11.253  -7.750 -12.066
  640    HZ2  LYS  82           1HZ      LYS  82  10.613  -7.768 -13.630
  641    HZ3  LYS  82           2HZ      LYS  82  11.764  -8.920 -13.171
  642    H    GLU  83           H        GLU  83   6.794  -3.884 -10.254
  643    HA   GLU  83           HA       GLU  83   4.789  -3.375  -8.295
  644    HB2  GLU  83           1HB      GLU  83   5.857  -1.730  -9.946
  645    HB3  GLU  83           2HB      GLU  83   4.809  -2.432 -11.166
  646    HG2  GLU  83           1HG      GLU  83   2.848  -1.676 -10.026
  647    HG3  GLU  83           2HG      GLU  83   3.812  -1.167  -8.630
  648    H    VAL  84           H        VAL  84   2.415  -3.247  -9.132
  649    HA   VAL  84           HA       VAL  84   1.778  -4.890 -11.401
  650    HB   VAL  84           HB       VAL  84  -0.210  -5.887 -10.030
  651   HG11  VAL  84          1HG1      VAL  84   1.492  -7.199 -11.224
  652   HG12  VAL  84          2HG1      VAL  84   1.030  -7.944  -9.695
  653   HG13  VAL  84          3HG1      VAL  84   2.557  -7.067  -9.823
  654   HG21  VAL  84          3HG2      VAL  84   0.291  -4.800  -7.950
  655   HG22  VAL  84          1HG2      VAL  84   1.907  -5.502  -7.937
  656   HG23  VAL  84          2HG2      VAL  84   0.493  -6.541  -7.765
  657    H    ALA  85           H        ALA  85   0.819  -2.702  -8.848
  658    HA   ALA  85           HA       ALA  85  -0.548  -1.055 -10.693
  659    HB1  ALA  85           1HB      ALA  85  -2.214  -2.652  -8.774
  660    HB2  ALA  85           2HB      ALA  85  -2.363  -2.569 -10.528
  661    HB3  ALA  85           3HB      ALA  85  -2.786  -1.171  -9.540
  662    H    LYS  86           H        LYS  86  -1.044   0.998  -9.875
  663    HA   LYS  86           HA       LYS  86  -0.682   1.454  -7.026
  664    HB2  LYS  86           1HB      LYS  86   0.889   3.350  -7.456
  665    HB3  LYS  86           2HB      LYS  86   1.567   1.763  -7.782
  666    HG2  LYS  86           1HG      LYS  86   1.138   2.108 -10.186
  667    HG3  LYS  86           2HG      LYS  86   0.555   3.734  -9.818
  668    HD2  LYS  86           1HD      LYS  86   2.729   4.326  -8.903
  669    HD3  LYS  86           2HD      LYS  86   3.318   2.690  -9.200
  670    HE2  LYS  86           1HE      LYS  86   4.095   4.170 -10.947
  671    HE3  LYS  86           2HE      LYS  86   2.938   3.016 -11.609
  672    HZ1  LYS  86           3HZ      LYS  86   2.325   5.819 -10.852
  673    HZ2  LYS  86           1HZ      LYS  86   1.235   4.712 -11.522
  674    HZ3  LYS  86           2HZ      LYS  86   2.552   5.258 -12.429
  675    H    VAL  87           H        VAL  87  -2.074   2.909  -6.278
  676    HA   VAL  87           HA       VAL  87  -3.384   4.724  -8.178
  677    HB   VAL  87           HB       VAL  87  -5.560   4.254  -6.922
  678   HG11  VAL  87          1HG1      VAL  87  -4.380   2.108  -8.686
  679   HG12  VAL  87          2HG1      VAL  87  -5.208   3.567  -9.228
  680   HG13  VAL  87          3HG1      VAL  87  -6.097   2.326  -8.348
  681   HG21  VAL  87          3HG2      VAL  87  -4.016   1.776  -6.169
  682   HG22  VAL  87          1HG2      VAL  87  -5.752   2.003  -5.958
  683   HG23  VAL  87          2HG2      VAL  87  -4.617   3.013  -5.065
  684    H    VAL  88           H        VAL  88  -3.940   6.681  -7.382
  685    HA   VAL  88           HA       VAL  88  -2.870   7.285  -4.724
  686    HB   VAL  88           HB       VAL  88  -2.871   9.663  -5.524
  687   HG11  VAL  88          1HG1      VAL  88  -0.920   9.391  -6.988
  688   HG12  VAL  88          2HG1      VAL  88  -1.307   7.681  -7.173
  689   HG13  VAL  88          3HG1      VAL  88  -0.851   8.313  -5.592
  690   HG21  VAL  88          3HG2      VAL  88  -3.519   8.405  -8.193
  691   HG22  VAL  88          1HG2      VAL  88  -3.094  10.093  -7.919
  692   HG23  VAL  88          2HG2      VAL  88  -4.595   9.444  -7.259
  693    H    GLY  89           H        GLY  89  -5.294   6.101  -4.532
  694    HA2  GLY  89           1HA      GLY  89  -6.844   7.981  -3.151
  695    HA3  GLY  89           2HA      GLY  89  -7.541   7.761  -4.749
  696    H    ALA  90           H        ALA  90  -8.065   6.919  -1.764
  697    HA   ALA  90           HA       ALA  90  -8.345   4.106  -1.814
  698    HB1  ALA  90           1HB      ALA  90  -9.855   6.118  -0.177
  699    HB2  ALA  90           2HB      ALA  90  -8.258   5.496   0.216
  700    HB3  ALA  90           3HB      ALA  90  -9.649   4.403   0.182
  701    H    ASN  91           H        ASN  91  -9.569   3.172  -3.317
  702    HA   ASN  91           HA       ASN  91 -12.293   4.216  -3.680
  703    HB2  ASN  91           1HB      ASN  91 -10.418   3.963  -5.617
  704    HB3  ASN  91           2HB      ASN  91 -11.166   2.369  -5.697
  705   HD21  ASN  91          1HD2      ASN  91 -12.894   5.263  -4.753
  706   HD22  ASN  91          2HD2      ASN  91 -13.913   5.333  -6.147
  707    HA   PRO  92           HA       PRO  92 -12.803   0.774  -0.744
  708    HB2  PRO  92           1HB      PRO  92 -15.505   1.273  -1.953
  709    HB3  PRO  92           2HB      PRO  92 -15.092   0.851  -0.286
  710    HG2  PRO  92           1HG      PRO  92 -15.520   3.398  -1.019
  711    HG3  PRO  92           2HG      PRO  92 -14.310   2.965   0.202
  712    HD2  PRO  92           1HD      PRO  92 -13.912   4.019  -2.496
  713    HD3  PRO  92           2HD      PRO  92 -12.746   3.892  -1.169
  714    H    ALA  93           H        ALA  93 -14.923   0.423  -3.618
  715    HA   ALA  93           HA       ALA  93 -14.570  -2.438  -3.448
  716    HB1  ALA  93           1HB      ALA  93 -16.766  -1.459  -3.944
  717    HB2  ALA  93           2HB      ALA  93 -16.233  -2.572  -5.204
  718    HB3  ALA  93           3HB      ALA  93 -16.132  -0.831  -5.465
  719    H    ALA  94           H        ALA  94 -13.685   0.115  -5.740
  720    HA   ALA  94           HA       ALA  94 -12.702  -1.596  -7.754
  721    HB1  ALA  94           1HB      ALA  94 -11.825   1.223  -7.162
  722    HB2  ALA  94           2HB      ALA  94 -13.237   0.779  -8.121
  723    HB3  ALA  94           3HB      ALA  94 -11.619   0.355  -8.681
  724    H    ILE  95           H        ILE  95 -11.251  -0.345  -4.827
  725    HA   ILE  95           HA       ILE  95  -8.589  -1.129  -5.500
  726    HB   ILE  95           HB       ILE  95  -9.831  -0.607  -2.800
  727   HG12  ILE  95          1HG1      ILE  95  -9.725   1.395  -4.162
  728   HG13  ILE  95          2HG1      ILE  95  -8.490   1.483  -2.910
  729   HG21  ILE  95          1HG2      ILE  95  -6.947  -1.057  -3.541
  730   HG22  ILE  95          2HG2      ILE  95  -7.959  -2.126  -2.572
  731   HG23  ILE  95          3HG2      ILE  95  -7.521  -0.530  -1.958
  732   HD11  ILE  95          3HD1      ILE  95  -6.812   0.779  -4.564
  733   HD12  ILE  95          1HD1      ILE  95  -7.611   2.293  -4.988
  734   HD13  ILE  95          2HD1      ILE  95  -8.065   0.798  -5.805
  735    H    LYS  96           H        LYS  96 -11.162  -2.556  -3.512
  736    HA   LYS  96           HA       LYS  96  -9.689  -4.840  -2.794
  737    HB2  LYS  96           1HB      LYS  96 -12.696  -4.533  -2.952
  738    HB3  LYS  96           2HB      LYS  96 -11.826  -5.809  -2.094
  739    HG2  LYS  96           1HG      LYS  96 -10.787  -4.077  -0.670
  740    HG3  LYS  96           2HG      LYS  96 -11.803  -2.871  -1.459
  741    HD2  LYS  96           1HD      LYS  96 -12.822  -5.273   0.061
  742    HD3  LYS  96           2HD      LYS  96 -12.703  -3.641   0.714
  743    HE2  LYS  96           1HE      LYS  96 -14.907  -3.707   0.076
  744    HE3  LYS  96           2HE      LYS  96 -14.160  -3.012  -1.357
  745    HZ1  LYS  96           3HZ      LYS  96 -14.190  -5.181  -2.399
  746    HZ2  LYS  96           1HZ      LYS  96 -15.749  -4.764  -1.898
  747    HZ3  LYS  96           2HZ      LYS  96 -14.847  -5.882  -1.011
  748    H    GLN  97           H        GLN  97 -11.605  -4.061  -5.592
  749    HA   GLN  97           HA       GLN  97 -11.526  -6.674  -6.728
  750    HB2  GLN  97           1HB      GLN  97 -13.181  -5.040  -7.457
  751    HB3  GLN  97           2HB      GLN  97 -11.918  -3.936  -7.972
  752    HG2  GLN  97           1HG      GLN  97 -12.006  -6.629  -9.223
  753    HG3  GLN  97           2HG      GLN  97 -13.249  -5.464  -9.670
  754   HE21  GLN  97          1HE2      GLN  97 -12.636  -3.553 -10.710
  755   HE22  GLN  97          2HE2      GLN  97 -11.118  -3.399 -11.520
  756    H    ALA  98           H        ALA  98  -9.418  -3.865  -6.808
  757    HA   ALA  98           HA       ALA  98  -7.776  -4.688  -8.940
  758    HB1  ALA  98           1HB      ALA  98  -6.186  -3.046  -8.104
  759    HB2  ALA  98           2HB      ALA  98  -7.121  -2.900  -6.616
  760    HB3  ALA  98           3HB      ALA  98  -7.823  -2.395  -8.153
  761    H    ILE  99           H        ILE  99  -7.380  -4.960  -5.448
  762    HA   ILE  99           HA       ILE  99  -4.909  -6.184  -5.358
  763    HB   ILE  99           HB       ILE  99  -7.113  -7.051  -3.491
  764   HG12  ILE  99          1HG1      ILE  99  -7.457  -4.723  -3.467
  765   HG13  ILE  99          2HG1      ILE  99  -6.383  -5.024  -2.104
  766   HG21  ILE  99          1HG2      ILE  99  -5.016  -8.145  -3.191
  767   HG22  ILE  99          2HG2      ILE  99  -5.214  -6.982  -1.879
  768   HG23  ILE  99          3HG2      ILE  99  -4.155  -6.609  -3.239
  769   HD11  ILE  99          3HD1      ILE  99  -5.641  -3.955  -4.803
  770   HD12  ILE  99          1HD1      ILE  99  -4.487  -4.365  -3.529
  771   HD13  ILE  99          2HD1      ILE  99  -5.663  -3.076  -3.268
  772    H    ALA 100           H        ALA 100  -8.097  -7.630  -5.895
  773    HA   ALA 100           HA       ALA 100  -7.094 -10.332  -5.852
  774    HB1  ALA 100           1HB      ALA 100  -9.357 -10.956  -6.524
  775    HB2  ALA 100           2HB      ALA 100  -9.748  -9.258  -6.798
  776    HB3  ALA 100           3HB      ALA 100  -9.383  -9.827  -5.169
  777    H    ALA 101           H        ALA 101  -7.341  -7.840  -8.179
  778    HA   ALA 101           HA       ALA 101  -7.308  -9.552 -10.501
  779    HB1  ALA 101           1HB      ALA 101  -6.802  -6.581 -10.305
  780    HB2  ALA 101           2HB      ALA 101  -8.392  -7.324 -10.513
  781    HB3  ALA 101           3HB      ALA 101  -7.165  -7.498 -11.768
  782    H    ASN 102           H        ASN 102  -5.022  -7.686  -8.609
  783    HA   ASN 102           HA       ASN 102  -2.895  -8.064 -10.523
  784    HB2  ASN 102           1HB      ASN 102  -2.888  -6.787  -7.794
  785    HB3  ASN 102           2HB      ASN 102  -1.523  -6.783  -8.900
  786   HD21  ASN 102          1HD2      ASN 102  -4.465  -5.350  -8.034
  787   HD22  ASN 102          2HD2      ASN 102  -4.572  -4.185  -9.305
  788    H    ALA 103           H        ALA 103  -4.067  -9.648  -7.718
  789    HA   ALA 103           HA       ALA 103  -1.649 -10.998  -7.027
  790    HB1  ALA 103           1HB      ALA 103  -3.067 -12.389  -5.608
  791    HB2  ALA 103           2HB      ALA 103  -4.506 -11.714  -6.375
  792    HB3  ALA 103           3HB      ALA 103  -3.455 -10.679  -5.409
  Start of MODEL    7
    1    H1   MET   1           1H       MET   1  -6.079  -6.074  12.185
    2    H2   MET   1           2H       MET   1  -4.734  -6.866  11.532
    3    H3   MET   1           3H       MET   1  -6.031  -6.445  10.536
    4    HA   MET   1           HA       MET   1  -5.608  -4.128  10.847
    5    HB2  MET   1           1HB      MET   1  -3.627  -3.370  12.035
    6    HB3  MET   1           2HB      MET   1  -4.742  -4.211  13.097
    7    HG2  MET   1           1HG      MET   1  -3.348  -6.150  13.133
    8    HG3  MET   1           2HG      MET   1  -2.288  -5.464  11.899
    9    HE1  MET   1           3HE      MET   1  -3.825  -3.017  14.283
   10    HE2  MET   1           1HE      MET   1  -2.817  -3.040  15.731
   11    HE3  MET   1           2HE      MET   1  -3.890  -4.394  15.383
   12    H    VAL   2           H        VAL   2  -3.592  -2.965   9.952
   13    HA   VAL   2           HA       VAL   2  -2.345  -4.688   7.923
   14    HB   VAL   2           HB       VAL   2  -3.230  -1.805   7.829
   15   HG11  VAL   2          1HG1      VAL   2  -1.001  -1.937   6.839
   16   HG12  VAL   2          2HG1      VAL   2  -2.229  -1.670   5.600
   17   HG13  VAL   2          3HG1      VAL   2  -1.527  -3.272   5.818
   18   HG21  VAL   2          3HG2      VAL   2  -3.834  -4.009   5.894
   19   HG22  VAL   2          1HG2      VAL   2  -4.684  -2.489   6.136
   20   HG23  VAL   2          2HG2      VAL   2  -4.787  -3.761   7.351
   21    H    THR   3           H        THR   3  -0.211  -4.833   7.920
   22    HA   THR   3           HA       THR   3   1.157  -4.224  10.287
   23    HB   THR   3           HB       THR   3   2.610  -4.904   7.757
   24    HG1  THR   3           1HG      THR   3   1.045  -6.373   7.530
   25   HG21  THR   3          3HG2      THR   3   3.880  -6.361   9.262
   26   HG22  THR   3          1HG2      THR   3   2.835  -5.892  10.603
   27   HG23  THR   3          2HG2      THR   3   3.883  -4.695   9.842
   28    H    GLN   4           H        GLN   4   2.850  -2.852  10.760
   29    HA   GLN   4           HA       GLN   4   2.850  -0.376   9.175
   30    HB2  GLN   4           1HB      GLN   4   2.142  -0.410  11.593
   31    HB3  GLN   4           2HB      GLN   4   3.799  -0.807  12.008
   32    HG2  GLN   4           1HG      GLN   4   3.271   1.582  12.275
   33    HG3  GLN   4           2HG      GLN   4   4.580   1.285  11.128
   34   HE21  GLN   4          1HE2      GLN   4   4.278   1.712   8.989
   35   HE22  GLN   4          2HE2      GLN   4   2.908   2.562   8.377
   36    H    PHE   5           H        PHE   5   4.530  -0.067   7.874
   37    HA   PHE   5           HA       PHE   5   7.009  -1.469   8.054
   38    HB2  PHE   5           1HB      PHE   5   6.054   0.863   6.431
   39    HB3  PHE   5           2HB      PHE   5   7.741   0.385   6.399
   40    HD1  PHE   5           2HD      PHE   5   7.051  -2.669   6.604
   41    HD2  PHE   5           1HD      PHE   5   5.711   0.510   4.112
   42    HE1  PHE   5           2HE      PHE   5   6.565  -4.277   4.812
   43    HE2  PHE   5           1HE      PHE   5   5.224  -1.096   2.318
   44    HZ   PHE   5           HZ       PHE   5   5.653  -3.491   2.666
   45    H    LYS   6           H        LYS   6   9.133  -0.343   8.089
   46    HA   LYS   6           HA       LYS   6   9.139   1.952   9.926
   47    HB2  LYS   6           1HB      LYS   6  11.262  -0.193   9.854
   48    HB3  LYS   6           2HB      LYS   6  11.076   1.087  11.042
   49    HG2  LYS   6           1HG      LYS   6   9.089  -1.124  10.626
   50    HG3  LYS   6           2HG      LYS   6  10.386  -1.174  11.818
   51    HD2  LYS   6           1HD      LYS   6   8.277   0.981  11.716
   52    HD3  LYS   6           2HD      LYS   6   8.155  -0.463  12.721
   53    HE2  LYS   6           1HE      LYS   6  10.275   0.178  13.827
   54    HE3  LYS   6           2HE      LYS   6  10.294   1.660  12.871
   55    HZ1  LYS   6           3HZ      LYS   6   8.160   0.890  14.789
   56    HZ2  LYS   6           1HZ      LYS   6   8.234   2.333  13.907
   57    HZ3  LYS   6           2HZ      LYS   6   9.390   2.008  15.095
   58    H    THR   7           H        THR   7  10.899   0.229   7.360
   59    HA   THR   7           HA       THR   7  11.891   2.847   6.444
   60    HB   THR   7           HB       THR   7  14.098   1.957   5.910
   61    HG1  THR   7           1HG      THR   7  13.285  -0.416   7.281
   62   HG21  THR   7          3HG2      THR   7  15.004   1.689   8.172
   63   HG22  THR   7          1HG2      THR   7  13.373   1.449   8.797
   64   HG23  THR   7          2HG2      THR   7  13.829   3.003   8.098
   65    H    ALA   8           H        ALA   8  13.097   2.436   4.208
   66    HA   ALA   8           HA       ALA   8  11.184   1.410   2.389
   67    HB1  ALA   8           1HB      ALA   8  14.042   2.268   2.026
   68    HB2  ALA   8           2HB      ALA   8  12.577   3.161   1.616
   69    HB3  ALA   8           3HB      ALA   8  13.019   1.724   0.701
   70    H    SER   9           H        SER   9  13.918   0.068   4.036
   71    HA   SER   9           HA       SER   9  14.384  -2.206   2.464
   72    HB2  SER   9           1HB      SER   9  14.592  -2.043   5.477
   73    HB3  SER   9           2HB      SER   9  15.508  -3.092   4.394
   74    HG   SER   9           HG       SER   9  16.369  -0.889   5.256
   75    H    GLU  10           H        GLU  10  12.270  -1.712   5.297
   76    HA   GLU  10           HA       GLU  10  10.934  -4.111   5.308
   77    HB2  GLU  10           1HB      GLU  10  10.195  -1.310   6.026
   78    HB3  GLU  10           2HB      GLU  10   8.975  -2.568   6.091
   79    HG2  GLU  10           1HG      GLU  10   9.960  -2.242   8.245
   80    HG3  GLU  10           2HG      GLU  10  10.366  -3.836   7.632
   81    H    PHE  11           H        PHE  11  10.297  -1.226   3.308
   82    HA   PHE  11           HA       PHE  11   7.909  -2.109   2.148
   83    HB2  PHE  11           1HB      PHE  11   8.878   0.213   1.943
   84    HB3  PHE  11           2HB      PHE  11  10.016  -0.414   0.753
   85    HD1  PHE  11           1HD      PHE  11   8.988  -1.551  -1.330
   86    HD2  PHE  11           2HD      PHE  11   6.808   1.028   1.262
   87    HE1  PHE  11           1HE      PHE  11   7.357  -1.132  -3.118
   88    HE2  PHE  11           2HE      PHE  11   5.161   1.462  -0.544
   89    HZ   PHE  11           HZ       PHE  11   5.451   0.369  -2.723
   90    H    ASP  12           H        ASP  12  11.180  -2.315   0.810
   91    HA   ASP  12           HA       ASP  12  10.547  -3.882  -1.430
   92    HB2  ASP  12           1HB      ASP  12  12.653  -2.742  -1.340
   93    HB3  ASP  12           2HB      ASP  12  13.119  -3.590   0.131
   94    H    SER  13           H        SER  13  11.346  -4.822   1.874
   95    HA   SER  13           HA       SER  13  11.783  -7.554   1.379
   96    HB2  SER  13           1HB      SER  13  12.415  -6.340   3.478
   97    HB3  SER  13           2HB      SER  13  10.711  -6.331   3.929
   98    HG   SER  13           HG       SER  13  12.326  -8.626   3.467
   99    H    ALA  14           H        ALA  14   8.829  -5.774   2.239
  100    HA   ALA  14           HA       ALA  14   7.149  -8.042   2.277
  101    HB1  ALA  14           1HB      ALA  14   5.291  -6.452   2.115
  102    HB2  ALA  14           2HB      ALA  14   6.441  -5.158   1.745
  103    HB3  ALA  14           3HB      ALA  14   6.476  -5.946   3.322
  104    H    ILE  15           H        ILE  15   8.227  -5.840  -0.208
  105    HA   ILE  15           HA       ILE  15   6.502  -6.595  -2.285
  106    HB   ILE  15           HB       ILE  15   9.361  -5.711  -2.554
  107   HG12  ILE  15          1HG1      ILE  15   8.381  -3.951  -1.370
  108   HG13  ILE  15          2HG1      ILE  15   8.223  -3.482  -3.057
  109   HG21  ILE  15          1HG2      ILE  15   8.912  -5.162  -4.758
  110   HG22  ILE  15          2HG2      ILE  15   7.169  -5.249  -4.521
  111   HG23  ILE  15          3HG2      ILE  15   8.129  -6.728  -4.538
  112   HD11  ILE  15          3HD1      ILE  15   5.907  -4.179  -3.059
  113   HD12  ILE  15          1HD1      ILE  15   6.204  -3.005  -1.778
  114   HD13  ILE  15          2HD1      ILE  15   6.051  -4.718  -1.386
  115    H    ALA  16           H        ALA  16   9.513  -7.947  -1.130
  116    HA   ALA  16           HA       ALA  16   9.997  -9.575  -3.414
  117    HB1  ALA  16           1HB      ALA  16  11.211  -9.727  -0.663
  118    HB2  ALA  16           2HB      ALA  16  11.794  -8.725  -1.990
  119    HB3  ALA  16           3HB      ALA  16  11.845 -10.481  -2.124
  120    H    GLN  17           H        GLN  17   7.683  -9.903  -1.168
  121    HA   GLN  17           HA       GLN  17   7.816 -12.705  -0.684
  122    HB2  GLN  17           1HB      GLN  17   5.626 -10.653  -0.386
  123    HB3  GLN  17           2HB      GLN  17   5.456 -12.329   0.079
  124    HG2  GLN  17           1HG      GLN  17   7.289 -12.087   1.667
  125    HG3  GLN  17           2HG      GLN  17   7.449 -10.396   1.207
  126   HE21  GLN  17          1HE2      GLN  17   4.616  -9.919   0.997
  127   HE22  GLN  17          2HE2      GLN  17   3.971  -9.929   2.601
  128    H    ASP  18           H        ASP  18   6.676 -14.333  -1.726
  129    HA   ASP  18           HA       ASP  18   6.032 -13.808  -4.490
  130    HB2  ASP  18           1HB      ASP  18   6.172 -16.290  -2.808
  131    HB3  ASP  18           2HB      ASP  18   5.408 -16.335  -4.392
  132    H    LYS  19           H        LYS  19   4.346 -12.412  -2.811
  133    HA   LYS  19           HA       LYS  19   1.756 -13.554  -3.561
  134    HB2  LYS  19           1HB      LYS  19   0.811 -13.012  -1.353
  135    HB3  LYS  19           2HB      LYS  19   2.104 -14.198  -1.213
  136    HG2  LYS  19           1HG      LYS  19   3.640 -12.272  -0.670
  137    HG3  LYS  19           2HG      LYS  19   2.194 -11.275  -0.530
  138    HD2  LYS  19           1HD      LYS  19   2.755 -13.775   1.063
  139    HD3  LYS  19           2HD      LYS  19   2.968 -12.125   1.647
  140    HE2  LYS  19           1HE      LYS  19   0.536 -11.744   1.207
  141    HE3  LYS  19           2HE      LYS  19   0.390 -13.464   0.843
  142    HZ1  LYS  19           3HZ      LYS  19   1.312 -12.316   3.424
  143    HZ2  LYS  19           1HZ      LYS  19   1.159 -13.966   3.074
  144    HZ3  LYS  19           2HZ      LYS  19  -0.216 -12.988   3.132
  145    H    LEU  20           H        LEU  20   0.019 -11.839  -3.352
  146    HA   LEU  20           HA       LEU  20   0.900  -9.398  -4.517
  147    HB2  LEU  20           1HB      LEU  20  -1.341 -10.543  -4.857
  148    HB3  LEU  20           2HB      LEU  20  -1.801  -9.938  -3.281
  149    HG   LEU  20           HG       LEU  20  -2.684  -8.617  -5.208
  150   HD11  LEU  20          1HD1      LEU  20  -0.822  -7.081  -3.408
  151   HD12  LEU  20          2HD1      LEU  20  -2.461  -7.589  -3.002
  152   HD13  LEU  20          3HD1      LEU  20  -2.195  -6.427  -4.302
  153   HD21  LEU  20          3HD2      LEU  20  -0.759  -8.856  -6.676
  154   HD22  LEU  20          1HD2      LEU  20   0.202  -7.856  -5.586
  155   HD23  LEU  20          2HD2      LEU  20  -1.181  -7.159  -6.429
  156    H    VAL  21           H        VAL  21   1.568  -7.607  -3.563
  157    HA   VAL  21           HA       VAL  21   1.292  -7.396  -0.642
  158    HB   VAL  21           HB       VAL  21   3.137  -5.655  -2.218
  159   HG11  VAL  21          1HG1      VAL  21   3.298  -6.908   0.516
  160   HG12  VAL  21          2HG1      VAL  21   2.874  -5.236   0.147
  161   HG13  VAL  21          3HG1      VAL  21   4.503  -5.828  -0.186
  162   HG21  VAL  21          3HG2      VAL  21   3.764  -7.694  -3.183
  163   HG22  VAL  21          1HG2      VAL  21   3.573  -8.572  -1.660
  164   HG23  VAL  21          2HG2      VAL  21   4.911  -7.447  -1.864
  165    H    VAL  22           H        VAL  22  -0.196  -5.999   0.061
  166    HA   VAL  22           HA       VAL  22  -0.935  -3.714  -1.623
  167    HB   VAL  22           HB       VAL  22  -2.223  -4.673   0.940
  168   HG11  VAL  22          1HG1      VAL  22  -3.239  -2.725  -1.127
  169   HG12  VAL  22          2HG1      VAL  22  -2.522  -2.271   0.419
  170   HG13  VAL  22          3HG1      VAL  22  -4.030  -3.179   0.383
  171   HG21  VAL  22          3HG2      VAL  22  -2.486  -6.345  -0.785
  172   HG22  VAL  22          1HG2      VAL  22  -3.042  -5.120  -1.925
  173   HG23  VAL  22          2HG2      VAL  22  -4.021  -5.520  -0.512
  174    H    VAL  23           H        VAL  23   0.470  -2.081  -1.304
  175    HA   VAL  23           HA       VAL  23   1.308  -1.572   1.454
  176    HB   VAL  23           HB       VAL  23   2.512  -0.423  -1.060
  177   HG11  VAL  23          1HG1      VAL  23   2.886   1.018   0.785
  178   HG12  VAL  23          2HG1      VAL  23   4.372   0.100   0.547
  179   HG13  VAL  23          3HG1      VAL  23   3.266  -0.332   1.849
  180   HG21  VAL  23          3HG2      VAL  23   2.873  -2.823  -0.971
  181   HG22  VAL  23          1HG2      VAL  23   3.424  -2.693   0.699
  182   HG23  VAL  23          2HG2      VAL  23   4.373  -1.970  -0.601
  183    H    ALA  24           H        ALA  24   0.677   0.062   2.511
  184    HA   ALA  24           HA       ALA  24  -1.218   1.952   1.267
  185    HB1  ALA  24           1HB      ALA  24  -2.043   0.498   3.061
  186    HB2  ALA  24           2HB      ALA  24  -2.063   2.188   3.568
  187    HB3  ALA  24           3HB      ALA  24  -0.795   1.102   4.148
  188    H    PHE  25           H        PHE  25   0.175   3.666   0.625
  189    HA   PHE  25           HA       PHE  25   1.808   4.839   2.763
  190    HB2  PHE  25           1HB      PHE  25   2.044   4.780  -0.169
  191    HB3  PHE  25           2HB      PHE  25   2.496   6.303   0.597
  192    HD1  PHE  25           2HD      PHE  25   2.871   2.731   1.518
  193    HD2  PHE  25           1HD      PHE  25   4.766   6.469   0.859
  194    HE1  PHE  25           2HE      PHE  25   5.017   1.747   2.188
  195    HE2  PHE  25           1HE      PHE  25   6.920   5.500   1.538
  196    HZ   PHE  25           HZ       PHE  25   7.044   3.131   2.201
  197    H    TYR  26           H        TYR  26   1.212   6.541   3.798
  198    HA   TYR  26           HA       TYR  26  -0.331   8.642   2.542
  199    HB2  TYR  26           1HB      TYR  26  -2.074   8.627   4.316
  200    HB3  TYR  26           2HB      TYR  26  -2.128   7.190   3.301
  201    HD1  TYR  26           1HD      TYR  26  -1.478   5.014   4.199
  202    HD2  TYR  26           2HD      TYR  26  -1.463   8.480   6.659
  203    HE1  TYR  26           1HE      TYR  26  -1.358   3.587   6.187
  204    HE2  TYR  26           2HE      TYR  26  -1.340   7.065   8.662
  205    HH   TYR  26           HH       TYR  26  -1.809   4.823   9.372
  206    H    ALA  27           H        ALA  27  -0.818  10.330   4.476
  207    HA   ALA  27           HA       ALA  27   1.603  10.441   6.139
  208    HB1  ALA  27           1HB      ALA  27   0.415  12.836   4.762
  209    HB2  ALA  27           2HB      ALA  27   1.747  11.896   4.099
  210    HB3  ALA  27           3HB      ALA  27   1.943  12.736   5.638
  211    H    THR  28           H        THR  28   1.299  11.052   8.192
  212    HA   THR  28           HA       THR  28  -1.278  11.094   9.312
  213    HB   THR  28           HB       THR  28   0.124  12.147  11.313
  214    HG1  THR  28           1HG      THR  28   2.131  10.872   9.724
  215   HG21  THR  28          3HG2      THR  28   0.554   9.315  10.362
  216   HG22  THR  28          1HG2      THR  28  -0.889   9.881  11.208
  217   HG23  THR  28          2HG2      THR  28   0.676   9.908  12.020
  218    H    TRP  29           H        TRP  29   0.628  13.694   8.014
  219    HA   TRP  29           HA       TRP  29  -0.941  15.715   9.360
  220    HB2  TRP  29           1HB      TRP  29   0.329  17.342   8.017
  221    HB3  TRP  29           2HB      TRP  29   1.385  16.233   8.877
  222    HD1  TRP  29           HD       TRP  29   3.140  14.962   7.472
  223    HE1  TRP  29           1HE      TRP  29   3.714  14.830   4.967
  224    HE3  TRP  29           3HE      TRP  29  -0.939  17.386   5.571
  225    HZ2  TRP  29           2HZ      TRP  29   2.586  15.641   2.518
  226    HZ3  TRP  29           3HZ      TRP  29  -1.119  17.660   3.140
  227    HH2  TRP  29           HH       TRP  29   0.611  16.809   1.641
  228    H    CYS  30           H        CYS  30  -1.324  13.738   6.690
  229    HA   CYS  30           HA       CYS  30  -2.839  15.592   5.070
  230    HB2  CYS  30           1HB      CYS  30  -1.499  13.812   4.020
  231    HB3  CYS  30           2HB      CYS  30  -2.461  12.593   4.843
  232    HG   CYS  30           HG       CYS  30  -3.375  14.604   2.249
  233    H    GLY  31           H        GLY  31  -5.082  15.465   4.716
  234    HA2  GLY  31           1HA      GLY  31  -6.607  14.739   7.031
  235    HA3  GLY  31           2HA      GLY  31  -7.236  15.418   5.539
  236    HA   PRO  32           HA       PRO  32  -8.880  11.584   4.265
  237    HB2  PRO  32           1HB      PRO  32  -7.541  11.523   1.663
  238    HB3  PRO  32           2HB      PRO  32  -9.244  11.789   2.042
  239    HG2  PRO  32           1HG      PRO  32  -7.662  13.763   1.125
  240    HG3  PRO  32           2HG      PRO  32  -8.973  14.066   2.280
  241    HD2  PRO  32           1HD      PRO  32  -6.029  13.793   2.784
  242    HD3  PRO  32           2HD      PRO  32  -7.178  14.976   3.445
  243    H    CYS  33           H        CYS  33  -5.844  11.468   5.200
  244    HA   CYS  33           HA       CYS  33  -4.824   9.091   4.012
  245    HB2  CYS  33           1HB      CYS  33  -3.347   9.008   6.014
  246    HB3  CYS  33           2HB      CYS  33  -3.340  10.582   5.227
  247    HG   CYS  33           HG       CYS  33  -4.072  11.963   7.265
  248    H    LYS  34           H        LYS  34  -7.048   9.814   6.539
  249    HA   LYS  34           HA       LYS  34  -7.163   7.271   7.753
  250    HB2  LYS  34           1HB      LYS  34  -9.133   9.553   7.694
  251    HB3  LYS  34           2HB      LYS  34  -9.359   8.098   8.656
  252    HG2  LYS  34           1HG      LYS  34  -7.339   8.571   9.901
  253    HG3  LYS  34           2HG      LYS  34  -7.030   9.990   8.900
  254    HD2  LYS  34           1HD      LYS  34  -9.034  11.056   9.721
  255    HD3  LYS  34           2HD      LYS  34  -9.471   9.608  10.630
  256    HE2  LYS  34           1HE      LYS  34  -7.527   9.855  12.037
  257    HE3  LYS  34           2HE      LYS  34  -6.967  11.224  11.080
  258    HZ1  LYS  34           3HZ      LYS  34  -8.059  11.895  13.148
  259    HZ2  LYS  34           1HZ      LYS  34  -9.495  11.162  12.636
  260    HZ3  LYS  34           2HZ      LYS  34  -8.871  12.487  11.787
  261    H    MET  35           H        MET  35  -8.129   8.238   4.667
  262    HA   MET  35           HA       MET  35 -10.400   6.474   4.433
  263    HB2  MET  35           1HB      MET  35  -9.470   8.509   2.894
  264    HB3  MET  35           2HB      MET  35  -8.805   7.136   2.019
  265    HG2  MET  35           1HG      MET  35 -11.700   7.714   2.601
  266    HG3  MET  35           2HG      MET  35 -10.896   7.716   1.035
  267    HE1  MET  35           3HE      MET  35 -12.400   6.045  -0.290
  268    HE2  MET  35           1HE      MET  35 -13.507   6.246   1.070
  269    HE3  MET  35           2HE      MET  35 -13.135   4.632   0.464
  270    H    ILE  36           H        ILE  36  -6.940   6.353   3.905
  271    HA   ILE  36           HA       ILE  36  -6.950   3.786   2.653
  272    HB   ILE  36           HB       ILE  36  -4.960   5.808   3.325
  273   HG12  ILE  36          1HG1      ILE  36  -4.091   5.216   1.166
  274   HG13  ILE  36          2HG1      ILE  36  -4.991   3.705   1.167
  275   HG21  ILE  36          1HG2      ILE  36  -4.168   2.909   3.436
  276   HG22  ILE  36          2HG2      ILE  36  -3.969   4.121   4.701
  277   HG23  ILE  36          3HG2      ILE  36  -3.037   4.240   3.208
  278   HD11  ILE  36          3HD1      ILE  36  -7.078   4.925   1.084
  279   HD12  ILE  36          1HD1      ILE  36  -6.031   5.362  -0.269
  280   HD13  ILE  36          2HD1      ILE  36  -6.200   6.453   1.107
  281    H    ALA  37           H        ALA  37  -6.735   4.964   5.901
  282    HA   ALA  37           HA       ALA  37  -5.663   2.744   7.154
  283    HB1  ALA  37           1HB      ALA  37  -7.084   3.443   9.137
  284    HB2  ALA  37           2HB      ALA  37  -7.698   4.732   8.101
  285    HB3  ALA  37           3HB      ALA  37  -5.981   4.644   8.472
  286    HA   PRO  38           HA       PRO  38  -9.722   0.478   7.689
  287    HB2  PRO  38           1HB      PRO  38 -12.127   1.443   7.052
  288    HB3  PRO  38           2HB      PRO  38 -11.274   1.983   8.504
  289    HG2  PRO  38           1HG      PRO  38 -11.551   3.329   5.858
  290    HG3  PRO  38           2HG      PRO  38 -11.616   4.031   7.483
  291    HD2  PRO  38           1HD      PRO  38  -9.398   4.064   5.831
  292    HD3  PRO  38           2HD      PRO  38  -9.362   4.255   7.591
  293    H    MET  39           H        MET  39  -9.737   2.168   4.530
  294    HA   MET  39           HA       MET  39 -11.337   0.202   3.213
  295    HB2  MET  39           1HB      MET  39 -11.111   2.352   2.150
  296    HB3  MET  39           2HB      MET  39  -9.365   2.263   2.255
  297    HG2  MET  39           1HG      MET  39  -9.774   0.109   0.759
  298    HG3  MET  39           2HG      MET  39 -11.206   1.037   0.309
  299    HE1  MET  39           3HE      MET  39  -8.106   3.128   1.423
  300    HE2  MET  39           1HE      MET  39  -7.021   2.926   0.054
  301    HE3  MET  39           2HE      MET  39  -7.418   1.538   1.085
  302    H    ILE  40           H        ILE  40  -7.888   0.711   3.589
  303    HA   ILE  40           HA       ILE  40  -7.083  -1.505   2.008
  304    HB   ILE  40           HB       ILE  40  -5.908   0.649   3.473
  305   HG12  ILE  40          1HG1      ILE  40  -4.443  -1.094   1.537
  306   HG13  ILE  40          2HG1      ILE  40  -5.804  -0.115   0.995
  307   HG21  ILE  40          1HG2      ILE  40  -4.521  -2.004   3.819
  308   HG22  ILE  40          2HG2      ILE  40  -5.117  -0.937   5.091
  309   HG23  ILE  40          3HG2      ILE  40  -3.763  -0.433   4.081
  310   HD11  ILE  40          3HD1      ILE  40  -3.362   0.795   0.891
  311   HD12  ILE  40          1HD1      ILE  40  -3.659   1.173   2.587
  312   HD13  ILE  40          2HD1      ILE  40  -4.705   1.847   1.338
  313    H    GLU  41           H        GLU  41  -7.559  -1.047   5.515
  314    HA   GLU  41           HA       GLU  41  -6.844  -3.683   6.240
  315    HB2  GLU  41           1HB      GLU  41  -8.867  -1.795   7.472
  316    HB3  GLU  41           2HB      GLU  41  -8.459  -3.355   8.171
  317    HG2  GLU  41           1HG      GLU  41  -6.069  -2.556   8.238
  318    HG3  GLU  41           2HG      GLU  41  -6.692  -0.955   7.836
  319    H    LYS  42           H        LYS  42  -9.705  -2.340   4.789
  320    HA   LYS  42           HA       LYS  42 -11.426  -4.541   5.268
  321    HB2  LYS  42           1HB      LYS  42 -12.249  -2.266   4.822
  322    HB3  LYS  42           2HB      LYS  42 -11.617  -2.348   3.184
  323    HG2  LYS  42           1HG      LYS  42 -14.020  -2.727   3.231
  324    HG3  LYS  42           2HG      LYS  42 -13.166  -4.172   2.681
  325    HD2  LYS  42           1HD      LYS  42 -13.388  -5.184   4.863
  326    HD3  LYS  42           2HD      LYS  42 -14.122  -3.714   5.504
  327    HE2  LYS  42           1HE      LYS  42 -15.288  -5.388   3.286
  328    HE3  LYS  42           2HE      LYS  42 -15.754  -5.508   4.980
  329    HZ1  LYS  42           3HZ      LYS  42 -17.293  -4.122   3.784
  330    HZ2  LYS  42           1HZ      LYS  42 -16.045  -3.112   3.258
  331    HZ3  LYS  42           2HZ      LYS  42 -16.442  -3.181   4.900
  332    H    PHE  43           H        PHE  43  -9.187  -3.700   2.689
  333    HA   PHE  43           HA       PHE  43  -9.909  -5.500   0.694
  334    HB2  PHE  43           1HB      PHE  43  -7.089  -4.800   1.598
  335    HB3  PHE  43           2HB      PHE  43  -7.499  -5.587   0.068
  336    HD1  PHE  43           1HD      PHE  43 -10.094  -3.514   0.260
  337    HD2  PHE  43           2HD      PHE  43  -5.873  -3.291  -0.027
  338    HE1  PHE  43           1HE      PHE  43 -10.290  -1.312  -0.823
  339    HE2  PHE  43           2HE      PHE  43  -6.048  -1.090  -1.097
  340    HZ   PHE  43           HZ       PHE  43  -8.262  -0.098  -1.498
  341    H    SER  44           H        SER  44  -7.446  -6.139   3.258
  342    HA   SER  44           HA       SER  44  -7.390  -8.902   2.505
  343    HB2  SER  44           1HB      SER  44  -6.138  -7.747   4.985
  344    HB3  SER  44           2HB      SER  44  -5.650  -9.163   4.045
  345    HG   SER  44           HG       SER  44  -4.459  -7.888   2.897
  346    H    GLU  45           H        GLU  45  -9.302  -7.065   4.663
  347    HA   GLU  45           HA       GLU  45 -10.099  -9.074   6.461
  348    HB2  GLU  45           1HB      GLU  45 -10.759  -6.545   6.330
  349    HB3  GLU  45           2HB      GLU  45 -12.046  -7.109   5.280
  350    HG2  GLU  45           1HG      GLU  45 -11.603  -8.157   8.060
  351    HG3  GLU  45           2HG      GLU  45 -12.656  -6.794   7.692
  352    H    GLN  46           H        GLN  46 -11.031  -8.295   3.156
  353    HA   GLN  46           HA       GLN  46 -12.962 -10.412   2.973
  354    HB2  GLN  46           1HB      GLN  46 -11.671  -8.906   0.694
  355    HB3  GLN  46           2HB      GLN  46 -13.210  -9.750   0.678
  356    HG2  GLN  46           1HG      GLN  46 -12.764  -7.407   2.482
  357    HG3  GLN  46           2HG      GLN  46 -13.178  -7.181   0.787
  358   HE21  GLN  46          1HE2      GLN  46 -14.424  -9.862   2.641
  359   HE22  GLN  46          2HE2      GLN  46 -16.048  -9.296   2.724
  360    H    TYR  47           H        TYR  47  -9.697  -9.764   1.785
  361    HA   TYR  47           HA       TYR  47  -9.344 -12.636   1.343
  362    HB2  TYR  47           1HB      TYR  47  -7.938 -11.880  -0.699
  363    HB3  TYR  47           2HB      TYR  47  -9.691 -11.931  -0.822
  364    HD1  TYR  47           1HD      TYR  47  -6.832  -9.608  -0.279
  365    HD2  TYR  47           2HD      TYR  47 -10.922 -10.041  -1.373
  366    HE1  TYR  47           1HE      TYR  47  -6.891  -7.252  -0.998
  367    HE2  TYR  47           2HE      TYR  47 -10.990  -7.688  -2.073
  368    HH   TYR  47           HH       TYR  47  -8.182  -5.800  -2.422
  369    HA   PRO  48           HA       PRO  48  -5.764 -11.240   3.858
  370    HB2  PRO  48           1HB      PRO  48  -5.460 -13.603   5.139
  371    HB3  PRO  48           2HB      PRO  48  -6.562 -12.342   5.690
  372    HG2  PRO  48           1HG      PRO  48  -7.161 -14.814   4.115
  373    HG3  PRO  48           2HG      PRO  48  -8.060 -14.107   5.468
  374    HD2  PRO  48           1HD      PRO  48  -8.825 -13.780   2.895
  375    HD3  PRO  48           2HD      PRO  48  -9.085 -12.530   4.128
  376    H    GLN  49           H        GLN  49  -6.256 -13.246   1.281
  377    HA   GLN  49           HA       GLN  49  -3.887 -14.760   1.103
  378    HB2  GLN  49           1HB      GLN  49  -5.776 -15.166  -0.368
  379    HB3  GLN  49           2HB      GLN  49  -5.642 -13.550  -1.043
  380    HG2  GLN  49           1HG      GLN  49  -3.178 -14.512  -1.563
  381    HG3  GLN  49           2HG      GLN  49  -4.131 -15.991  -1.653
  382   HE21  GLN  49          1HE2      GLN  49  -5.184 -12.730  -2.494
  383   HE22  GLN  49          2HE2      GLN  49  -5.429 -13.063  -4.174
  384    H    ALA  50           H        ALA  50  -4.540 -11.412   0.656
  385    HA   ALA  50           HA       ALA  50  -1.921 -10.971  -0.598
  386    HB1  ALA  50           1HB      ALA  50  -2.734  -8.779  -1.175
  387    HB2  ALA  50           2HB      ALA  50  -4.194  -9.033  -0.219
  388    HB3  ALA  50           3HB      ALA  50  -3.921  -9.988  -1.682
  389    H    ASP  51           H        ASP  51  -0.534  -9.284   0.321
  390    HA   ASP  51           HA       ASP  51  -0.771  -9.441   3.215
  391    HB2  ASP  51           1HB      ASP  51   1.463  -9.625   1.540
  392    HB3  ASP  51           2HB      ASP  51   1.635  -8.079   2.365
  393    H    PHE  52           H        PHE  52  -0.421  -7.680   4.562
  394    HA   PHE  52           HA       PHE  52  -1.509  -5.204   3.411
  395    HB2  PHE  52           1HB      PHE  52  -2.397  -5.099   5.934
  396    HB3  PHE  52           2HB      PHE  52  -3.309  -5.878   4.651
  397    HD1  PHE  52           1HD      PHE  52  -1.171  -6.429   7.591
  398    HD2  PHE  52           2HD      PHE  52  -3.607  -8.252   4.620
  399    HE1  PHE  52           1HE      PHE  52  -1.160  -8.527   8.872
  400    HE2  PHE  52           2HE      PHE  52  -3.602 -10.353   5.897
  401    HZ   PHE  52           HZ       PHE  52  -2.377 -10.494   8.027
  402    H    TYR  53           H        TYR  53  -0.065  -3.600   3.522
  403    HA   TYR  53           HA       TYR  53   1.363  -3.216   6.052
  404    HB2  TYR  53           1HB      TYR  53   2.705  -3.271   3.334
  405    HB3  TYR  53           2HB      TYR  53   3.458  -2.674   4.806
  406    HD1  TYR  53           1HD      TYR  53   4.112  -4.218   6.583
  407    HD2  TYR  53           2HD      TYR  53   2.441  -5.645   2.939
  408    HE1  TYR  53           1HE      TYR  53   4.912  -6.481   7.108
  409    HE2  TYR  53           2HE      TYR  53   3.229  -7.920   3.454
  410    HH   TYR  53           HH       TYR  53   5.066  -8.955   4.865
  411    H    LYS  54           H        LYS  54   2.011  -1.138   6.481
  412    HA   LYS  54           HA       LYS  54   0.913   1.023   4.796
  413    HB2  LYS  54           1HB      LYS  54   0.541   0.401   7.676
  414    HB3  LYS  54           2HB      LYS  54   0.571   2.087   7.203
  415    HG2  LYS  54           1HG      LYS  54  -1.351   1.625   5.720
  416    HG3  LYS  54           2HG      LYS  54  -1.382  -0.030   6.327
  417    HD2  LYS  54           1HD      LYS  54  -1.825   2.514   7.882
  418    HD3  LYS  54           2HD      LYS  54  -3.011   1.258   7.533
  419    HE2  LYS  54           1HE      LYS  54  -1.818  -0.308   8.935
  420    HE3  LYS  54           2HE      LYS  54  -0.527   0.864   9.198
  421    HZ1  LYS  54           3HZ      LYS  54  -2.051   0.769  11.069
  422    HZ2  LYS  54           1HZ      LYS  54  -3.344   1.197  10.067
  423    HZ3  LYS  54           2HZ      LYS  54  -2.087   2.293  10.339
  424    H    LEU  55           H        LEU  55   2.004   3.103   5.102
  425    HA   LEU  55           HA       LEU  55   4.024   3.319   7.122
  426    HB2  LEU  55           1HB      LEU  55   5.327   2.234   5.380
  427    HB3  LEU  55           2HB      LEU  55   4.812   3.429   4.212
  428    HG   LEU  55           HG       LEU  55   6.258   4.407   6.626
  429   HD11  LEU  55          1HD1      LEU  55   7.625   2.521   6.012
  430   HD12  LEU  55          2HD1      LEU  55   8.416   4.002   5.472
  431   HD13  LEU  55          3HD1      LEU  55   7.564   2.982   4.314
  432   HD21  LEU  55          3HD2      LEU  55   6.890   6.140   5.205
  433   HD22  LEU  55          1HD2      LEU  55   5.243   5.763   4.703
  434   HD23  LEU  55          2HD2      LEU  55   6.614   5.180   3.753
  435    H    ASP  56           H        ASP  56   4.597   5.456   7.544
  436    HA   ASP  56           HA       ASP  56   2.720   7.427   6.458
  437    HB2  ASP  56           1HB      ASP  56   3.492   6.835   9.048
  438    HB3  ASP  56           2HB      ASP  56   4.436   8.270   8.674
  439    H    VAL  57           H        VAL  57   3.463   8.803   4.922
  440    HA   VAL  57           HA       VAL  57   6.240   8.813   4.234
  441    HB   VAL  57           HB       VAL  57   5.690   9.964   2.339
  442   HG11  VAL  57          1HG1      VAL  57   2.974   8.952   3.158
  443   HG12  VAL  57          2HG1      VAL  57   4.271   7.968   2.472
  444   HG13  VAL  57          3HG1      VAL  57   3.534   9.249   1.509
  445   HG21  VAL  57          3HG2      VAL  57   5.058  12.051   3.334
  446   HG22  VAL  57          1HG2      VAL  57   3.524  11.375   3.876
  447   HG23  VAL  57          2HG2      VAL  57   3.830  11.593   2.155
  448    H    ASP  58           H        ASP  58   4.311  10.642   6.367
  449    HA   ASP  58           HA       ASP  58   5.882  13.014   6.456
  450    HB2  ASP  58           1HB      ASP  58   3.588  12.953   7.340
  451    HB3  ASP  58           2HB      ASP  58   4.082  11.789   8.563
  452    H    GLU  59           H        GLU  59   5.998   9.883   7.974
  453    HA   GLU  59           HA       GLU  59   8.228  10.626   9.673
  454    HB2  GLU  59           1HB      GLU  59   6.461   9.026  10.415
  455    HB3  GLU  59           2HB      GLU  59   7.027   7.892   9.199
  456    HG2  GLU  59           1HG      GLU  59   9.211   7.810  10.295
  457    HG3  GLU  59           2HG      GLU  59   8.638   8.946  11.514
  458    H    LEU  60           H        LEU  60   7.670   8.610   6.776
  459    HA   LEU  60           HA       LEU  60  10.597   8.613   6.371
  460    HB2  LEU  60           1HB      LEU  60   8.665   6.401   5.696
  461    HB3  LEU  60           2HB      LEU  60  10.324   6.450   5.156
  462    HG   LEU  60           HG       LEU  60  10.406   4.990   6.939
  463   HD11  LEU  60          1HD1      LEU  60  11.574   6.102   8.752
  464   HD12  LEU  60          2HD1      LEU  60  10.985   7.664   8.190
  465   HD13  LEU  60          3HD1      LEU  60  12.091   6.728   7.188
  466   HD21  LEU  60          3HD2      LEU  60   8.555   6.816   8.454
  467   HD22  LEU  60          1HD2      LEU  60   9.251   5.320   9.074
  468   HD23  LEU  60          2HD2      LEU  60   8.131   5.273   7.712
  469    H    GLY  61           H        GLY  61  10.266  10.553   5.126
  470    HA2  GLY  61           1HA      GLY  61   8.678  10.620   2.780
  471    HA3  GLY  61           2HA      GLY  61  10.007  11.705   3.155
  472    H    ASP  62           H        ASP  62  12.063   9.753   3.328
  473    HA   ASP  62           HA       ASP  62  12.836   9.622   0.626
  474    HB2  ASP  62           1HB      ASP  62  13.943   8.109   2.988
  475    HB3  ASP  62           2HB      ASP  62  14.735   8.263   1.426
  476    H    VAL  63           H        VAL  63  11.325   7.310   2.723
  477    HA   VAL  63           HA       VAL  63  11.567   5.050   1.041
  478    HB   VAL  63           HB       VAL  63   9.439   5.680   3.078
  479   HG11  VAL  63          1HG1      VAL  63   9.088   3.222   3.098
  480   HG12  VAL  63          2HG1      VAL  63  10.177   3.091   1.718
  481   HG13  VAL  63          3HG1      VAL  63   8.662   3.976   1.563
  482   HG21  VAL  63          3HG2      VAL  63  11.825   3.870   3.384
  483   HG22  VAL  63          1HG2      VAL  63  10.719   4.426   4.639
  484   HG23  VAL  63          2HG2      VAL  63  11.836   5.566   3.884
  485    H    ALA  64           H        ALA  64   8.894   7.373   1.511
  486    HA   ALA  64           HA       ALA  64   7.158   6.484  -0.417
  487    HB1  ALA  64           1HB      ALA  64   6.635   8.316   1.092
  488    HB2  ALA  64           2HB      ALA  64   6.370   8.803  -0.584
  489    HB3  ALA  64           3HB      ALA  64   7.811   9.344   0.275
  490    H    GLN  65           H        GLN  65  10.063   8.431  -0.810
  491    HA   GLN  65           HA       GLN  65   9.699   8.928  -3.601
  492    HB2  GLN  65           1HB      GLN  65  12.278   8.916  -2.014
  493    HB3  GLN  65           2HB      GLN  65  12.043   9.638  -3.597
  494    HG2  GLN  65           1HG      GLN  65  10.717  10.510  -1.042
  495    HG3  GLN  65           2HG      GLN  65  12.066  11.314  -1.840
  496   HE21  GLN  65          1HE2      GLN  65  10.962  10.833  -4.513
  497   HE22  GLN  65          2HE2      GLN  65   9.656  11.952  -4.690
  498    H    LYS  66           H        LYS  66  11.333   6.451  -1.726
  499    HA   LYS  66           HA       LYS  66  12.688   5.135  -3.743
  500    HB2  LYS  66           1HB      LYS  66  13.368   4.396  -1.705
  501    HB3  LYS  66           2HB      LYS  66  11.780   4.602  -0.985
  502    HG2  LYS  66           1HG      LYS  66  12.099   2.332  -0.883
  503    HG3  LYS  66           2HG      LYS  66  11.139   2.539  -2.342
  504    HD2  LYS  66           1HD      LYS  66  13.279   2.522  -3.653
  505    HD3  LYS  66           2HD      LYS  66  14.111   2.071  -2.164
  506    HE2  LYS  66           1HE      LYS  66  13.647   0.094  -3.474
  507    HE3  LYS  66           2HE      LYS  66  12.677   0.075  -2.001
  508    HZ1  LYS  66           3HZ      LYS  66  11.674   0.989  -4.639
  509    HZ2  LYS  66           1HZ      LYS  66  10.765   0.761  -3.231
  510    HZ3  LYS  66           2HZ      LYS  66  11.445  -0.569  -4.028
  511    H    ASN  67           H        ASN  67   9.294   5.239  -3.054
  512    HA   ASN  67           HA       ASN  67   8.830   2.775  -4.589
  513    HB2  ASN  67           1HB      ASN  67   6.814   4.193  -2.894
  514    HB3  ASN  67           2HB      ASN  67   6.837   2.522  -3.402
  515   HD21  ASN  67          1HD2      ASN  67   6.889   4.184  -0.839
  516   HD22  ASN  67          2HD2      ASN  67   8.013   3.344   0.142
  517    H    GLU  68           H        GLU  68   8.693   6.111  -4.782
  518    HA   GLU  68           HA       GLU  68   8.023   7.454  -6.486
  519    HB2  GLU  68           1HB      GLU  68   6.615   5.012  -7.574
  520    HB3  GLU  68           2HB      GLU  68   6.734   6.572  -8.394
  521    HG2  GLU  68           1HG      GLU  68   9.151   6.353  -8.514
  522    HG3  GLU  68           2HG      GLU  68   9.064   4.819  -7.650
  523    H    VAL  69           H        VAL  69   6.574   6.849  -3.977
  524    HA   VAL  69           HA       VAL  69   3.929   7.802  -4.808
  525    HB   VAL  69           HB       VAL  69   3.451   5.984  -3.463
  526   HG11  VAL  69          1HG1      VAL  69   5.456   6.782  -1.366
  527   HG12  VAL  69          2HG1      VAL  69   5.808   5.652  -2.669
  528   HG13  VAL  69          3HG1      VAL  69   4.550   5.270  -1.495
  529   HG21  VAL  69          3HG2      VAL  69   2.229   7.938  -2.700
  530   HG22  VAL  69          1HG2      VAL  69   3.515   8.313  -1.554
  531   HG23  VAL  69          2HG2      VAL  69   2.557   6.846  -1.356
  532    H    SER  70           H        SER  70   3.842   9.895  -4.899
  533    HA   SER  70           HA       SER  70   5.058  11.472  -2.733
  534    HB2  SER  70           1HB      SER  70   4.501  12.338  -5.583
  535    HB3  SER  70           2HB      SER  70   5.274  13.312  -4.333
  536    HG   SER  70           HG       SER  70   6.868  11.530  -4.252
  537    H    ALA  71           H        ALA  71   2.260  10.990  -4.803
  538    HA   ALA  71           HA       ALA  71   0.687  13.020  -3.497
  539    HB1  ALA  71           1HB      ALA  71  -1.159  12.165  -4.846
  540    HB2  ALA  71           2HB      ALA  71  -0.172  10.791  -5.345
  541    HB3  ALA  71           3HB      ALA  71   0.273  12.424  -5.841
  542    H    MET  72           H        MET  72  -1.409  12.389  -2.390
  543    HA   MET  72           HA       MET  72  -1.325   9.810  -1.076
  544    HB2  MET  72           1HB      MET  72  -1.298  10.792   1.195
  545    HB3  MET  72           2HB      MET  72   0.200  11.050   0.313
  546    HG2  MET  72           1HG      MET  72  -0.597  13.332  -0.252
  547    HG3  MET  72           2HG      MET  72  -1.990  13.052   0.792
  548    HE1  MET  72           3HE      MET  72   1.702  11.730   1.525
  549    HE2  MET  72           1HE      MET  72   2.378  13.189   2.247
  550    HE3  MET  72           2HE      MET  72   1.868  13.198   0.559
  551    HA   PRO  73           HA       PRO  73  -2.173   8.913   0.572
  552    HB2  PRO  73           1HB      PRO  73  -4.121   7.084   0.932
  553    HB3  PRO  73           2HB      PRO  73  -3.843   8.416   2.054
  554    HG2  PRO  73           1HG      PRO  73  -5.954   8.085  -0.013
  555    HG3  PRO  73           2HG      PRO  73  -6.047   8.880   1.575
  556    HD2  PRO  73           1HD      PRO  73  -5.760  10.167  -0.885
  557    HD3  PRO  73           2HD      PRO  73  -5.401  10.880   0.698
  558    H    THR  74           H        THR  74  -1.381   6.930  -0.227
  559    HA   THR  74           HA       THR  74  -2.202   6.291  -2.989
  560    HB   THR  74           HB       THR  74   0.577   6.746  -1.903
  561    HG1  THR  74           1HG      THR  74   0.174   8.577  -2.870
  562   HG21  THR  74          3HG2      THR  74   1.423   5.997  -4.131
  563   HG22  THR  74          1HG2      THR  74  -0.181   5.332  -4.472
  564   HG23  THR  74          2HG2      THR  74   0.780   4.699  -3.129
  565    H    LEU  75           H        LEU  75  -2.255   4.236  -3.559
  566    HA   LEU  75           HA       LEU  75  -1.387   2.209  -1.599
  567    HB2  LEU  75           1HB      LEU  75  -3.448   1.959  -3.778
  568    HB3  LEU  75           2HB      LEU  75  -3.054   0.749  -2.575
  569    HG   LEU  75           HG       LEU  75  -3.815   2.782  -0.967
  570   HD11  LEU  75          1HD1      LEU  75  -5.764   3.883  -1.856
  571   HD12  LEU  75          2HD1      LEU  75  -5.654   2.989  -3.370
  572   HD13  LEU  75          3HD1      LEU  75  -4.423   4.188  -2.960
  573   HD21  LEU  75          3HD2      LEU  75  -6.013   1.591  -0.923
  574   HD22  LEU  75          1HD2      LEU  75  -4.588   0.566  -0.757
  575   HD23  LEU  75          2HD2      LEU  75  -5.446   0.643  -2.296
  576    H    LEU  76           H        LEU  76   0.314   1.003  -2.271
  577    HA   LEU  76           HA       LEU  76   0.769   0.803  -5.175
  578    HB2  LEU  76           1HB      LEU  76   2.503   1.690  -3.117
  579    HB3  LEU  76           2HB      LEU  76   3.117   0.148  -3.682
  580    HG   LEU  76           HG       LEU  76   2.557   2.551  -5.422
  581   HD11  LEU  76          1HD1      LEU  76   4.512   2.772  -3.901
  582   HD12  LEU  76          2HD1      LEU  76   4.927   2.813  -5.621
  583   HD13  LEU  76          3HD1      LEU  76   5.212   1.346  -4.670
  584   HD21  LEU  76          3HD2      LEU  76   3.712   1.225  -7.168
  585   HD22  LEU  76          1HD2      LEU  76   2.182   0.515  -6.655
  586   HD23  LEU  76          2HD2      LEU  76   3.703  -0.161  -6.077
  587    H    LEU  77           H        LEU  77   0.416  -1.108  -5.988
  588    HA   LEU  77           HA       LEU  77   0.393  -3.460  -4.224
  589    HB2  LEU  77           1HB      LEU  77  -0.763  -2.916  -6.956
  590    HB3  LEU  77           2HB      LEU  77  -0.663  -4.530  -6.295
  591    HG   LEU  77           HG       LEU  77  -2.352  -4.133  -4.720
  592   HD11  LEU  77          1HD1      LEU  77  -3.243  -1.941  -4.150
  593   HD12  LEU  77          2HD1      LEU  77  -2.113  -1.168  -5.262
  594   HD13  LEU  77          3HD1      LEU  77  -1.510  -1.992  -3.824
  595   HD21  LEU  77          3HD2      LEU  77  -3.079  -2.465  -7.119
  596   HD22  LEU  77          1HD2      LEU  77  -4.187  -3.305  -6.036
  597   HD23  LEU  77          2HD2      LEU  77  -3.095  -4.231  -7.069
  598    H    PHE  78           H        PHE  78   1.921  -5.003  -4.425
  599    HA   PHE  78           HA       PHE  78   3.534  -5.058  -6.888
  600    HB2  PHE  78           1HB      PHE  78   4.527  -5.204  -4.047
  601    HB3  PHE  78           2HB      PHE  78   5.467  -5.777  -5.413
  602    HD1  PHE  78           1HD      PHE  78   3.869  -2.762  -3.981
  603    HD2  PHE  78           2HD      PHE  78   6.744  -4.320  -6.695
  604    HE1  PHE  78           1HE      PHE  78   4.778  -0.510  -4.315
  605    HE2  PHE  78           2HE      PHE  78   7.655  -2.064  -7.040
  606    HZ   PHE  78           HZ       PHE  78   6.672  -0.150  -5.843
  607    H    LYS  79           H        LYS  79   4.442  -7.162  -7.418
  608    HA   LYS  79           HA       LYS  79   3.838  -9.286  -5.493
  609    HB2  LYS  79           1HB      LYS  79   1.998  -9.262  -7.217
  610    HB3  LYS  79           2HB      LYS  79   3.217  -9.637  -8.431
  611    HG2  LYS  79           1HG      LYS  79   3.626 -11.759  -7.536
  612    HG3  LYS  79           2HG      LYS  79   2.834 -11.365  -6.012
  613    HD2  LYS  79           1HD      LYS  79   1.402 -12.830  -7.259
  614    HD3  LYS  79           2HD      LYS  79   0.673 -11.227  -7.233
  615    HE2  LYS  79           1HE      LYS  79   2.399 -12.072  -9.526
  616    HE3  LYS  79           2HE      LYS  79   0.717 -12.587  -9.441
  617    HZ1  LYS  79           3HZ      LYS  79   1.663  -9.776  -9.420
  618    HZ2  LYS  79           1HZ      LYS  79   0.045 -10.270  -9.352
  619    HZ3  LYS  79           2HZ      LYS  79   0.972 -10.569 -10.739
  620    H    ASN  80           H        ASN  80   5.518 -10.592  -5.209
  621    HA   ASN  80           HA       ASN  80   7.652 -11.321  -5.262
  622    HB2  ASN  80           1HB      ASN  80   8.325 -12.473  -7.378
  623    HB3  ASN  80           2HB      ASN  80   6.781 -12.976  -6.717
  624   HD21  ASN  80          1HD2      ASN  80   8.412 -11.334  -9.303
  625   HD22  ASN  80          2HD2      ASN  80   7.069 -11.293 -10.393
  626    H    GLY  81           H        GLY  81   7.873  -8.691  -5.198
  627    HA2  GLY  81           1HA      GLY  81   9.733  -7.303  -5.247
  628    HA3  GLY  81           2HA      GLY  81  10.522  -8.457  -6.317
  629    H    LYS  82           H        LYS  82   7.601  -7.826  -7.694
  630    HA   LYS  82           HA       LYS  82   8.583  -5.421  -9.061
  631    HB2  LYS  82           1HB      LYS  82   7.586  -6.253 -11.140
  632    HB3  LYS  82           2HB      LYS  82   8.801  -7.365 -10.532
  633    HG2  LYS  82           1HG      LYS  82   7.132  -8.867  -9.717
  634    HG3  LYS  82           2HG      LYS  82   5.849  -7.722 -10.120
  635    HD2  LYS  82           1HD      LYS  82   7.698  -8.721 -12.247
  636    HD3  LYS  82           2HD      LYS  82   6.351  -9.720 -11.707
  637    HE2  LYS  82           1HE      LYS  82   5.653  -8.481 -13.632
  638    HE3  LYS  82           2HE      LYS  82   4.818  -7.838 -12.222
  639    HZ1  LYS  82           3HZ      LYS  82   7.248  -6.624 -13.413
  640    HZ2  LYS  82           1HZ      LYS  82   6.281  -5.971 -12.190
  641    HZ3  LYS  82           2HZ      LYS  82   5.671  -6.124 -13.758
  642    H    GLU  83           H        GLU  83   6.810  -4.093  -9.937
  643    HA   GLU  83           HA       GLU  83   4.740  -3.725  -8.053
  644    HB2  GLU  83           1HB      GLU  83   5.826  -2.014  -9.612
  645    HB3  GLU  83           2HB      GLU  83   4.811  -2.671 -10.884
  646    HG2  GLU  83           1HG      GLU  83   2.818  -1.964  -9.758
  647    HG3  GLU  83           2HG      GLU  83   3.751  -1.491  -8.330
  648    H    VAL  84           H        VAL  84   2.383  -3.548  -8.927
  649    HA   VAL  84           HA       VAL  84   1.805  -5.105 -11.282
  650    HB   VAL  84           HB       VAL  84  -0.292  -6.038 -10.059
  651   HG11  VAL  84          1HG1      VAL  84   0.829  -8.135  -9.663
  652   HG12  VAL  84          2HG1      VAL  84   2.397  -7.324  -9.617
  653   HG13  VAL  84          3HG1      VAL  84   1.479  -7.388 -11.124
  654   HG21  VAL  84          3HG2      VAL  84   0.082  -4.972  -7.946
  655   HG22  VAL  84          1HG2      VAL  84   1.669  -5.723  -7.810
  656   HG23  VAL  84          2HG2      VAL  84   0.215  -6.719  -7.749
  657    H    ALA  85           H        ALA  85   0.863  -2.836  -8.799
  658    HA   ALA  85           HA       ALA  85  -0.491  -1.239 -10.720
  659    HB1  ALA  85           1HB      ALA  85  -2.690  -1.232  -9.473
  660    HB2  ALA  85           2HB      ALA  85  -2.124  -2.702  -8.675
  661    HB3  ALA  85           3HB      ALA  85  -2.337  -2.674 -10.422
  662    H    LYS  86           H        LYS  86  -1.091   0.842  -9.951
  663    HA   LYS  86           HA       LYS  86  -0.408   1.510  -7.193
  664    HB2  LYS  86           1HB      LYS  86   1.691   1.851  -8.399
  665    HB3  LYS  86           2HB      LYS  86   0.869   2.852  -9.589
  666    HG2  LYS  86           1HG      LYS  86   0.273   4.409  -7.701
  667    HG3  LYS  86           2HG      LYS  86   1.367   3.473  -6.691
  668    HD2  LYS  86           1HD      LYS  86   2.118   4.942  -9.220
  669    HD3  LYS  86           2HD      LYS  86   2.448   5.485  -7.577
  670    HE2  LYS  86           1HE      LYS  86   4.462   4.539  -8.159
  671    HE3  LYS  86           2HE      LYS  86   3.661   3.188  -7.361
  672    HZ1  LYS  86           3HZ      LYS  86   2.887   2.617  -9.738
  673    HZ2  LYS  86           1HZ      LYS  86   4.476   2.238  -9.287
  674    HZ3  LYS  86           2HZ      LYS  86   4.159   3.611 -10.228
  675    H    VAL  87           H        VAL  87  -1.882   2.884  -6.389
  676    HA   VAL  87           HA       VAL  87  -3.296   4.657  -8.251
  677    HB   VAL  87           HB       VAL  87  -5.429   4.234  -6.967
  678   HG11  VAL  87          1HG1      VAL  87  -5.107   3.368  -9.212
  679   HG12  VAL  87          2HG1      VAL  87  -5.989   2.199  -8.229
  680   HG13  VAL  87          3HG1      VAL  87  -4.276   1.951  -8.569
  681   HG21  VAL  87          3HG2      VAL  87  -3.922   1.792  -6.042
  682   HG22  VAL  87          1HG2      VAL  87  -5.643   2.094  -5.806
  683   HG23  VAL  87          2HG2      VAL  87  -4.452   3.133  -5.026
  684    H    VAL  88           H        VAL  88  -3.908   6.624  -7.404
  685    HA   VAL  88           HA       VAL  88  -2.732   7.216  -4.775
  686    HB   VAL  88           HB       VAL  88  -2.624   9.595  -5.597
  687   HG11  VAL  88          1HG1      VAL  88  -0.632   9.228  -6.978
  688   HG12  VAL  88          2HG1      VAL  88  -1.082   7.534  -7.170
  689   HG13  VAL  88          3HG1      VAL  88  -0.656   8.158  -5.576
  690   HG21  VAL  88          3HG2      VAL  88  -3.263   8.307  -8.253
  691   HG22  VAL  88          1HG2      VAL  88  -2.727   9.971  -8.022
  692   HG23  VAL  88          2HG2      VAL  88  -4.284   9.447  -7.379
  693    H    GLY  89           H        GLY  89  -5.248   6.142  -4.741
  694    HA2  GLY  89           1HA      GLY  89  -6.772   8.082  -3.405
  695    HA3  GLY  89           2HA      GLY  89  -7.393   7.901  -5.038
  696    H    ALA  90           H        ALA  90  -7.818   6.927  -1.974
  697    HA   ALA  90           HA       ALA  90  -8.314   4.194  -2.074
  698    HB1  ALA  90           1HB      ALA  90  -9.597   4.501  -0.099
  699    HB2  ALA  90           2HB      ALA  90  -9.912   6.192  -0.508
  700    HB3  ALA  90           3HB      ALA  90  -8.285   5.688  -0.065
  701    H    ASN  91           H        ASN  91  -9.517   3.258  -3.598
  702    HA   ASN  91           HA       ASN  91 -12.201   4.368  -4.044
  703    HB2  ASN  91           1HB      ASN  91 -10.251   3.879  -5.939
  704    HB3  ASN  91           2HB      ASN  91 -11.272   2.444  -6.031
  705   HD21  ASN  91          1HD2      ASN  91 -12.496   5.567  -5.061
  706   HD22  ASN  91          2HD2      ASN  91 -13.469   5.832  -6.468
  707    HA   PRO  92           HA       PRO  92 -12.960   1.057  -1.039
  708    HB2  PRO  92           1HB      PRO  92 -15.571   1.576  -2.430
  709    HB3  PRO  92           2HB      PRO  92 -15.265   1.231  -0.723
  710    HG2  PRO  92           1HG      PRO  92 -15.563   3.754  -1.668
  711    HG3  PRO  92           2HG      PRO  92 -14.534   3.360  -0.283
  712    HD2  PRO  92           1HD      PRO  92 -13.754   4.316  -2.903
  713    HD3  PRO  92           2HD      PRO  92 -12.741   4.091  -1.478
  714    H    ALA  93           H        ALA  93 -15.148   0.531  -3.807
  715    HA   ALA  93           HA       ALA  93 -14.654  -2.295  -3.516
  716    HB1  ALA  93           1HB      ALA  93 -16.920  -1.432  -3.877
  717    HB2  ALA  93           2HB      ALA  93 -16.448  -2.578  -5.131
  718    HB3  ALA  93           3HB      ALA  93 -16.438  -0.848  -5.470
  719    H    ALA  94           H        ALA  94 -13.842   0.192  -5.846
  720    HA   ALA  94           HA       ALA  94 -13.100  -1.554  -7.952
  721    HB1  ALA  94           1HB      ALA  94 -12.031   0.384  -8.948
  722    HB2  ALA  94           2HB      ALA  94 -12.113   1.251  -7.415
  723    HB3  ALA  94           3HB      ALA  94 -13.597   0.841  -8.277
  724    H    ILE  95           H        ILE  95 -11.357  -0.303  -5.160
  725    HA   ILE  95           HA       ILE  95  -8.867  -1.322  -6.238
  726    HB   ILE  95           HB       ILE  95  -9.336  -0.087  -3.525
  727   HG12  ILE  95          1HG1      ILE  95  -9.785   1.537  -5.264
  728   HG13  ILE  95          2HG1      ILE  95  -8.228   1.902  -4.535
  729   HG21  ILE  95          1HG2      ILE  95  -6.890   0.179  -3.515
  730   HG22  ILE  95          2HG2      ILE  95  -6.801  -0.715  -5.032
  731   HG23  ILE  95          3HG2      ILE  95  -7.379  -1.514  -3.569
  732   HD11  ILE  95          3HD1      ILE  95  -8.086   2.187  -6.909
  733   HD12  ILE  95          1HD1      ILE  95  -8.711   0.561  -7.185
  734   HD13  ILE  95          2HD1      ILE  95  -7.126   0.783  -6.444
  735    H    LYS  96           H        LYS  96 -11.247  -2.259  -3.769
  736    HA   LYS  96           HA       LYS  96  -9.790  -4.497  -2.852
  737    HB2  LYS  96           1HB      LYS  96 -12.803  -4.492  -3.156
  738    HB3  LYS  96           2HB      LYS  96 -11.820  -5.464  -2.050
  739    HG2  LYS  96           1HG      LYS  96 -11.133  -3.084  -1.165
  740    HG3  LYS  96           2HG      LYS  96 -12.699  -2.652  -1.842
  741    HD2  LYS  96           1HD      LYS  96 -12.160  -4.805   0.204
  742    HD3  LYS  96           2HD      LYS  96 -12.948  -3.254   0.494
  743    HE2  LYS  96           1HE      LYS  96 -13.980  -5.453  -1.296
  744    HE3  LYS  96           2HE      LYS  96 -14.569  -5.083   0.323
  745    HZ1  LYS  96           3HZ      LYS  96 -14.682  -3.252  -2.008
  746    HZ2  LYS  96           1HZ      LYS  96 -15.265  -2.914  -0.457
  747    HZ3  LYS  96           2HZ      LYS  96 -15.982  -4.130  -1.385
  748    H    GLN  97           H        GLN  97 -11.765  -3.923  -5.677
  749    HA   GLN  97           HA       GLN  97 -11.619  -6.564  -6.710
  750    HB2  GLN  97           1HB      GLN  97 -13.245  -4.840  -7.509
  751    HB3  GLN  97           2HB      GLN  97 -11.914  -3.964  -8.252
  752    HG2  GLN  97           1HG      GLN  97 -11.456  -6.246  -9.435
  753    HG3  GLN  97           2HG      GLN  97 -13.132  -6.583  -9.013
  754   HE21  GLN  97          1HE2      GLN  97 -11.838  -3.430  -9.869
  755   HE22  GLN  97          2HE2      GLN  97 -12.695  -3.284 -11.359
  756    H    ALA  98           H        ALA  98  -9.498  -3.795  -6.757
  757    HA   ALA  98           HA       ALA  98  -7.858  -4.592  -8.916
  758    HB1  ALA  98           1HB      ALA  98  -6.277  -2.940  -8.090
  759    HB2  ALA  98           2HB      ALA  98  -7.198  -2.798  -6.593
  760    HB3  ALA  98           3HB      ALA  98  -7.914  -2.291  -8.123
  761    H    ILE  99           H        ILE  99  -7.433  -4.803  -5.416
  762    HA   ILE  99           HA       ILE  99  -5.007  -6.131  -5.370
  763    HB   ILE  99           HB       ILE  99  -7.170  -6.820  -3.379
  764   HG12  ILE  99          1HG1      ILE  99  -7.399  -4.477  -3.434
  765   HG13  ILE  99          2HG1      ILE  99  -6.287  -4.785  -2.103
  766   HG21  ILE  99          1HG2      ILE  99  -4.185  -6.519  -3.276
  767   HG22  ILE  99          2HG2      ILE  99  -5.118  -8.010  -3.145
  768   HG23  ILE  99          3HG2      ILE  99  -5.199  -6.801  -1.863
  769   HD11  ILE  99          3HD1      ILE  99  -5.627  -3.826  -4.860
  770   HD12  ILE  99          1HD1      ILE  99  -4.421  -4.280  -3.649
  771   HD13  ILE  99          2HD1      ILE  99  -5.506  -2.922  -3.345
  772    H    ALA 100           H        ALA 100  -8.274  -7.422  -5.742
  773    HA   ALA 100           HA       ALA 100  -7.472 -10.170  -5.696
  774    HB1  ALA 100           1HB      ALA 100 -10.002  -8.930  -6.776
  775    HB2  ALA 100           2HB      ALA 100  -9.747  -9.464  -5.115
  776    HB3  ALA 100           3HB      ALA 100  -9.747 -10.640  -6.430
  777    H    ALA 101           H        ALA 101  -7.617  -7.705  -8.111
  778    HA   ALA 101           HA       ALA 101  -7.604  -9.477 -10.376
  779    HB1  ALA 101           1HB      ALA 101  -8.607  -7.218 -10.468
  780    HB2  ALA 101           2HB      ALA 101  -7.370  -7.462 -11.702
  781    HB3  ALA 101           3HB      ALA 101  -6.998  -6.519 -10.257
  782    H    ASN 102           H        ASN 102  -5.230  -7.652  -8.535
  783    HA   ASN 102           HA       ASN 102  -3.110  -8.231 -10.432
  784    HB2  ASN 102           1HB      ASN 102  -3.020  -6.786  -7.786
  785    HB3  ASN 102           2HB      ASN 102  -1.694  -6.881  -8.933
  786   HD21  ASN 102          1HD2      ASN 102  -4.549  -5.302  -8.042
  787   HD22  ASN 102          2HD2      ASN 102  -4.668  -4.204  -9.367
  788    H    ALA 103           H        ALA 103  -4.448  -9.682  -7.681
  789    HA   ALA 103           HA       ALA 103  -2.046 -11.068  -6.870
  790    HB1  ALA 103           1HB      ALA 103  -4.921 -11.479  -6.057
  791    HB2  ALA 103           2HB      ALA 103  -3.722 -10.515  -5.198
  792    HB3  ALA 103           3HB      ALA 103  -3.527 -12.264  -5.317
  Start of MODEL    8
    1    H1   MET   1           1H       MET   1  -6.442  -6.439   9.383
    2    H2   MET   1           2H       MET   1  -6.612  -6.732  11.039
    3    H3   MET   1           3H       MET   1  -5.415  -7.537  10.154
    4    HA   MET   1           HA       MET   1  -5.539  -4.631  10.659
    5    HB2  MET   1           1HB      MET   1  -3.661  -4.909  12.118
    6    HB3  MET   1           2HB      MET   1  -4.903  -6.037  12.632
    7    HG2  MET   1           1HG      MET   1  -2.497  -6.738  10.963
    8    HG3  MET   1           2HG      MET   1  -2.652  -7.005  12.698
    9    HE1  MET   1           3HE      MET   1  -5.795  -7.829  12.776
   10    HE2  MET   1           1HE      MET   1  -4.534  -8.578  13.755
   11    HE3  MET   1           2HE      MET   1  -5.621  -9.584  12.799
   12    H    VAL   2           H        VAL   2  -3.629  -3.494   9.938
   13    HA   VAL   2           HA       VAL   2  -2.301  -4.797   7.667
   14    HB   VAL   2           HB       VAL   2  -3.344  -1.973   7.914
   15   HG11  VAL   2          1HG1      VAL   2  -1.585  -3.123   5.748
   16   HG12  VAL   2          2HG1      VAL   2  -1.107  -1.904   6.927
   17   HG13  VAL   2          3HG1      VAL   2  -2.345  -1.530   5.725
   18   HG21  VAL   2          3HG2      VAL   2  -3.895  -4.169   5.927
   19   HG22  VAL   2          1HG2      VAL   2  -4.612  -2.563   5.923
   20   HG23  VAL   2          2HG2      VAL   2  -4.956  -3.675   7.243
   21    H    THR   3           H        THR   3  -0.146  -4.783   7.708
   22    HA   THR   3           HA       THR   3   1.082  -4.184  10.216
   23    HB   THR   3           HB       THR   3   2.553  -5.086   7.755
   24    HG1  THR   3           1HG      THR   3   1.131  -6.667   7.700
   25   HG21  THR   3          3HG2      THR   3   2.837  -5.769  10.686
   26   HG22  THR   3          1HG2      THR   3   3.866  -4.655   9.786
   27   HG23  THR   3          2HG2      THR   3   3.857  -6.371   9.379
   28    H    GLN   4           H        GLN   4   2.826  -2.879  10.682
   29    HA   GLN   4           HA       GLN   4   2.883  -0.390   9.155
   30    HB2  GLN   4           1HB      GLN   4   2.410  -0.435  11.593
   31    HB3  GLN   4           2HB      GLN   4   4.018  -1.071  11.870
   32    HG2  GLN   4           1HG      GLN   4   3.890   1.322  12.328
   33    HG3  GLN   4           2HG      GLN   4   5.021   0.954  11.027
   34   HE21  GLN   4          1HE2      GLN   4   1.561   0.932  10.591
   35   HE22  GLN   4          2HE2      GLN   4   1.497   2.319   9.569
   36    H    PHE   5           H        PHE   5   4.662   0.392   8.120
   37    HA   PHE   5           HA       PHE   5   7.222  -1.081   8.319
   38    HB2  PHE   5           1HB      PHE   5   6.175   0.926   6.315
   39    HB3  PHE   5           2HB      PHE   5   7.861   0.447   6.377
   40    HD1  PHE   5           2HD      PHE   5   7.241  -2.525   7.006
   41    HD2  PHE   5           1HD      PHE   5   5.784   0.233   4.115
   42    HE1  PHE   5           2HE      PHE   5   6.780  -4.385   5.466
   43    HE2  PHE   5           1HE      PHE   5   5.320  -1.622   2.572
   44    HZ   PHE   5           HZ       PHE   5   5.821  -3.931   3.248
   45    H    LYS   6           H        LYS   6   9.164   0.091   8.771
   46    HA   LYS   6           HA       LYS   6   8.805   2.940   9.419
   47    HB2  LYS   6           1HB      LYS   6  10.229   2.762  11.358
   48    HB3  LYS   6           2HB      LYS   6   8.914   1.607  11.505
   49    HG2  LYS   6           1HG      LYS   6  10.427  -0.169  10.727
   50    HG3  LYS   6           2HG      LYS   6  11.741   1.005  10.692
   51    HD2  LYS   6           1HD      LYS   6  11.430   1.388  13.103
   52    HD3  LYS   6           2HD      LYS   6  10.162   0.160  13.118
   53    HE2  LYS   6           1HE      LYS   6  13.056  -0.270  12.384
   54    HE3  LYS   6           2HE      LYS   6  12.279  -0.772  13.883
   55    HZ1  LYS   6           3HZ      LYS   6  11.579  -1.747  11.160
   56    HZ2  LYS   6           1HZ      LYS   6  10.846  -2.242  12.608
   57    HZ3  LYS   6           2HZ      LYS   6  12.471  -2.605  12.318
   58    H    THR   7           H        THR   7  10.373   0.710   7.529
   59    HA   THR   7           HA       THR   7  12.348   2.729   6.765
   60    HB   THR   7           HB       THR   7  14.077   0.929   6.414
   61    HG1  THR   7           1HG      THR   7  12.514  -0.570   8.266
   62   HG21  THR   7          3HG2      THR   7  14.206   2.516   8.289
   63   HG22  THR   7          1HG2      THR   7  14.867   0.936   8.708
   64   HG23  THR   7          2HG2      THR   7  13.267   1.402   9.280
   65    H    ALA   8           H        ALA   8  13.330   2.270   4.624
   66    HA   ALA   8           HA       ALA   8  11.330   1.458   2.757
   67    HB1  ALA   8           1HB      ALA   8  14.222   2.120   2.265
   68    HB2  ALA   8           2HB      ALA   8  12.889   3.272   2.262
   69    HB3  ALA   8           3HB      ALA   8  12.955   1.999   1.047
   70    H    SER   9           H        SER   9  14.187  -0.004   4.142
   71    HA   SER   9           HA       SER   9  14.447  -2.251   2.518
   72    HB2  SER   9           1HB      SER   9  16.043  -1.710   4.317
   73    HB3  SER   9           2HB      SER   9  14.807  -2.055   5.526
   74    HG   SER   9           HG       SER   9  16.272  -3.804   3.907
   75    H    GLU  10           H        GLU  10  12.460  -1.758   5.413
   76    HA   GLU  10           HA       GLU  10  11.052  -4.106   5.479
   77    HB2  GLU  10           1HB      GLU  10  10.458  -1.293   6.259
   78    HB3  GLU  10           2HB      GLU  10   9.204  -2.520   6.409
   79    HG2  GLU  10           1HG      GLU  10  10.492  -3.795   7.873
   80    HG3  GLU  10           2HG      GLU  10  11.952  -2.883   7.532
   81    H    PHE  11           H        PHE  11  10.290  -1.179   3.560
   82    HA   PHE  11           HA       PHE  11   7.889  -2.128   2.467
   83    HB2  PHE  11           1HB      PHE  11   8.732   0.229   2.280
   84    HB3  PHE  11           2HB      PHE  11   9.894  -0.327   1.081
   85    HD1  PHE  11           1HD      PHE  11   8.900  -1.480  -1.034
   86    HD2  PHE  11           2HD      PHE  11   6.641   0.974   1.613
   87    HE1  PHE  11           1HE      PHE  11   7.242  -1.085  -2.811
   88    HE2  PHE  11           2HE      PHE  11   4.979   1.374  -0.177
   89    HZ   PHE  11           HZ       PHE  11   5.286   0.334  -2.375
   90    H    ASP  12           H        ASP  12  11.145  -2.204   1.106
   91    HA   ASP  12           HA       ASP  12  10.473  -3.595  -1.250
   92    HB2  ASP  12           1HB      ASP  12  12.535  -2.224  -0.859
   93    HB3  ASP  12           2HB      ASP  12  13.164  -3.540   0.123
   94    H    SER  13           H        SER  13  11.498  -4.750   1.931
   95    HA   SER  13           HA       SER  13  11.954  -7.434   1.232
   96    HB2  SER  13           1HB      SER  13  10.975  -6.297   3.863
   97    HB3  SER  13           2HB      SER  13  11.604  -7.928   3.632
   98    HG   SER  13           HG       SER  13  13.008  -5.487   3.230
   99    H    ALA  14           H        ALA  14   9.008  -5.737   2.212
  100    HA   ALA  14           HA       ALA  14   7.332  -8.009   2.169
  101    HB1  ALA  14           1HB      ALA  14   6.574  -5.112   1.818
  102    HB2  ALA  14           2HB      ALA  14   6.737  -5.942   3.363
  103    HB3  ALA  14           3HB      ALA  14   5.478  -6.431   2.230
  104    H    ILE  15           H        ILE  15   8.681  -6.020  -0.242
  105    HA   ILE  15           HA       ILE  15   6.736  -6.597  -2.282
  106    HB   ILE  15           HB       ILE  15   9.494  -5.439  -2.561
  107   HG12  ILE  15          1HG1      ILE  15   8.391  -3.893  -1.195
  108   HG13  ILE  15          2HG1      ILE  15   8.158  -3.281  -2.829
  109   HG21  ILE  15          1HG2      ILE  15   8.937  -4.755  -4.694
  110   HG22  ILE  15          2HG2      ILE  15   7.215  -5.009  -4.429
  111   HG23  ILE  15          3HG2      ILE  15   8.291  -6.395  -4.592
  112   HD11  ILE  15          3HD1      ILE  15   6.146  -4.830  -1.218
  113   HD12  ILE  15          1HD1      ILE  15   5.909  -4.224  -2.858
  114   HD13  ILE  15          2HD1      ILE  15   6.126  -3.092  -1.524
  115    H    ALA  16           H        ALA  16   9.824  -7.854  -1.236
  116    HA   ALA  16           HA       ALA  16  10.442  -9.103  -3.743
  117    HB1  ALA  16           1HB      ALA  16  12.462  -9.853  -2.656
  118    HB2  ALA  16           2HB      ALA  16  11.814  -9.393  -1.081
  119    HB3  ALA  16           3HB      ALA  16  12.165  -8.154  -2.287
  120    H    GLN  17           H        GLN  17   8.139 -10.026  -1.795
  121    HA   GLN  17           HA       GLN  17   8.764 -12.871  -1.859
  122    HB2  GLN  17           1HB      GLN  17   6.415 -12.828  -0.663
  123    HB3  GLN  17           2HB      GLN  17   7.883 -12.470   0.216
  124    HG2  GLN  17           1HG      GLN  17   7.486 -10.122   0.017
  125    HG3  GLN  17           2HG      GLN  17   6.058 -10.424  -0.972
  126   HE21  GLN  17          1HE2      GLN  17   4.858  -9.276   0.497
  127   HE22  GLN  17          2HE2      GLN  17   4.335  -9.952   2.009
  128    H    ASP  18           H        ASP  18   7.385 -14.336  -2.907
  129    HA   ASP  18           HA       ASP  18   6.180 -13.243  -5.292
  130    HB2  ASP  18           1HB      ASP  18   7.620 -15.270  -5.361
  131    HB3  ASP  18           2HB      ASP  18   6.402 -16.132  -4.429
  132    H    LYS  19           H        LYS  19   4.612 -12.154  -3.753
  133    HA   LYS  19           HA       LYS  19   2.092 -13.534  -4.063
  134    HB2  LYS  19           1HB      LYS  19   1.358 -13.121  -1.744
  135    HB3  LYS  19           2HB      LYS  19   2.706 -14.246  -1.807
  136    HG2  LYS  19           1HG      LYS  19   4.229 -12.596  -1.037
  137    HG3  LYS  19           2HG      LYS  19   3.033 -11.313  -1.232
  138    HD2  LYS  19           1HD      LYS  19   3.227 -11.890   1.108
  139    HD3  LYS  19           2HD      LYS  19   1.644 -12.382   0.506
  140    HE2  LYS  19           1HE      LYS  19   2.508 -14.125   1.906
  141    HE3  LYS  19           2HE      LYS  19   2.522 -14.688   0.236
  142    HZ1  LYS  19           3HZ      LYS  19   4.559 -15.271   1.386
  143    HZ2  LYS  19           1HZ      LYS  19   4.870 -13.645   1.730
  144    HZ3  LYS  19           2HZ      LYS  19   4.885 -14.193   0.130
  145    H    LEU  20           H        LEU  20   0.294 -11.868  -3.237
  146    HA   LEU  20           HA       LEU  20   0.968  -9.434  -4.656
  147    HB2  LEU  20           1HB      LEU  20  -1.180 -10.741  -4.995
  148    HB3  LEU  20           2HB      LEU  20  -1.696 -10.145  -3.430
  149    HG   LEU  20           HG       LEU  20  -2.614  -8.908  -5.419
  150   HD11  LEU  20          1HD1      LEU  20  -2.559  -7.897  -3.192
  151   HD12  LEU  20          2HD1      LEU  20  -2.337  -6.700  -4.469
  152   HD13  LEU  20          3HD1      LEU  20  -0.951  -7.258  -3.530
  153   HD21  LEU  20          3HD2      LEU  20  -0.600  -8.980  -6.790
  154   HD22  LEU  20          1HD2      LEU  20   0.218  -7.915  -5.648
  155   HD23  LEU  20          2HD2      LEU  20  -1.171  -7.326  -6.558
  156    H    VAL  21           H        VAL  21   1.757  -7.757  -3.668
  157    HA   VAL  21           HA       VAL  21   1.302  -7.416  -0.786
  158    HB   VAL  21           HB       VAL  21   3.181  -5.659  -2.269
  159   HG11  VAL  21          1HG1      VAL  21   2.862  -5.369   0.109
  160   HG12  VAL  21          2HG1      VAL  21   4.505  -5.916  -0.221
  161   HG13  VAL  21          3HG1      VAL  21   3.306  -7.051   0.399
  162   HG21  VAL  21          3HG2      VAL  21   4.981  -7.399  -2.049
  163   HG22  VAL  21          1HG2      VAL  21   3.790  -7.692  -3.318
  164   HG23  VAL  21          2HG2      VAL  21   3.701  -8.584  -1.796
  165    H    VAL  22           H        VAL  22  -0.038  -5.846  -0.101
  166    HA   VAL  22           HA       VAL  22  -0.566  -3.591  -1.932
  167    HB   VAL  22           HB       VAL  22  -2.351  -4.470   0.336
  168   HG11  VAL  22          1HG1      VAL  22  -2.569  -2.133  -0.304
  169   HG12  VAL  22          2HG1      VAL  22  -4.007  -3.041  -0.772
  170   HG13  VAL  22          3HG1      VAL  22  -2.807  -2.601  -1.987
  171   HG21  VAL  22          3HG2      VAL  22  -2.618  -5.094  -2.597
  172   HG22  VAL  22          1HG2      VAL  22  -3.832  -5.425  -1.362
  173   HG23  VAL  22          2HG2      VAL  22  -2.273  -6.249  -1.309
  174    H    VAL  23           H        VAL  23   0.658  -1.929  -1.309
  175    HA   VAL  23           HA       VAL  23   1.091  -1.613   1.574
  176    HB   VAL  23           HB       VAL  23   2.726  -0.308  -0.594
  177   HG11  VAL  23          1HG1      VAL  23   4.327   0.013   1.233
  178   HG12  VAL  23          2HG1      VAL  23   3.202  -0.755   2.352
  179   HG13  VAL  23          3HG1      VAL  23   2.779   0.776   1.591
  180   HG21  VAL  23          3HG2      VAL  23   4.415  -2.043  -0.095
  181   HG22  VAL  23          1HG2      VAL  23   2.951  -2.710  -0.821
  182   HG23  VAL  23          2HG2      VAL  23   3.226  -2.866   0.915
  183    H    ALA  24           H        ALA  24   0.410   0.027   2.598
  184    HA   ALA  24           HA       ALA  24  -1.292   1.973   1.204
  185    HB1  ALA  24           1HB      ALA  24  -1.928   0.436   3.240
  186    HB2  ALA  24           2HB      ALA  24  -2.514   2.096   3.154
  187    HB3  ALA  24           3HB      ALA  24  -1.136   1.700   4.177
  188    H    PHE  25           H        PHE  25   0.070   3.678   0.594
  189    HA   PHE  25           HA       PHE  25   1.738   4.794   2.745
  190    HB2  PHE  25           1HB      PHE  25   2.108   4.566  -0.149
  191    HB3  PHE  25           2HB      PHE  25   2.539   6.145   0.509
  192    HD1  PHE  25           2HD      PHE  25   2.810   2.684   1.819
  193    HD2  PHE  25           1HD      PHE  25   4.819   6.283   0.797
  194    HE1  PHE  25           2HE      PHE  25   4.906   1.751   2.692
  195    HE2  PHE  25           1HE      PHE  25   6.920   5.362   1.678
  196    HZ   PHE  25           HZ       PHE  25   6.961   3.090   2.625
  197    H    TYR  26           H        TYR  26   0.768   6.274   3.852
  198    HA   TYR  26           HA       TYR  26  -0.534   8.466   2.400
  199    HB2  TYR  26           1HB      TYR  26  -2.197   8.633   4.269
  200    HB3  TYR  26           2HB      TYR  26  -2.365   7.193   3.277
  201    HD1  TYR  26           2HD      TYR  26  -1.482   8.477   6.595
  202    HD2  TYR  26           1HD      TYR  26  -1.897   4.994   4.192
  203    HE1  TYR  26           2HE      TYR  26  -1.459   7.082   8.618
  204    HE2  TYR  26           1HE      TYR  26  -1.887   3.589   6.199
  205    HH   TYR  26           HH       TYR  26  -2.415   4.747   9.235
  206    H    ALA  27           H        ALA  27  -1.015  10.206   4.403
  207    HA   ALA  27           HA       ALA  27   1.586  10.490   5.749
  208    HB1  ALA  27           1HB      ALA  27   0.065  12.705   4.375
  209    HB2  ALA  27           2HB      ALA  27   1.498  11.897   3.733
  210    HB3  ALA  27           3HB      ALA  27   1.612  12.854   5.213
  211    H    THR  28           H        THR  28   1.521  11.308   7.810
  212    HA   THR  28           HA       THR  28  -0.950  11.101   9.192
  213    HB   THR  28           HB       THR  28   0.580  12.118  11.086
  214    HG1  THR  28           1HG      THR  28   2.738  11.966  10.640
  215   HG21  THR  28          3HG2      THR  28  -0.228   9.796  10.983
  216   HG22  THR  28          1HG2      THR  28   1.444   9.879  11.537
  217   HG23  THR  28          2HG2      THR  28   1.088   9.395   9.880
  218    H    TRP  29           H        TRP  29   0.700  13.719   7.685
  219    HA   TRP  29           HA       TRP  29  -0.745  15.726   9.193
  220    HB2  TRP  29           1HB      TRP  29   0.427  17.353   7.719
  221    HB3  TRP  29           2HB      TRP  29   1.518  16.290   8.597
  222    HD1  TRP  29           HD       TRP  29   3.233  14.951   7.200
  223    HE1  TRP  29           1HE      TRP  29   3.730  14.702   4.688
  224    HE3  TRP  29           3HE      TRP  29  -0.893  17.307   5.317
  225    HZ2  TRP  29           2HZ      TRP  29   2.529  15.408   2.233
  226    HZ3  TRP  29           3HZ      TRP  29  -1.148  17.475   2.883
  227    HH2  TRP  29           HH       TRP  29   0.533  16.550   1.369
  228    H    CYS  30           H        CYS  30  -1.308  13.822   6.446
  229    HA   CYS  30           HA       CYS  30  -2.967  15.830   5.132
  230    HB2  CYS  30           1HB      CYS  30  -3.127  14.328   3.286
  231    HB3  CYS  30           2HB      CYS  30  -1.456  14.283   3.822
  232    HG   CYS  30           HG       CYS  30  -2.450  11.902   5.492
  233    H    GLY  31           H        GLY  31  -5.180  15.514   4.736
  234    HA2  GLY  31           1HA      GLY  31  -6.573  14.353   6.957
  235    HA3  GLY  31           2HA      GLY  31  -7.290  15.216   5.611
  236    HA   PRO  32           HA       PRO  32  -8.575  11.546   3.542
  237    HB2  PRO  32           1HB      PRO  32  -7.066  10.995   1.348
  238    HB3  PRO  32           2HB      PRO  32  -8.234  12.316   1.424
  239    HG2  PRO  32           1HG      PRO  32  -5.263  12.396   1.818
  240    HG3  PRO  32           2HG      PRO  32  -6.295  13.490   0.875
  241    HD2  PRO  32           1HD      PRO  32  -5.427  14.144   3.323
  242    HD3  PRO  32           2HD      PRO  32  -7.046  14.604   2.760
  243    H    CYS  33           H        CYS  33  -5.664  11.337   5.072
  244    HA   CYS  33           HA       CYS  33  -4.685   8.802   4.336
  245    HB2  CYS  33           1HB      CYS  33  -3.609   8.807   6.577
  246    HB3  CYS  33           2HB      CYS  33  -3.350  10.306   5.691
  247    HG   CYS  33           HG       CYS  33  -4.505  11.920   7.363
  248    H    LYS  34           H        LYS  34  -7.232   9.837   6.471
  249    HA   LYS  34           HA       LYS  34  -7.633   7.375   7.803
  250    HB2  LYS  34           1HB      LYS  34  -9.737   8.345   8.569
  251    HB3  LYS  34           2HB      LYS  34  -8.423   9.504   8.719
  252    HG2  LYS  34           1HG      LYS  34  -9.168  10.586   6.641
  253    HG3  LYS  34           2HG      LYS  34 -10.515   9.448   6.553
  254    HD2  LYS  34           1HD      LYS  34 -11.353  10.277   8.696
  255    HD3  LYS  34           2HD      LYS  34 -10.001  11.406   8.791
  256    HE2  LYS  34           1HE      LYS  34 -12.175  11.373   6.702
  257    HE3  LYS  34           2HE      LYS  34 -11.992  12.546   8.004
  258    HZ1  LYS  34           3HZ      LYS  34 -11.135  13.497   6.015
  259    HZ2  LYS  34           1HZ      LYS  34 -10.175  12.143   5.695
  260    HZ3  LYS  34           2HZ      LYS  34  -9.816  13.141   7.007
  261    H    MET  35           H        MET  35  -8.220   8.217   4.579
  262    HA   MET  35           HA       MET  35 -10.602   6.597   4.271
  263    HB2  MET  35           1HB      MET  35 -10.045   8.538   2.771
  264    HB3  MET  35           2HB      MET  35  -8.697   7.593   2.141
  265    HG2  MET  35           1HG      MET  35 -10.547   7.462   0.626
  266    HG3  MET  35           2HG      MET  35 -10.274   5.889   1.370
  267    HE1  MET  35           3HE      MET  35 -12.824   6.414  -0.250
  268    HE2  MET  35           1HE      MET  35 -14.114   5.843   0.809
  269    HE3  MET  35           2HE      MET  35 -12.619   4.922   0.664
  270    H    ILE  36           H        ILE  36  -7.146   6.275   4.025
  271    HA   ILE  36           HA       ILE  36  -7.237   3.702   2.746
  272    HB   ILE  36           HB       ILE  36  -5.164   5.608   3.542
  273   HG12  ILE  36          1HG1      ILE  36  -4.218   4.947   1.412
  274   HG13  ILE  36          2HG1      ILE  36  -5.318   3.573   1.324
  275   HG21  ILE  36          1HG2      ILE  36  -4.309   3.880   4.916
  276   HG22  ILE  36          2HG2      ILE  36  -3.354   3.877   3.433
  277   HG23  ILE  36          3HG2      ILE  36  -4.605   2.661   3.681
  278   HD11  ILE  36          3HD1      ILE  36  -7.194   5.263   1.433
  279   HD12  ILE  36          1HD1      ILE  36  -6.248   5.210  -0.062
  280   HD13  ILE  36          2HD1      ILE  36  -5.965   6.484   1.123
  281    H    ALA  37           H        ALA  37  -7.068   4.937   5.984
  282    HA   ALA  37           HA       ALA  37  -6.181   2.736   7.365
  283    HB1  ALA  37           1HB      ALA  37  -8.300   4.723   8.145
  284    HB2  ALA  37           2HB      ALA  37  -6.588   4.746   8.554
  285    HB3  ALA  37           3HB      ALA  37  -7.644   3.513   9.245
  286    HA   PRO  38           HA       PRO  38 -10.346   0.591   7.524
  287    HB2  PRO  38           1HB      PRO  38 -12.604   1.562   6.469
  288    HB3  PRO  38           2HB      PRO  38 -11.997   2.125   8.032
  289    HG2  PRO  38           1HG      PRO  38 -11.785   3.413   5.344
  290    HG3  PRO  38           2HG      PRO  38 -12.142   4.152   6.916
  291    HD2  PRO  38           1HD      PRO  38  -9.662   4.168   5.724
  292    HD3  PRO  38           2HD      PRO  38  -9.941   4.322   7.467
  293    H    MET  39           H        MET  39 -10.135   2.265   4.335
  294    HA   MET  39           HA       MET  39 -11.549   0.228   2.950
  295    HB2  MET  39           1HB      MET  39 -11.395   2.390   1.945
  296    HB3  MET  39           2HB      MET  39  -9.652   2.408   2.078
  297    HG2  MET  39           1HG      MET  39 -11.033   0.408   0.338
  298    HG3  MET  39           2HG      MET  39 -10.735   2.053  -0.221
  299    HE1  MET  39           3HE      MET  39  -7.798   2.014   1.834
  300    HE2  MET  39           1HE      MET  39  -8.224   3.087   0.494
  301    HE3  MET  39           2HE      MET  39  -6.762   2.109   0.408
  302    H    ILE  40           H        ILE  40  -8.187   0.685   3.747
  303    HA   ILE  40           HA       ILE  40  -7.345  -1.536   2.134
  304    HB   ILE  40           HB       ILE  40  -6.092   0.625   3.610
  305   HG12  ILE  40          1HG1      ILE  40  -5.082  -1.049   1.315
  306   HG13  ILE  40          2HG1      ILE  40  -6.231   0.273   1.130
  307   HG21  ILE  40          1HG2      ILE  40  -3.902  -0.569   3.863
  308   HG22  ILE  40          2HG2      ILE  40  -4.785  -2.085   3.666
  309   HG23  ILE  40          3HG2      ILE  40  -5.147  -1.021   5.025
  310   HD11  ILE  40          3HD1      ILE  40  -4.601   1.834   1.977
  311   HD12  ILE  40          1HD1      ILE  40  -3.945   0.940   0.610
  312   HD13  ILE  40          2HD1      ILE  40  -3.463   0.523   2.251
  313    H    GLU  41           H        GLU  41  -7.900  -0.917   5.593
  314    HA   GLU  41           HA       GLU  41  -7.138  -3.513   6.417
  315    HB2  GLU  41           1HB      GLU  41  -9.032  -1.475   7.565
  316    HB3  GLU  41           2HB      GLU  41  -8.871  -3.070   8.288
  317    HG2  GLU  41           1HG      GLU  41  -6.454  -2.669   8.568
  318    HG3  GLU  41           2HG      GLU  41  -6.680  -1.041   7.929
  319    H    LYS  42           H        LYS  42  -9.855  -2.350   4.654
  320    HA   LYS  42           HA       LYS  42 -11.515  -4.610   5.281
  321    HB2  LYS  42           1HB      LYS  42 -11.951  -2.227   3.498
  322    HB3  LYS  42           2HB      LYS  42 -13.106  -3.554   3.626
  323    HG2  LYS  42           1HG      LYS  42 -13.248  -3.143   6.060
  324    HG3  LYS  42           2HG      LYS  42 -12.177  -1.757   5.858
  325    HD2  LYS  42           1HD      LYS  42 -14.248  -0.748   5.822
  326    HD3  LYS  42           2HD      LYS  42 -13.953  -1.001   4.101
  327    HE2  LYS  42           1HE      LYS  42 -16.213  -1.654   4.643
  328    HE3  LYS  42           2HE      LYS  42 -15.274  -3.077   4.208
  329    HZ1  LYS  42           3HZ      LYS  42 -15.753  -2.229   7.009
  330    HZ2  LYS  42           1HZ      LYS  42 -15.096  -3.702   6.482
  331    HZ3  LYS  42           2HZ      LYS  42 -16.727  -3.346   6.193
  332    H    PHE  43           H        PHE  43  -9.354  -3.716   2.618
  333    HA   PHE  43           HA       PHE  43 -10.337  -5.664   0.829
  334    HB2  PHE  43           1HB      PHE  43  -8.361  -5.496  -0.446
  335    HB3  PHE  43           2HB      PHE  43  -8.542  -3.907   0.285
  336    HD1  PHE  43           1HD      PHE  43  -6.798  -7.158   0.982
  337    HD2  PHE  43           2HD      PHE  43  -6.650  -2.908   1.076
  338    HE1  PHE  43           1HE      PHE  43  -4.461  -7.260   1.731
  339    HE2  PHE  43           2HE      PHE  43  -4.319  -3.008   1.848
  340    HZ   PHE  43           HZ       PHE  43  -3.222  -5.184   2.174
  341    H    SER  44           H        SER  44  -8.034  -5.954   3.557
  342    HA   SER  44           HA       SER  44  -7.755  -8.803   3.066
  343    HB2  SER  44           1HB      SER  44  -6.741  -8.309   5.602
  344    HB3  SER  44           2HB      SER  44  -5.829  -8.380   4.091
  345    HG   SER  44           HG       SER  44  -5.831  -6.199   3.980
  346    H    GLU  45           H        GLU  45  -9.873  -6.746   4.833
  347    HA   GLU  45           HA       GLU  45 -10.957  -8.494   6.704
  348    HB2  GLU  45           1HB      GLU  45 -11.695  -6.187   6.533
  349    HB3  GLU  45           2HB      GLU  45 -12.334  -6.475   4.922
  350    HG2  GLU  45           1HG      GLU  45 -13.896  -8.155   6.014
  351    HG3  GLU  45           2HG      GLU  45 -13.393  -7.450   7.551
  352    H    GLN  46           H        GLN  46 -11.452  -8.229   3.223
  353    HA   GLN  46           HA       GLN  46 -13.244 -10.488   3.158
  354    HB2  GLN  46           1HB      GLN  46 -11.900  -9.026   0.880
  355    HB3  GLN  46           2HB      GLN  46 -13.212 -10.184   0.730
  356    HG2  GLN  46           1HG      GLN  46 -14.670  -8.655   1.993
  357    HG3  GLN  46           2HG      GLN  46 -13.353  -7.486   2.054
  358   HE21  GLN  46          1HE2      GLN  46 -12.458  -8.195  -0.659
  359   HE22  GLN  46          2HE2      GLN  46 -13.593  -7.462  -1.735
  360    H    TYR  47           H        TYR  47  -9.957  -9.719   2.090
  361    HA   TYR  47           HA       TYR  47  -9.363 -12.580   2.015
  362    HB2  TYR  47           1HB      TYR  47  -8.012 -12.070  -0.100
  363    HB3  TYR  47           2HB      TYR  47  -9.761 -12.153  -0.238
  364    HD1  TYR  47           2HD      TYR  47  -6.900  -9.788  -0.069
  365    HD2  TYR  47           1HD      TYR  47 -11.019 -10.332  -0.979
  366    HE1  TYR  47           2HE      TYR  47  -6.965  -7.555  -1.106
  367    HE2  TYR  47           1HE      TYR  47 -11.093  -8.098  -2.002
  368    HH   TYR  47           HH       TYR  47  -8.260  -6.273  -2.626
  369    HA   PRO  48           HA       PRO  48  -5.921 -10.580   4.257
  370    HB2  PRO  48           1HB      PRO  48  -5.530 -12.536   6.038
  371    HB3  PRO  48           2HB      PRO  48  -6.806 -11.336   6.246
  372    HG2  PRO  48           1HG      PRO  48  -7.004 -14.142   5.214
  373    HG3  PRO  48           2HG      PRO  48  -8.073 -13.289   6.343
  374    HD2  PRO  48           1HD      PRO  48  -8.626 -13.598   3.683
  375    HD3  PRO  48           2HD      PRO  48  -9.215 -12.230   4.650
  376    H    GLN  49           H        GLN  49  -6.364 -13.118   2.217
  377    HA   GLN  49           HA       GLN  49  -3.932 -14.499   2.265
  378    HB2  GLN  49           1HB      GLN  49  -4.534 -15.084  -0.109
  379    HB3  GLN  49           2HB      GLN  49  -5.749 -15.475   1.098
  380    HG2  GLN  49           1HG      GLN  49  -7.171 -14.361  -0.147
  381    HG3  GLN  49           2HG      GLN  49  -6.305 -12.922   0.377
  382   HE21  GLN  49          1HE2      GLN  49  -4.862 -11.921  -1.034
  383   HE22  GLN  49          2HE2      GLN  49  -4.839 -12.273  -2.725
  384    H    ALA  50           H        ALA  50  -4.562 -11.313   1.440
  385    HA   ALA  50           HA       ALA  50  -2.179 -11.128  -0.281
  386    HB1  ALA  50           1HB      ALA  50  -4.291  -9.078   0.387
  387    HB2  ALA  50           2HB      ALA  50  -4.146  -9.975  -1.126
  388    HB3  ALA  50           3HB      ALA  50  -2.907  -8.803  -0.668
  389    H    ASP  51           H        ASP  51  -0.618  -9.355   0.262
  390    HA   ASP  51           HA       ASP  51  -0.262  -9.348   3.150
  391    HB2  ASP  51           1HB      ASP  51   1.578  -9.214   0.899
  392    HB3  ASP  51           2HB      ASP  51   1.919  -8.014   2.119
  393    H    PHE  52           H        PHE  52  -0.384  -7.670   4.402
  394    HA   PHE  52           HA       PHE  52  -1.353  -5.173   3.195
  395    HB2  PHE  52           1HB      PHE  52  -2.361  -5.130   5.704
  396    HB3  PHE  52           2HB      PHE  52  -3.225  -5.802   4.327
  397    HD1  PHE  52           2HD      PHE  52  -1.028  -6.692   7.180
  398    HD2  PHE  52           1HD      PHE  52  -3.798  -8.070   4.261
  399    HE1  PHE  52           2HE      PHE  52  -1.112  -8.880   8.296
  400    HE2  PHE  52           1HE      PHE  52  -3.885 -10.261   5.373
  401    HZ   PHE  52           HZ       PHE  52  -2.541 -10.667   7.393
  402    H    TYR  53           H        TYR  53   0.058  -3.566   3.414
  403    HA   TYR  53           HA       TYR  53   1.300  -3.172   6.033
  404    HB2  TYR  53           1HB      TYR  53   2.851  -3.071   3.429
  405    HB3  TYR  53           2HB      TYR  53   3.466  -2.622   5.015
  406    HD1  TYR  53           1HD      TYR  53   4.009  -4.331   6.665
  407    HD2  TYR  53           2HD      TYR  53   2.561  -5.385   2.809
  408    HE1  TYR  53           1HE      TYR  53   4.733  -6.652   7.034
  409    HE2  TYR  53           2HE      TYR  53   3.287  -7.709   3.161
  410    HH   TYR  53           HH       TYR  53   4.549  -9.054   4.466
  411    H    LYS  54           H        LYS  54   1.919  -1.009   6.476
  412    HA   LYS  54           HA       LYS  54   0.981   1.027   4.624
  413    HB2  LYS  54           1HB      LYS  54  -0.658   1.946   6.095
  414    HB3  LYS  54           2HB      LYS  54  -0.987   0.225   5.928
  415    HG2  LYS  54           1HG      LYS  54  -0.177  -0.240   8.096
  416    HG3  LYS  54           2HG      LYS  54   0.512   1.378   8.262
  417    HD2  LYS  54           1HD      LYS  54  -1.763   2.328   8.142
  418    HD3  LYS  54           2HD      LYS  54  -2.422   0.695   8.054
  419    HE2  LYS  54           1HE      LYS  54  -0.646   1.501  10.322
  420    HE3  LYS  54           2HE      LYS  54  -2.355   1.927  10.334
  421    HZ1  LYS  54           3HZ      LYS  54  -1.855  -0.170  11.492
  422    HZ2  LYS  54           1HZ      LYS  54  -1.318  -0.844  10.037
  423    HZ3  LYS  54           2HZ      LYS  54  -2.938  -0.378  10.212
  424    H    LEU  55           H        LEU  55   1.640   3.175   5.184
  425    HA   LEU  55           HA       LEU  55   3.346   3.613   7.458
  426    HB2  LEU  55           1HB      LEU  55   4.894   2.391   6.097
  427    HB3  LEU  55           2HB      LEU  55   4.478   3.327   4.679
  428    HG   LEU  55           HG       LEU  55   5.693   4.755   7.005
  429   HD11  LEU  55          1HD1      LEU  55   7.934   4.227   6.104
  430   HD12  LEU  55          2HD1      LEU  55   7.199   3.039   5.030
  431   HD13  LEU  55          3HD1      LEU  55   7.124   2.814   6.777
  432   HD21  LEU  55          3HD2      LEU  55   6.404   5.113   4.137
  433   HD22  LEU  55          1HD2      LEU  55   6.279   6.309   5.428
  434   HD23  LEU  55          2HD2      LEU  55   4.816   5.653   4.688
  435    H    ASP  56           H        ASP  56   3.882   5.847   7.736
  436    HA   ASP  56           HA       ASP  56   2.380   7.673   6.028
  437    HB2  ASP  56           1HB      ASP  56   2.797   9.322   7.817
  438    HB3  ASP  56           2HB      ASP  56   1.899   7.922   8.381
  439    H    VAL  57           H        VAL  57   3.337   9.035   4.663
  440    HA   VAL  57           HA       VAL  57   6.135   8.780   4.146
  441    HB   VAL  57           HB       VAL  57   5.798  10.058   2.238
  442   HG11  VAL  57          1HG1      VAL  57   4.370   8.039   2.250
  443   HG12  VAL  57          2HG1      VAL  57   3.737   9.330   1.227
  444   HG13  VAL  57          3HG1      VAL  57   3.022   9.035   2.814
  445   HG21  VAL  57          3HG2      VAL  57   4.039  11.721   1.939
  446   HG22  VAL  57          1HG2      VAL  57   5.037  12.095   3.343
  447   HG23  VAL  57          2HG2      VAL  57   3.439  11.385   3.563
  448    H    ASP  58           H        ASP  58   4.400  10.691   6.311
  449    HA   ASP  58           HA       ASP  58   5.874  13.105   6.219
  450    HB2  ASP  58           1HB      ASP  58   3.714  12.999   7.347
  451    HB3  ASP  58           2HB      ASP  58   4.352  11.839   8.509
  452    H    GLU  59           H        GLU  59   6.116  10.240   8.304
  453    HA   GLU  59           HA       GLU  59   8.647  11.086   9.372
  454    HB2  GLU  59           1HB      GLU  59   6.980   8.602   9.602
  455    HB3  GLU  59           2HB      GLU  59   8.625   8.645  10.224
  456    HG2  GLU  59           1HG      GLU  59   6.534  10.644  11.023
  457    HG3  GLU  59           2HG      GLU  59   6.787   9.125  11.879
  458    H    LEU  60           H        LEU  60   7.521   8.782   6.921
  459    HA   LEU  60           HA       LEU  60  10.360   8.270   6.278
  460    HB2  LEU  60           1HB      LEU  60   7.984   6.452   6.023
  461    HB3  LEU  60           2HB      LEU  60   9.524   6.113   5.273
  462    HG   LEU  60           HG       LEU  60   9.568   4.831   7.205
  463   HD11  LEU  60          1HD1      LEU  60  10.877   7.410   8.031
  464   HD12  LEU  60          2HD1      LEU  60  11.585   6.188   6.975
  465   HD13  LEU  60          3HD1      LEU  60  11.229   5.800   8.658
  466   HD21  LEU  60          3HD2      LEU  60   8.409   7.165   8.716
  467   HD22  LEU  60          1HD2      LEU  60   8.881   5.619   9.421
  468   HD23  LEU  60          2HD2      LEU  60   7.562   5.689   8.254
  469    H    GLY  61           H        GLY  61  10.070  10.286   4.978
  470    HA2  GLY  61           1HA      GLY  61   8.539  10.139   2.556
  471    HA3  GLY  61           2HA      GLY  61   9.754  11.345   2.950
  472    H    ASP  62           H        ASP  62  11.885   9.517   3.444
  473    HA   ASP  62           HA       ASP  62  12.933   9.165   0.859
  474    HB2  ASP  62           1HB      ASP  62  14.441   9.410   2.708
  475    HB3  ASP  62           2HB      ASP  62  13.750   8.017   3.525
  476    H    VAL  63           H        VAL  63  11.142   7.075   2.935
  477    HA   VAL  63           HA       VAL  63  11.506   4.696   1.432
  478    HB   VAL  63           HB       VAL  63   9.191   5.470   3.196
  479   HG11  VAL  63          1HG1      VAL  63   8.895   3.005   3.402
  480   HG12  VAL  63          2HG1      VAL  63  10.118   2.801   2.148
  481   HG13  VAL  63          3HG1      VAL  63   8.607   3.623   1.777
  482   HG21  VAL  63          3HG2      VAL  63  10.334   4.237   4.961
  483   HG22  VAL  63          1HG2      VAL  63  11.351   5.552   4.372
  484   HG23  VAL  63          2HG2      VAL  63  11.675   3.891   3.869
  485    H    ALA  64           H        ALA  64   8.840   7.075   1.577
  486    HA   ALA  64           HA       ALA  64   7.233   6.093  -0.422
  487    HB1  ALA  64           1HB      ALA  64   6.612   7.972   0.996
  488    HB2  ALA  64           2HB      ALA  64   6.429   8.387  -0.711
  489    HB3  ALA  64           3HB      ALA  64   7.816   8.986   0.200
  490    H    GLN  65           H        GLN  65  10.132   8.091  -0.722
  491    HA   GLN  65           HA       GLN  65   9.840   8.532  -3.529
  492    HB2  GLN  65           1HB      GLN  65  12.314   8.713  -1.804
  493    HB3  GLN  65           2HB      GLN  65  12.175   9.323  -3.447
  494    HG2  GLN  65           1HG      GLN  65  10.328  10.806  -2.642
  495    HG3  GLN  65           2HG      GLN  65  10.728  10.297  -1.001
  496   HE21  GLN  65          1HE2      GLN  65  11.331  12.349  -0.356
  497   HE22  GLN  65          2HE2      GLN  65  12.785  13.107  -0.909
  498    H    LYS  66           H        LYS  66  11.396   6.073  -1.595
  499    HA   LYS  66           HA       LYS  66  12.844   4.780  -3.594
  500    HB2  LYS  66           1HB      LYS  66  13.487   3.885  -1.625
  501    HB3  LYS  66           2HB      LYS  66  11.965   4.305  -0.853
  502    HG2  LYS  66           1HG      LYS  66  12.108   2.001  -0.684
  503    HG3  LYS  66           2HG      LYS  66  10.987   2.300  -2.003
  504    HD2  LYS  66           1HD      LYS  66  12.749   1.841  -3.629
  505    HD3  LYS  66           2HD      LYS  66  13.906   1.587  -2.318
  506    HE2  LYS  66           1HE      LYS  66  12.659  -0.321  -1.529
  507    HE3  LYS  66           2HE      LYS  66  11.388  -0.025  -2.713
  508    HZ1  LYS  66           3HZ      LYS  66  12.913  -0.538  -4.475
  509    HZ2  LYS  66           1HZ      LYS  66  12.913  -1.820  -3.367
  510    HZ3  LYS  66           2HZ      LYS  66  14.195  -0.712  -3.389
  511    H    ASN  67           H        ASN  67   9.451   4.897  -2.925
  512    HA   ASN  67           HA       ASN  67   8.948   2.405  -4.386
  513    HB2  ASN  67           1HB      ASN  67   6.950   3.988  -2.822
  514    HB3  ASN  67           2HB      ASN  67   6.895   2.299  -3.259
  515   HD21  ASN  67          1HD2      ASN  67   6.952   4.051  -0.752
  516   HD22  ASN  67          2HD2      ASN  67   7.999   3.192   0.291
  517    H    GLU  68           H        GLU  68   8.892   5.737  -4.709
  518    HA   GLU  68           HA       GLU  68   8.343   7.030  -6.489
  519    HB2  GLU  68           1HB      GLU  68   8.487   4.995  -7.910
  520    HB3  GLU  68           2HB      GLU  68   6.787   4.673  -7.571
  521    HG2  GLU  68           1HG      GLU  68   6.253   6.872  -8.629
  522    HG3  GLU  68           2HG      GLU  68   7.949   7.010  -9.083
  523    H    VAL  69           H        VAL  69   6.676   6.347  -4.003
  524    HA   VAL  69           HA       VAL  69   4.130   7.429  -4.946
  525    HB   VAL  69           HB       VAL  69   3.523   5.747  -3.493
  526   HG11  VAL  69          1HG1      VAL  69   5.568   6.525  -1.432
  527   HG12  VAL  69          2HG1      VAL  69   5.863   5.332  -2.687
  528   HG13  VAL  69          3HG1      VAL  69   4.585   5.057  -1.507
  529   HG21  VAL  69          3HG2      VAL  69   2.436   7.818  -2.820
  530   HG22  VAL  69          1HG2      VAL  69   3.746   8.147  -1.687
  531   HG23  VAL  69          2HG2      VAL  69   2.689   6.758  -1.433
  532    H    SER  70           H        SER  70   3.796   9.499  -4.940
  533    HA   SER  70           HA       SER  70   5.410  11.189  -3.145
  534    HB2  SER  70           1HB      SER  70   4.302  11.981  -5.846
  535    HB3  SER  70           2HB      SER  70   5.463  12.870  -4.862
  536    HG   SER  70           HG       SER  70   6.700  10.711  -5.123
  537    H    ALA  71           H        ALA  71   2.263  10.535  -4.513
  538    HA   ALA  71           HA       ALA  71   1.050  12.768  -3.079
  539    HB1  ALA  71           1HB      ALA  71  -0.179  10.732  -4.940
  540    HB2  ALA  71           2HB      ALA  71   0.316  12.369  -5.370
  541    HB3  ALA  71           3HB      ALA  71  -1.012  12.118  -4.238
  542    H    MET  72           H        MET  72  -0.944  12.298  -1.798
  543    HA   MET  72           HA       MET  72  -1.002   9.641  -0.616
  544    HB2  MET  72           1HB      MET  72  -0.974  10.559   1.690
  545    HB3  MET  72           2HB      MET  72   0.551  10.758   0.844
  546    HG2  MET  72           1HG      MET  72  -1.495  12.946   1.014
  547    HG3  MET  72           2HG      MET  72  -0.261  12.703   2.245
  548    HE1  MET  72           3HE      MET  72   2.324  12.741   1.731
  549    HE2  MET  72           1HE      MET  72   3.034  13.281   0.207
  550    HE3  MET  72           2HE      MET  72   2.216  11.724   0.295
  551    HA   PRO  73           HA       PRO  73  -1.974   8.581   0.698
  552    HB2  PRO  73           1HB      PRO  73  -4.022   6.834   0.755
  553    HB3  PRO  73           2HB      PRO  73  -3.721   7.997   2.047
  554    HG2  PRO  73           1HG      PRO  73  -5.804   8.009  -0.059
  555    HG3  PRO  73           2HG      PRO  73  -5.855   8.695   1.584
  556    HD2  PRO  73           1HD      PRO  73  -5.388  10.086  -0.839
  557    HD3  PRO  73           2HD      PRO  73  -5.180  10.715   0.803
  558    H    THR  74           H        THR  74  -1.238   6.723  -0.293
  559    HA   THR  74           HA       THR  74  -2.096   6.216  -3.064
  560    HB   THR  74           HB       THR  74   0.700   6.663  -2.021
  561    HG1  THR  74           1HG      THR  74   0.213   8.514  -2.915
  562   HG21  THR  74          3HG2      THR  74   1.518   5.949  -4.269
  563   HG22  THR  74          1HG2      THR  74  -0.088   5.284  -4.593
  564   HG23  THR  74          2HG2      THR  74   0.896   4.636  -3.274
  565    H    LEU  75           H        LEU  75  -2.332   4.147  -3.560
  566    HA   LEU  75           HA       LEU  75  -1.378   2.117  -1.655
  567    HB2  LEU  75           1HB      LEU  75  -3.362   1.902  -3.909
  568    HB3  LEU  75           2HB      LEU  75  -2.929   0.611  -2.807
  569    HG   LEU  75           HG       LEU  75  -3.806   2.513  -1.070
  570   HD11  LEU  75          1HD1      LEU  75  -4.505   3.993  -2.923
  571   HD12  LEU  75          2HD1      LEU  75  -5.868   3.454  -1.943
  572   HD13  LEU  75          3HD1      LEU  75  -5.573   2.720  -3.518
  573   HD21  LEU  75          3HD2      LEU  75  -5.841   1.145  -0.975
  574   HD22  LEU  75          1HD2      LEU  75  -4.376   0.169  -1.071
  575   HD23  LEU  75          2HD2      LEU  75  -5.387   0.388  -2.500
  576    H    LEU  76           H        LEU  76   0.291   0.825  -2.267
  577    HA   LEU  76           HA       LEU  76   0.868   0.668  -5.149
  578    HB2  LEU  76           1HB      LEU  76   2.555   1.489  -2.993
  579    HB3  LEU  76           2HB      LEU  76   3.195   0.006  -3.679
  580    HG   LEU  76           HG       LEU  76   2.563   2.501  -5.259
  581   HD11  LEU  76          1HD1      LEU  76   4.983   2.797  -5.426
  582   HD12  LEU  76          2HD1      LEU  76   5.227   1.389  -4.378
  583   HD13  LEU  76          3HD1      LEU  76   4.450   2.836  -3.738
  584   HD21  LEU  76          3HD2      LEU  76   4.013  -0.017  -6.073
  585   HD22  LEU  76          1HD2      LEU  76   3.684   1.386  -7.088
  586   HD23  LEU  76          2HD2      LEU  76   2.355   0.382  -6.513
  587    H    LEU  77           H        LEU  77   0.429  -1.224  -5.944
  588    HA   LEU  77           HA       LEU  77   0.508  -3.617  -4.240
  589    HB2  LEU  77           1HB      LEU  77  -0.728  -3.045  -6.938
  590    HB3  LEU  77           2HB      LEU  77  -0.585  -4.669  -6.304
  591    HG   LEU  77           HG       LEU  77  -2.255  -4.326  -4.689
  592   HD11  LEU  77          1HD1      LEU  77  -2.036  -1.349  -5.176
  593   HD12  LEU  77          2HD1      LEU  77  -1.438  -2.204  -3.754
  594   HD13  LEU  77          3HD1      LEU  77  -3.170  -2.141  -4.082
  595   HD21  LEU  77          3HD2      LEU  77  -4.132  -3.474  -5.934
  596   HD22  LEU  77          1HD2      LEU  77  -3.070  -4.391  -7.005
  597   HD23  LEU  77          2HD2      LEU  77  -3.052  -2.626  -7.041
  598    H    PHE  78           H        PHE  78   2.025  -5.182  -4.581
  599    HA   PHE  78           HA       PHE  78   3.741  -4.917  -6.964
  600    HB2  PHE  78           1HB      PHE  78   4.553  -5.119  -4.084
  601    HB3  PHE  78           2HB      PHE  78   5.612  -5.715  -5.357
  602    HD1  PHE  78           1HD      PHE  78   6.679  -4.186  -6.902
  603    HD2  PHE  78           2HD      PHE  78   4.145  -2.764  -3.799
  604    HE1  PHE  78           1HE      PHE  78   7.577  -1.920  -7.218
  605    HE2  PHE  78           2HE      PHE  78   5.037  -0.501  -4.113
  606    HZ   PHE  78           HZ       PHE  78   6.752  -0.070  -5.820
  607    H    LYS  79           H        LYS  79   4.690  -6.863  -7.760
  608    HA   LYS  79           HA       LYS  79   4.037  -9.330  -6.270
  609    HB2  LYS  79           1HB      LYS  79   2.571  -9.021  -8.299
  610    HB3  LYS  79           2HB      LYS  79   4.028  -9.093  -9.274
  611    HG2  LYS  79           1HG      LYS  79   2.962 -11.231  -9.321
  612    HG3  LYS  79           2HG      LYS  79   4.464 -11.361  -8.406
  613    HD2  LYS  79           1HD      LYS  79   2.787 -12.587  -7.231
  614    HD3  LYS  79           2HD      LYS  79   3.113 -11.117  -6.314
  615    HE2  LYS  79           1HE      LYS  79   0.742 -11.465  -6.372
  616    HE3  LYS  79           2HE      LYS  79   1.125 -10.078  -7.390
  617    HZ1  LYS  79           3HZ      LYS  79  -0.473 -11.518  -8.466
  618    HZ2  LYS  79           1HZ      LYS  79   0.579 -12.837  -8.339
  619    HZ3  LYS  79           2HZ      LYS  79   0.981 -11.530  -9.329
  620    H    ASN  80           H        ASN  80   5.849 -10.260  -5.661
  621    HA   ASN  80           HA       ASN  80   8.048 -10.746  -5.402
  622    HB2  ASN  80           1HB      ASN  80   9.062 -12.006  -7.289
  623    HB3  ASN  80           2HB      ASN  80   7.459 -12.562  -6.835
  624   HD21  ASN  80          1HD2      ASN  80   5.851 -12.515  -8.313
  625   HD22  ASN  80          2HD2      ASN  80   6.063 -12.027  -9.958
  626    H    GLY  81           H        GLY  81   8.164  -8.163  -5.422
  627    HA2  GLY  81           1HA      GLY  81   9.877  -6.587  -5.543
  628    HA3  GLY  81           2HA      GLY  81  10.757  -7.683  -6.605
  629    H    LYS  82           H        LYS  82   7.848  -7.565  -7.980
  630    HA   LYS  82           HA       LYS  82   8.588  -5.294  -9.702
  631    HB2  LYS  82           1HB      LYS  82   6.749  -7.603 -10.378
  632    HB3  LYS  82           2HB      LYS  82   7.392  -6.402 -11.487
  633    HG2  LYS  82           1HG      LYS  82   9.012  -8.491 -10.039
  634    HG3  LYS  82           2HG      LYS  82   8.492  -8.574 -11.723
  635    HD2  LYS  82           1HD      LYS  82  10.246  -6.406 -10.578
  636    HD3  LYS  82           2HD      LYS  82  10.839  -7.821 -11.443
  637    HE2  LYS  82           1HE      LYS  82   9.552  -7.135 -13.421
  638    HE3  LYS  82           2HE      LYS  82   8.995  -5.706 -12.550
  639    HZ1  LYS  82           3HZ      LYS  82  11.261  -4.933 -12.401
  640    HZ2  LYS  82           1HZ      LYS  82  10.866  -5.231 -14.020
  641    HZ3  LYS  82           2HZ      LYS  82  11.830  -6.328 -13.169
  642    H    GLU  83           H        GLU  83   6.715  -4.021 -10.476
  643    HA   GLU  83           HA       GLU  83   4.799  -3.562  -8.415
  644    HB2  GLU  83           1HB      GLU  83   5.762  -1.861 -10.050
  645    HB3  GLU  83           2HB      GLU  83   4.708  -2.565 -11.266
  646    HG2  GLU  83           1HG      GLU  83   2.752  -1.926 -10.017
  647    HG3  GLU  83           2HG      GLU  83   3.762  -1.352  -8.683
  648    H    VAL  84           H        VAL  84   2.382  -3.498  -9.082
  649    HA   VAL  84           HA       VAL  84   1.702  -5.088 -11.397
  650    HB   VAL  84           HB       VAL  84  -0.281  -6.067 -10.013
  651   HG11  VAL  84          1HG1      VAL  84   2.466  -7.284  -9.775
  652   HG12  VAL  84          2HG1      VAL  84   1.443  -7.367 -11.212
  653   HG13  VAL  84          3HG1      VAL  84   0.916  -8.132  -9.713
  654   HG21  VAL  84          3HG2      VAL  84   1.851  -5.792  -7.916
  655   HG22  VAL  84          1HG2      VAL  84   0.338  -6.682  -7.751
  656   HG23  VAL  84          2HG2      VAL  84   0.314  -4.930  -7.947
  657    H    ALA  85           H        ALA  85   0.799  -2.896  -8.830
  658    HA   ALA  85           HA       ALA  85  -0.610  -1.245 -10.651
  659    HB1  ALA  85           1HB      ALA  85  -2.221  -2.840  -8.683
  660    HB2  ALA  85           2HB      ALA  85  -2.408  -2.775 -10.434
  661    HB3  ALA  85           3HB      ALA  85  -2.815  -1.368  -9.452
  662    H    LYS  86           H        LYS  86  -1.320   0.746  -9.725
  663    HA   LYS  86           HA       LYS  86  -0.795   1.225  -6.920
  664    HB2  LYS  86           1HB      LYS  86   0.661   3.201  -7.435
  665    HB3  LYS  86           2HB      LYS  86   1.402   1.640  -7.742
  666    HG2  LYS  86           1HG      LYS  86   0.721   1.947 -10.160
  667    HG3  LYS  86           2HG      LYS  86   0.355   3.620  -9.734
  668    HD2  LYS  86           1HD      LYS  86   2.611   4.020  -9.070
  669    HD3  LYS  86           2HD      LYS  86   3.014   2.309  -9.223
  670    HE2  LYS  86           1HE      LYS  86   2.276   2.620 -11.686
  671    HE3  LYS  86           2HE      LYS  86   2.513   4.336 -11.361
  672    HZ1  LYS  86           3HZ      LYS  86   4.785   3.929 -10.778
  673    HZ2  LYS  86           1HZ      LYS  86   4.489   3.225 -12.292
  674    HZ3  LYS  86           2HZ      LYS  86   4.571   2.248 -10.910
  675    H    VAL  87           H        VAL  87  -2.053   2.822  -6.103
  676    HA   VAL  87           HA       VAL  87  -3.694   4.338  -8.019
  677    HB   VAL  87           HB       VAL  87  -4.862   2.979  -5.588
  678   HG11  VAL  87          1HG1      VAL  87  -7.003   3.510  -6.666
  679   HG12  VAL  87          2HG1      VAL  87  -6.134   4.336  -7.959
  680   HG13  VAL  87          3HG1      VAL  87  -6.060   4.955  -6.309
  681   HG21  VAL  87          3HG2      VAL  87  -5.890   1.361  -7.097
  682   HG22  VAL  87          1HG2      VAL  87  -4.131   1.269  -7.178
  683   HG23  VAL  87          2HG2      VAL  87  -5.032   2.074  -8.463
  684    H    VAL  88           H        VAL  88  -3.739   6.434  -7.525
  685    HA   VAL  88           HA       VAL  88  -2.674   7.271  -4.945
  686    HB   VAL  88           HB       VAL  88  -2.673   9.567  -5.979
  687   HG11  VAL  88          1HG1      VAL  88  -0.677   8.165  -5.940
  688   HG12  VAL  88          2HG1      VAL  88  -0.747   9.119  -7.420
  689   HG13  VAL  88          3HG1      VAL  88  -1.168   7.407  -7.455
  690   HG21  VAL  88          3HG2      VAL  88  -4.429   9.208  -7.648
  691   HG22  VAL  88          1HG2      VAL  88  -3.403   8.042  -8.483
  692   HG23  VAL  88          2HG2      VAL  88  -2.930   9.739  -8.408
  693    H    GLY  89           H        GLY  89  -5.038   6.207  -4.431
  694    HA2  GLY  89           1HA      GLY  89  -6.490   8.011  -3.028
  695    HA3  GLY  89           2HA      GLY  89  -7.190   8.112  -4.638
  696    H    ALA  90           H        ALA  90  -7.768   6.839  -1.775
  697    HA   ALA  90           HA       ALA  90  -8.207   4.102  -2.214
  698    HB1  ALA  90           1HB      ALA  90  -9.518   6.019  -0.326
  699    HB2  ALA  90           2HB      ALA  90  -8.150   4.964  -0.006
  700    HB3  ALA  90           3HB      ALA  90  -9.748   4.270  -0.281
  701    H    ASN  91           H        ASN  91  -9.563   3.165  -3.479
  702    HA   ASN  91           HA       ASN  91 -12.125   4.470  -4.066
  703    HB2  ASN  91           1HB      ASN  91 -10.172   3.732  -5.850
  704    HB3  ASN  91           2HB      ASN  91 -11.241   2.333  -5.866
  705   HD21  ASN  91          1HD2      ASN  91 -13.573   4.025  -5.174
  706   HD22  ASN  91          2HD2      ASN  91 -14.000   4.826  -6.648
  707    HA   PRO  92           HA       PRO  92 -13.224   1.487  -0.798
  708    HB2  PRO  92           1HB      PRO  92 -15.717   1.844  -2.419
  709    HB3  PRO  92           2HB      PRO  92 -15.525   1.754  -0.666
  710    HG2  PRO  92           1HG      PRO  92 -15.668   4.107  -2.102
  711    HG3  PRO  92           2HG      PRO  92 -14.937   3.947  -0.497
  712    HD2  PRO  92           1HD      PRO  92 -13.623   4.612  -2.932
  713    HD3  PRO  92           2HD      PRO  92 -12.874   4.314  -1.365
  714    H    ALA  93           H        ALA  93 -15.159   0.694  -3.687
  715    HA   ALA  93           HA       ALA  93 -14.682  -2.113  -3.137
  716    HB1  ALA  93           1HB      ALA  93 -16.942  -1.324  -3.661
  717    HB2  ALA  93           2HB      ALA  93 -16.387  -2.534  -4.819
  718    HB3  ALA  93           3HB      ALA  93 -16.394  -0.828  -5.262
  719    H    ALA  94           H        ALA  94 -13.777   0.252  -5.571
  720    HA   ALA  94           HA       ALA  94 -12.938  -1.600  -7.542
  721    HB1  ALA  94           1HB      ALA  94 -13.423   0.785  -7.997
  722    HB2  ALA  94           2HB      ALA  94 -11.864   0.255  -8.627
  723    HB3  ALA  94           3HB      ALA  94 -11.937   1.211  -7.151
  724    H    ILE  95           H        ILE  95 -11.351  -0.247  -4.726
  725    HA   ILE  95           HA       ILE  95  -8.742  -1.169  -5.447
  726    HB   ILE  95           HB       ILE  95  -9.865  -0.409  -2.752
  727   HG12  ILE  95          1HG1      ILE  95  -9.703   1.460  -4.316
  728   HG13  ILE  95          2HG1      ILE  95  -8.494   1.618  -3.047
  729   HG21  ILE  95          1HG2      ILE  95  -8.060  -1.974  -2.423
  730   HG22  ILE  95          2HG2      ILE  95  -7.509  -0.352  -2.000
  731   HG23  ILE  95          3HG2      ILE  95  -7.034  -1.074  -3.539
  732   HD11  ILE  95          3HD1      ILE  95  -8.030   0.690  -5.869
  733   HD12  ILE  95          1HD1      ILE  95  -6.805   0.717  -4.601
  734   HD13  ILE  95          2HD1      ILE  95  -7.534   2.223  -5.154
  735    H    LYS  96           H        LYS  96 -11.358  -2.417  -3.415
  736    HA   LYS  96           HA       LYS  96 -10.014  -4.750  -2.574
  737    HB2  LYS  96           1HB      LYS  96 -13.001  -4.439  -2.951
  738    HB3  LYS  96           2HB      LYS  96 -12.167  -5.585  -1.894
  739    HG2  LYS  96           1HG      LYS  96 -11.436  -3.816  -0.457
  740    HG3  LYS  96           2HG      LYS  96 -12.094  -2.597  -1.554
  741    HD2  LYS  96           1HD      LYS  96 -14.348  -3.559  -1.203
  742    HD3  LYS  96           2HD      LYS  96 -13.657  -4.680  -0.030
  743    HE2  LYS  96           1HE      LYS  96 -12.999  -2.849   1.396
  744    HE3  LYS  96           2HE      LYS  96 -13.536  -1.676   0.192
  745    HZ1  LYS  96           3HZ      LYS  96 -15.795  -2.503   0.464
  746    HZ2  LYS  96           1HZ      LYS  96 -15.178  -1.934   1.928
  747    HZ3  LYS  96           2HZ      LYS  96 -15.277  -3.598   1.641
  748    H    GLN  97           H        GLN  97 -11.657  -3.877  -5.489
  749    HA   GLN  97           HA       GLN  97 -11.634  -6.564  -6.540
  750    HB2  GLN  97           1HB      GLN  97 -13.359  -4.871  -7.170
  751    HB3  GLN  97           2HB      GLN  97 -12.107  -3.951  -7.994
  752    HG2  GLN  97           1HG      GLN  97 -13.446  -5.314  -9.530
  753    HG3  GLN  97           2HG      GLN  97 -11.743  -5.768  -9.543
  754   HE21  GLN  97          1HE2      GLN  97 -11.126  -7.751  -8.746
  755   HE22  GLN  97          2HE2      GLN  97 -12.260  -9.012  -8.395
  756    H    ALA  98           H        ALA  98  -9.557  -3.775  -6.555
  757    HA   ALA  98           HA       ALA  98  -7.969  -4.427  -8.798
  758    HB1  ALA  98           1HB      ALA  98  -7.207  -2.843  -6.355
  759    HB2  ALA  98           2HB      ALA  98  -7.987  -2.197  -7.798
  760    HB3  ALA  98           3HB      ALA  98  -6.356  -2.857  -7.899
  761    H    ILE  99           H        ILE  99  -7.419  -4.875  -5.346
  762    HA   ILE  99           HA       ILE  99  -5.011  -6.208  -5.403
  763    HB   ILE  99           HB       ILE  99  -7.199  -7.063  -3.509
  764   HG12  ILE  99          1HG1      ILE  99  -7.437  -4.741  -3.332
  765   HG13  ILE  99          2HG1      ILE  99  -6.297  -5.140  -2.050
  766   HG21  ILE  99          1HG2      ILE  99  -5.278  -7.206  -1.947
  767   HG22  ILE  99          2HG2      ILE  99  -4.215  -6.781  -3.286
  768   HG23  ILE  99          3HG2      ILE  99  -5.143  -8.278  -3.340
  769   HD11  ILE  99          3HD1      ILE  99  -5.579  -3.161  -3.170
  770   HD12  ILE  99          1HD1      ILE  99  -5.673  -3.968  -4.738
  771   HD13  ILE  99          2HD1      ILE  99  -4.461  -4.470  -3.552
  772    H    ALA 100           H        ALA 100  -8.265  -7.507  -5.870
  773    HA   ALA 100           HA       ALA 100  -7.460 -10.245  -5.981
  774    HB1  ALA 100           1HB      ALA 100  -9.727 -10.684  -6.731
  775    HB2  ALA 100           2HB      ALA 100  -9.987  -8.963  -7.013
  776    HB3  ALA 100           3HB      ALA 100  -9.737  -9.561  -5.372
  777    H    ALA 101           H        ALA 101  -7.647  -7.665  -8.295
  778    HA   ALA 101           HA       ALA 101  -7.581  -9.350 -10.624
  779    HB1  ALA 101           1HB      ALA 101  -8.615  -7.110 -10.639
  780    HB2  ALA 101           2HB      ALA 101  -7.364  -7.285 -11.869
  781    HB3  ALA 101           3HB      ALA 101  -7.021  -6.394 -10.384
  782    H    ASN 102           H        ASN 102  -5.261  -7.863  -8.523
  783    HA   ASN 102           HA       ASN 102  -3.080  -8.306 -10.424
  784    HB2  ASN 102           1HB      ASN 102  -3.053  -6.954  -7.728
  785    HB3  ASN 102           2HB      ASN 102  -1.696  -7.034  -8.839
  786   HD21  ASN 102          1HD2      ASN 102  -4.605  -5.475  -8.019
  787   HD22  ASN 102          2HD2      ASN 102  -4.627  -4.300  -9.279
  788    H    ALA 103           H        ALA 103  -4.560  -9.777  -7.744
  789    HA   ALA 103           HA       ALA 103  -2.326 -11.221  -6.744
  790    HB1  ALA 103           1HB      ALA 103  -4.368 -10.896  -5.432
  791    HB2  ALA 103           2HB      ALA 103  -3.967 -12.606  -5.596
  792    HB3  ALA 103           3HB      ALA 103  -5.259 -11.905  -6.571
  Start of MODEL    9
    1    H1   MET   1           1H       MET   1  -7.365  -6.012  10.704
    2    H2   MET   1           2H       MET   1  -6.101  -7.049  10.293
    3    H3   MET   1           3H       MET   1  -6.789  -6.056   9.113
    4    HA   MET   1           HA       MET   1  -6.037  -4.113  10.341
    5    HB2  MET   1           1HB      MET   1  -4.428  -4.335  12.123
    6    HB3  MET   1           2HB      MET   1  -5.885  -5.215  12.544
    7    HG2  MET   1           1HG      MET   1  -3.386  -6.484  11.450
    8    HG3  MET   1           2HG      MET   1  -3.786  -6.370  13.159
    9    HE1  MET   1           3HE      MET   1  -4.748  -7.797   9.705
   10    HE2  MET   1           1HE      MET   1  -5.192  -9.444  10.163
   11    HE3  MET   1           2HE      MET   1  -3.561  -8.852  10.480
   12    H    VAL   2           H        VAL   2  -3.990  -3.148   9.836
   13    HA   VAL   2           HA       VAL   2  -2.427  -4.744   7.917
   14    HB   VAL   2           HB       VAL   2  -3.308  -1.859   7.782
   15   HG11  VAL   2          1HG1      VAL   2  -2.037  -1.673   5.719
   16   HG12  VAL   2          2HG1      VAL   2  -1.417  -3.309   5.938
   17   HG13  VAL   2          3HG1      VAL   2  -0.969  -2.037   7.073
   18   HG21  VAL   2          3HG2      VAL   2  -4.555  -2.472   5.911
   19   HG22  VAL   2          1HG2      VAL   2  -4.823  -3.781   7.058
   20   HG23  VAL   2          2HG2      VAL   2  -3.697  -3.996   5.719
   21    H    THR   3           H        THR   3  -0.200  -4.526   7.958
   22    HA   THR   3           HA       THR   3   0.790  -3.691  10.568
   23    HB   THR   3           HB       THR   3   2.218  -5.238   8.400
   24    HG1  THR   3           1HG      THR   3   1.399  -7.055   9.316
   25   HG21  THR   3          3HG2      THR   3   2.735  -5.004  11.370
   26   HG22  THR   3          1HG2      THR   3   3.710  -4.282  10.090
   27   HG23  THR   3          2HG2      THR   3   3.623  -6.036  10.249
   28    H    GLN   4           H        GLN   4   2.063  -2.074  10.954
   29    HA   GLN   4           HA       GLN   4   2.734  -0.091   9.039
   30    HB2  GLN   4           1HB      GLN   4   3.411  -0.624  11.905
   31    HB3  GLN   4           2HB      GLN   4   4.186   0.698  11.045
   32    HG2  GLN   4           1HG      GLN   4   1.232   0.339  11.497
   33    HG3  GLN   4           2HG      GLN   4   2.288   1.477  12.333
   34   HE21  GLN   4          1HE2      GLN   4   3.752   1.935   9.774
   35   HE22  GLN   4          2HE2      GLN   4   2.744   2.980   8.865
   36    H    PHE   5           H        PHE   5   4.540   0.202   7.860
   37    HA   PHE   5           HA       PHE   5   6.822  -1.578   8.070
   38    HB2  PHE   5           1HB      PHE   5   6.152   0.797   6.360
   39    HB3  PHE   5           2HB      PHE   5   7.794   0.181   6.427
   40    HD1  PHE   5           2HD      PHE   5   7.056  -2.781   6.576
   41    HD2  PHE   5           1HD      PHE   5   5.682   0.405   4.113
   42    HE1  PHE   5           2HE      PHE   5   6.532  -4.388   4.793
   43    HE2  PHE   5           1HE      PHE   5   5.154  -1.199   2.327
   44    HZ   PHE   5           HZ       PHE   5   5.582  -3.597   2.665
   45    H    LYS   6           H        LYS   6   9.042  -0.516   8.156
   46    HA   LYS   6           HA       LYS   6   9.013   1.689  10.095
   47    HB2  LYS   6           1HB      LYS   6  11.147  -0.434   9.967
   48    HB3  LYS   6           2HB      LYS   6  10.869   0.744  11.241
   49    HG2  LYS   6           1HG      LYS   6   8.810  -0.361  11.858
   50    HG3  LYS   6           2HG      LYS   6   9.009  -1.502  10.530
   51    HD2  LYS   6           1HD      LYS   6   9.702  -2.606  12.522
   52    HD3  LYS   6           2HD      LYS   6  11.155  -2.236  11.598
   53    HE2  LYS   6           1HE      LYS   6  10.181  -0.382  13.743
   54    HE3  LYS   6           2HE      LYS   6  11.134  -1.806  14.150
   55    HZ1  LYS   6           3HZ      LYS   6  12.858  -0.968  12.607
   56    HZ2  LYS   6           1HZ      LYS   6  12.588   0.051  13.926
   57    HZ3  LYS   6           2HZ      LYS   6  11.965   0.454  12.413
   58    H    THR   7           H        THR   7  10.826   0.108   7.500
   59    HA   THR   7           HA       THR   7  11.830   2.748   6.709
   60    HB   THR   7           HB       THR   7  14.071   1.893   6.245
   61    HG1  THR   7           1HG      THR   7  13.196  -0.514   7.528
   62   HG21  THR   7          3HG2      THR   7  13.672   2.898   8.441
   63   HG22  THR   7          1HG2      THR   7  14.886   1.622   8.532
   64   HG23  THR   7          2HG2      THR   7  13.242   1.316   9.089
   65    H    ALA   8           H        ALA   8  13.096   2.409   4.481
   66    HA   ALA   8           HA       ALA   8  11.218   1.409   2.624
   67    HB1  ALA   8           1HB      ALA   8  14.102   2.180   2.249
   68    HB2  ALA   8           2HB      ALA   8  12.681   3.186   1.964
   69    HB3  ALA   8           3HB      ALA   8  12.991   1.790   0.939
   70    H    SER   9           H        SER   9  13.975   0.011   4.221
   71    HA   SER   9           HA       SER   9  14.387  -2.239   2.616
   72    HB2  SER   9           1HB      SER   9  15.859  -1.519   4.517
   73    HB3  SER   9           2HB      SER   9  14.630  -2.106   5.635
   74    HG   SER   9           HG       SER   9  15.294  -3.969   3.756
   75    H    GLU  10           H        GLU  10  12.269  -1.798   5.456
   76    HA   GLU  10           HA       GLU  10  10.927  -4.183   5.454
   77    HB2  GLU  10           1HB      GLU  10  10.152  -1.378   6.134
   78    HB3  GLU  10           2HB      GLU  10   8.948  -2.654   6.199
   79    HG2  GLU  10           1HG      GLU  10   9.929  -2.260   8.363
   80    HG3  GLU  10           2HG      GLU  10  10.303  -3.875   7.784
   81    H    PHE  11           H        PHE  11  10.276  -1.300   3.451
   82    HA   PHE  11           HA       PHE  11   7.929  -2.270   2.255
   83    HB2  PHE  11           1HB      PHE  11   8.810   0.108   2.157
   84    HB3  PHE  11           2HB      PHE  11   9.935  -0.439   0.920
   85    HD1  PHE  11           1HD      PHE  11   8.887  -1.541  -1.174
   86    HD2  PHE  11           2HD      PHE  11   6.702   0.899   1.547
   87    HE1  PHE  11           1HE      PHE  11   7.207  -1.104  -2.912
   88    HE2  PHE  11           2HE      PHE  11   5.008   1.352  -0.215
   89    HZ   PHE  11           HZ       PHE  11   5.274   0.333  -2.431
   90    H    ASP  12           H        ASP  12  11.210  -2.208   0.895
   91    HA   ASP  12           HA       ASP  12  10.737  -3.704  -1.404
   92    HB2  ASP  12           1HB      ASP  12  13.228  -3.460   0.284
   93    HB3  ASP  12           2HB      ASP  12  13.199  -4.356  -1.227
   94    H    SER  13           H        SER  13  11.502  -4.855   1.857
   95    HA   SER  13           HA       SER  13  11.972  -7.543   1.147
   96    HB2  SER  13           1HB      SER  13  11.023  -6.407   3.790
   97    HB3  SER  13           2HB      SER  13  11.684  -8.025   3.547
   98    HG   SER  13           HG       SER  13  13.018  -5.546   3.142
   99    H    ALA  14           H        ALA  14   9.022  -5.905   2.291
  100    HA   ALA  14           HA       ALA  14   7.385  -8.191   2.230
  101    HB1  ALA  14           1HB      ALA  14   6.777  -6.137   3.430
  102    HB2  ALA  14           2HB      ALA  14   5.509  -6.645   2.314
  103    HB3  ALA  14           3HB      ALA  14   6.578  -5.307   1.888
  104    H    ILE  15           H        ILE  15   8.364  -5.870  -0.165
  105    HA   ILE  15           HA       ILE  15   6.504  -6.438  -2.190
  106    HB   ILE  15           HB       ILE  15   9.345  -5.503  -2.477
  107   HG12  ILE  15          1HG1      ILE  15   8.311  -3.874  -1.163
  108   HG13  ILE  15          2HG1      ILE  15   8.153  -3.279  -2.811
  109   HG21  ILE  15          1HG2      ILE  15   7.172  -4.891  -4.408
  110   HG22  ILE  15          2HG2      ILE  15   8.041  -6.417  -4.511
  111   HG23  ILE  15          3HG2      ILE  15   8.920  -4.891  -4.641
  112   HD11  ILE  15          3HD1      ILE  15   6.115  -2.960  -1.497
  113   HD12  ILE  15          1HD1      ILE  15   5.997  -4.705  -1.274
  114   HD13  ILE  15          2HD1      ILE  15   5.856  -4.009  -2.889
  115    H    ALA  16           H        ALA  16   9.536  -7.939  -1.305
  116    HA   ALA  16           HA       ALA  16   9.938  -9.314  -3.764
  117    HB1  ALA  16           1HB      ALA  16  11.188  -9.803  -1.071
  118    HB2  ALA  16           2HB      ALA  16  11.774  -8.682  -2.297
  119    HB3  ALA  16           3HB      ALA  16  11.777 -10.415  -2.617
  120    H    GLN  17           H        GLN  17   7.552  -9.843  -1.721
  121    HA   GLN  17           HA       GLN  17   7.710 -12.699  -1.462
  122    HB2  GLN  17           1HB      GLN  17   5.654 -10.613  -0.779
  123    HB3  GLN  17           2HB      GLN  17   5.376 -12.323  -0.548
  124    HG2  GLN  17           1HG      GLN  17   7.252 -12.463   0.973
  125    HG3  GLN  17           2HG      GLN  17   7.616 -10.763   0.698
  126   HE21  GLN  17          1HE2      GLN  17   4.867  -9.893   0.719
  127   HE22  GLN  17          2HE2      GLN  17   4.317 -10.005   2.351
  128    H    ASP  18           H        ASP  18   6.494 -14.186  -2.603
  129    HA   ASP  18           HA       ASP  18   5.813 -13.387  -5.286
  130    HB2  ASP  18           1HB      ASP  18   5.938 -16.042  -3.880
  131    HB3  ASP  18           2HB      ASP  18   5.291 -15.894  -5.508
  132    H    LYS  19           H        LYS  19   4.086 -12.407  -3.168
  133    HA   LYS  19           HA       LYS  19   1.582 -13.289  -4.383
  134    HB2  LYS  19           1HB      LYS  19   0.413 -13.153  -2.194
  135    HB3  LYS  19           2HB      LYS  19   1.563 -14.473  -2.280
  136    HG2  LYS  19           1HG      LYS  19   2.370 -11.864  -1.077
  137    HG3  LYS  19           2HG      LYS  19   1.408 -13.010  -0.147
  138    HD2  LYS  19           1HD      LYS  19   4.078 -13.590  -1.430
  139    HD3  LYS  19           2HD      LYS  19   3.810 -13.267   0.284
  140    HE2  LYS  19           1HE      LYS  19   2.296 -15.249   0.339
  141    HE3  LYS  19           2HE      LYS  19   2.778 -15.602  -1.318
  142    HZ1  LYS  19           3HZ      LYS  19   4.054 -16.881   0.276
  143    HZ2  LYS  19           1HZ      LYS  19   4.604 -15.466   1.014
  144    HZ3  LYS  19           2HZ      LYS  19   5.057 -15.824  -0.576
  145    H    LEU  20           H        LEU  20  -0.204 -11.631  -3.414
  146    HA   LEU  20           HA       LEU  20   0.658  -9.137  -4.517
  147    HB2  LEU  20           1HB      LEU  20  -1.643 -10.249  -4.725
  148    HB3  LEU  20           2HB      LEU  20  -1.956  -9.648  -3.112
  149    HG   LEU  20           HG       LEU  20  -2.906  -8.259  -4.971
  150   HD11  LEU  20          1HD1      LEU  20  -2.520  -7.323  -2.744
  151   HD12  LEU  20          2HD1      LEU  20  -2.290  -6.123  -4.016
  152   HD13  LEU  20          3HD1      LEU  20  -0.891  -6.855  -3.230
  153   HD21  LEU  20          3HD2      LEU  20  -0.018  -7.567  -5.466
  154   HD22  LEU  20          1HD2      LEU  20  -1.419  -6.827  -6.237
  155   HD23  LEU  20          2HD2      LEU  20  -1.043  -8.525  -6.535
  156    H    VAL  21           H        VAL  21   1.602  -7.557  -3.468
  157    HA   VAL  21           HA       VAL  21   1.362  -7.412  -0.546
  158    HB   VAL  21           HB       VAL  21   3.155  -5.577  -2.052
  159   HG11  VAL  21          1HG1      VAL  21   3.435  -7.105   0.528
  160   HG12  VAL  21          2HG1      VAL  21   3.007  -5.403   0.351
  161   HG13  VAL  21          3HG1      VAL  21   4.613  -5.962  -0.116
  162   HG21  VAL  21          3HG2      VAL  21   4.937  -7.425  -1.931
  163   HG22  VAL  21          1HG2      VAL  21   3.769  -7.471  -3.255
  164   HG23  VAL  21          2HG2      VAL  21   3.573  -8.538  -1.860
  165    H    VAL  22           H        VAL  22  -0.313  -6.146   0.101
  166    HA   VAL  22           HA       VAL  22  -1.037  -3.825  -1.467
  167    HB   VAL  22           HB       VAL  22  -2.733  -3.751   0.575
  168   HG11  VAL  22          1HG1      VAL  22  -4.329  -4.909  -0.796
  169   HG12  VAL  22          2HG1      VAL  22  -3.030  -5.727  -1.659
  170   HG13  VAL  22          3HG1      VAL  22  -3.250  -3.984  -1.842
  171   HG21  VAL  22          3HG2      VAL  22  -3.388  -5.938   1.332
  172   HG22  VAL  22          1HG2      VAL  22  -1.694  -5.658   1.723
  173   HG23  VAL  22          2HG2      VAL  22  -2.121  -6.677   0.353
  174    H    VAL  23           H        VAL  23   0.337  -2.172  -1.077
  175    HA   VAL  23           HA       VAL  23   1.052  -1.670   1.720
  176    HB   VAL  23           HB       VAL  23   2.348  -0.512  -0.747
  177   HG11  VAL  23          1HG1      VAL  23   2.550   1.022   1.075
  178   HG12  VAL  23          2HG1      VAL  23   4.091   0.180   0.919
  179   HG13  VAL  23          3HG1      VAL  23   2.964  -0.276   2.193
  180   HG21  VAL  23          3HG2      VAL  23   3.220  -2.694   1.139
  181   HG22  VAL  23          1HG2      VAL  23   4.250  -1.962  -0.092
  182   HG23  VAL  23          2HG2      VAL  23   2.816  -2.874  -0.569
  183    H    ALA  24           H        ALA  24   0.192  -0.160   2.763
  184    HA   ALA  24           HA       ALA  24  -1.539   1.811   1.436
  185    HB1  ALA  24           1HB      ALA  24  -2.306   0.385   3.373
  186    HB2  ALA  24           2HB      ALA  24  -2.490   2.123   3.620
  187    HB3  ALA  24           3HB      ALA  24  -1.165   1.258   4.392
  188    H    PHE  25           H        PHE  25  -0.063   3.392   0.719
  189    HA   PHE  25           HA       PHE  25   1.703   4.567   2.735
  190    HB2  PHE  25           1HB      PHE  25   1.985   4.085  -0.020
  191    HB3  PHE  25           2HB      PHE  25   1.887   5.835   0.159
  192    HD1  PHE  25           2HD      PHE  25   3.529   7.047   1.462
  193    HD2  PHE  25           1HD      PHE  25   3.815   2.848   0.868
  194    HE1  PHE  25           2HE      PHE  25   5.868   7.101   2.213
  195    HE2  PHE  25           1HE      PHE  25   6.152   2.896   1.620
  196    HZ   PHE  25           HZ       PHE  25   7.179   5.028   2.290
  197    H    TYR  26           H        TYR  26   1.313   6.468   3.648
  198    HA   TYR  26           HA       TYR  26  -0.365   8.458   2.405
  199    HB2  TYR  26           1HB      TYR  26  -1.946   8.555   4.351
  200    HB3  TYR  26           2HB      TYR  26  -2.121   7.117   3.355
  201    HD1  TYR  26           2HD      TYR  26  -0.975   8.400   6.606
  202    HD2  TYR  26           1HD      TYR  26  -1.623   4.939   4.226
  203    HE1  TYR  26           2HE      TYR  26  -0.714   6.988   8.598
  204    HE2  TYR  26           1HE      TYR  26  -1.379   3.510   6.201
  205    HH   TYR  26           HH       TYR  26  -0.180   3.737   8.510
  206    H    ALA  27           H        ALA  27  -0.835  10.127   4.499
  207    HA   ALA  27           HA       ALA  27   1.675  10.404   5.976
  208    HB1  ALA  27           1HB      ALA  27   1.997  11.696   3.928
  209    HB2  ALA  27           2HB      ALA  27   1.892  12.755   5.334
  210    HB3  ALA  27           3HB      ALA  27   0.511  12.587   4.249
  211    H    THR  28           H        THR  28   1.425  11.361   7.960
  212    HA   THR  28           HA       THR  28  -1.209  11.371   9.018
  213    HB   THR  28           HB       THR  28   0.132  12.448  11.034
  214    HG1  THR  28           1HG      THR  28   2.049  12.838   9.879
  215   HG21  THR  28          3HG2      THR  28   0.516   9.601  10.099
  216   HG22  THR  28          1HG2      THR  28  -0.861  10.209  11.019
  217   HG23  THR  28          2HG2      THR  28   0.744  10.185  11.748
  218    H    TRP  29           H        TRP  29   0.653  13.821   7.506
  219    HA   TRP  29           HA       TRP  29  -0.874  15.974   8.708
  220    HB2  TRP  29           1HB      TRP  29   0.381  17.454   7.184
  221    HB3  TRP  29           2HB      TRP  29   1.445  16.437   8.143
  222    HD1  TRP  29           HD       TRP  29   3.147  14.963   6.863
  223    HE1  TRP  29           1HE      TRP  29   3.687  14.559   4.379
  224    HE3  TRP  29           3HE      TRP  29  -0.881  17.313   4.757
  225    HZ2  TRP  29           2HZ      TRP  29   2.555  15.152   1.867
  226    HZ3  TRP  29           3HZ      TRP  29  -1.078  17.343   2.310
  227    HH2  TRP  29           HH       TRP  29   0.607  16.289   0.892
  228    H    CYS  30           H        CYS  30  -1.323  13.747   6.266
  229    HA   CYS  30           HA       CYS  30  -2.764  15.471   4.447
  230    HB2  CYS  30           1HB      CYS  30  -1.430  13.614   3.573
  231    HB3  CYS  30           2HB      CYS  30  -2.388  12.466   4.497
  232    HG   CYS  30           HG       CYS  30  -3.720  14.429   2.032
  233    H    GLY  31           H        GLY  31  -4.999  15.324   4.028
  234    HA2  GLY  31           1HA      GLY  31  -6.597  14.783   6.354
  235    HA3  GLY  31           2HA      GLY  31  -7.172  15.381   4.807
  236    HA   PRO  32           HA       PRO  32  -8.866  11.510   3.719
  237    HB2  PRO  32           1HB      PRO  32  -7.973  10.956   1.207
  238    HB3  PRO  32           2HB      PRO  32  -9.164  12.209   1.569
  239    HG2  PRO  32           1HG      PRO  32  -6.227  12.474   1.078
  240    HG3  PRO  32           2HG      PRO  32  -7.556  13.492   0.495
  241    HD2  PRO  32           1HD      PRO  32  -5.991  14.192   2.585
  242    HD3  PRO  32           2HD      PRO  32  -7.702  14.650   2.477
  243    H    CYS  33           H        CYS  33  -5.762  11.474   4.617
  244    HA   CYS  33           HA       CYS  33  -4.758   9.008   3.658
  245    HB2  CYS  33           1HB      CYS  33  -3.270   9.089   5.633
  246    HB3  CYS  33           2HB      CYS  33  -3.316  10.632   4.787
  247    HG   CYS  33           HG       CYS  33  -4.053  12.061   6.798
  248    H    LYS  34           H        LYS  34  -6.935   9.913   6.180
  249    HA   LYS  34           HA       LYS  34  -6.964   7.467   7.595
  250    HB2  LYS  34           1HB      LYS  34  -9.056   9.642   7.469
  251    HB3  LYS  34           2HB      LYS  34  -8.951   8.379   8.691
  252    HG2  LYS  34           1HG      LYS  34  -6.930   9.267   9.563
  253    HG3  LYS  34           2HG      LYS  34  -6.756  10.376   8.204
  254    HD2  LYS  34           1HD      LYS  34  -8.997  10.467  10.221
  255    HD3  LYS  34           2HD      LYS  34  -7.548  11.470  10.286
  256    HE2  LYS  34           1HE      LYS  34  -8.123  12.409   8.085
  257    HE3  LYS  34           2HE      LYS  34  -9.590  11.436   8.065
  258    HZ1  LYS  34           3HZ      LYS  34 -10.072  13.671   8.771
  259    HZ2  LYS  34           1HZ      LYS  34  -8.937  13.568  10.020
  260    HZ3  LYS  34           2HZ      LYS  34 -10.326  12.608  10.063
  261    H    MET  35           H        MET  35  -8.137   8.254   4.528
  262    HA   MET  35           HA       MET  35 -10.431   6.483   4.561
  263    HB2  MET  35           1HB      MET  35  -9.643   8.498   2.896
  264    HB3  MET  35           2HB      MET  35  -9.104   7.093   1.985
  265    HG2  MET  35           1HG      MET  35 -11.908   7.737   2.877
  266    HG3  MET  35           2HG      MET  35 -11.284   7.707   1.232
  267    HE1  MET  35           3HE      MET  35 -13.494   4.656   0.747
  268    HE2  MET  35           1HE      MET  35 -12.775   6.091   0.018
  269    HE3  MET  35           2HE      MET  35 -13.863   6.255   1.397
  270    H    ILE  36           H        ILE  36  -7.034   6.407   3.853
  271    HA   ILE  36           HA       ILE  36  -7.045   3.832   2.618
  272    HB   ILE  36           HB       ILE  36  -5.075   5.904   3.184
  273   HG12  ILE  36          1HG1      ILE  36  -4.272   5.268   1.003
  274   HG13  ILE  36          2HG1      ILE  36  -5.176   3.762   1.067
  275   HG21  ILE  36          1HG2      ILE  36  -3.987   4.273   4.546
  276   HG22  ILE  36          2HG2      ILE  36  -3.126   4.365   3.009
  277   HG23  ILE  36          3HG2      ILE  36  -4.228   3.025   3.324
  278   HD11  ILE  36          3HD1      ILE  36  -6.268   5.409  -0.350
  279   HD12  ILE  36          1HD1      ILE  36  -6.388   6.509   1.027
  280   HD13  ILE  36          2HD1      ILE  36  -7.260   4.976   1.047
  281    H    ALA  37           H        ALA  37  -6.766   5.055   5.843
  282    HA   ALA  37           HA       ALA  37  -5.659   2.847   7.096
  283    HB1  ALA  37           1HB      ALA  37  -7.887   4.470   8.307
  284    HB2  ALA  37           2HB      ALA  37  -6.228   5.037   8.180
  285    HB3  ALA  37           3HB      ALA  37  -6.598   3.601   9.134
  286    HA   PRO  38           HA       PRO  38  -9.712   0.623   7.746
  287    HB2  PRO  38           1HB      PRO  38 -12.061   1.897   6.756
  288    HB3  PRO  38           2HB      PRO  38 -11.540   1.755   8.435
  289    HG2  PRO  38           1HG      PRO  38 -11.696   4.126   7.013
  290    HG3  PRO  38           2HG      PRO  38 -10.721   3.876   8.473
  291    HD2  PRO  38           1HD      PRO  38  -9.888   3.805   5.598
  292    HD3  PRO  38           2HD      PRO  38  -9.045   4.499   6.994
  293    H    MET  39           H        MET  39  -9.895   2.262   4.563
  294    HA   MET  39           HA       MET  39 -11.521   0.269   3.344
  295    HB2  MET  39           1HB      MET  39 -11.408   2.401   2.274
  296    HB3  MET  39           2HB      MET  39  -9.658   2.394   2.310
  297    HG2  MET  39           1HG      MET  39 -10.114   0.201   0.824
  298    HG3  MET  39           2HG      MET  39 -11.509   1.188   0.398
  299    HE1  MET  39           3HE      MET  39  -7.242   2.894   0.062
  300    HE2  MET  39           1HE      MET  39  -7.624   1.435   0.987
  301    HE3  MET  39           2HE      MET  39  -8.235   3.004   1.512
  302    H    ILE  40           H        ILE  40  -8.080   0.763   3.652
  303    HA   ILE  40           HA       ILE  40  -7.308  -1.405   1.977
  304    HB   ILE  40           HB       ILE  40  -6.095   0.726   3.441
  305   HG12  ILE  40          1HG1      ILE  40  -4.656  -1.014   1.484
  306   HG13  ILE  40          2HG1      ILE  40  -6.017  -0.026   0.958
  307   HG21  ILE  40          1HG2      ILE  40  -4.662  -1.913   3.716
  308   HG22  ILE  40          2HG2      ILE  40  -5.332  -0.945   5.029
  309   HG23  ILE  40          3HG2      ILE  40  -3.980  -0.329   4.084
  310   HD11  ILE  40          3HD1      ILE  40  -3.727   1.144   2.481
  311   HD12  ILE  40          1HD1      ILE  40  -4.924   1.958   1.481
  312   HD13  ILE  40          2HD1      ILE  40  -3.682   0.956   0.729
  313    H    GLU  41           H        GLU  41  -7.709  -0.971   5.482
  314    HA   GLU  41           HA       GLU  41  -6.914  -3.601   6.158
  315    HB2  GLU  41           1HB      GLU  41  -8.771  -1.661   7.555
  316    HB3  GLU  41           2HB      GLU  41  -8.300  -3.213   8.244
  317    HG2  GLU  41           1HG      GLU  41  -5.912  -2.472   8.011
  318    HG3  GLU  41           2HG      GLU  41  -6.527  -0.876   7.591
  319    H    LYS  42           H        LYS  42  -9.905  -2.285   4.922
  320    HA   LYS  42           HA       LYS  42 -11.556  -4.521   5.417
  321    HB2  LYS  42           1HB      LYS  42 -11.714  -2.299   3.386
  322    HB3  LYS  42           2HB      LYS  42 -12.929  -3.567   3.492
  323    HG2  LYS  42           1HG      LYS  42 -12.202  -1.597   5.651
  324    HG3  LYS  42           2HG      LYS  42 -13.658  -1.577   4.656
  325    HD2  LYS  42           1HD      LYS  42 -12.881  -3.724   6.630
  326    HD3  LYS  42           2HD      LYS  42 -14.114  -2.487   6.873
  327    HE2  LYS  42           1HE      LYS  42 -14.161  -4.615   4.737
  328    HE3  LYS  42           2HE      LYS  42 -15.077  -4.655   6.241
  329    HZ1  LYS  42           3HZ      LYS  42 -16.444  -3.891   4.426
  330    HZ2  LYS  42           1HZ      LYS  42 -15.364  -2.638   4.082
  331    HZ3  LYS  42           2HZ      LYS  42 -16.224  -2.639   5.538
  332    H    PHE  43           H        PHE  43  -9.465  -3.670   2.698
  333    HA   PHE  43           HA       PHE  43 -10.229  -5.583   0.845
  334    HB2  PHE  43           1HB      PHE  43  -7.402  -4.633   1.402
  335    HB3  PHE  43           2HB      PHE  43  -7.927  -5.472  -0.066
  336    HD1  PHE  43           2HD      PHE  43 -10.652  -3.911  -0.093
  337    HD2  PHE  43           1HD      PHE  43  -6.569  -2.761   0.174
  338    HE1  PHE  43           2HE      PHE  43 -11.198  -1.751  -1.128
  339    HE2  PHE  43           1HE      PHE  43  -7.108  -0.599  -0.855
  340    HZ   PHE  43           HZ       PHE  43  -9.423  -0.092  -1.505
  341    H    SER  44           H        SER  44  -7.517  -5.962   3.179
  342    HA   SER  44           HA       SER  44  -7.284  -8.725   2.438
  343    HB2  SER  44           1HB      SER  44  -5.482  -8.777   4.127
  344    HB3  SER  44           2HB      SER  44  -5.269  -7.517   2.917
  345    HG   SER  44           HG       SER  44  -5.308  -6.096   4.454
  346    H    GLU  45           H        GLU  45  -9.107  -7.002   4.771
  347    HA   GLU  45           HA       GLU  45  -9.538  -9.023   6.659
  348    HB2  GLU  45           1HB      GLU  45 -10.452  -6.794   6.984
  349    HB3  GLU  45           2HB      GLU  45 -11.472  -6.970   5.563
  350    HG2  GLU  45           1HG      GLU  45 -12.757  -8.696   6.646
  351    HG3  GLU  45           2HG      GLU  45 -11.683  -8.661   8.042
  352    H    GLN  46           H        GLN  46 -10.906  -8.466   3.458
  353    HA   GLN  46           HA       GLN  46 -12.584 -10.801   3.601
  354    HB2  GLN  46           1HB      GLN  46 -11.908  -8.952   1.308
  355    HB3  GLN  46           2HB      GLN  46 -13.064 -10.273   1.211
  356    HG2  GLN  46           1HG      GLN  46 -13.275  -7.912   3.066
  357    HG3  GLN  46           2HG      GLN  46 -14.143  -8.099   1.543
  358   HE21  GLN  46          1HE2      GLN  46 -13.827  -9.234   4.818
  359   HE22  GLN  46          2HE2      GLN  46 -15.337 -10.069   4.890
  360    H    TYR  47           H        TYR  47  -9.580  -9.828   2.011
  361    HA   TYR  47           HA       TYR  47  -9.011 -12.674   1.602
  362    HB2  TYR  47           1HB      TYR  47  -7.748 -11.878  -0.498
  363    HB3  TYR  47           2HB      TYR  47  -9.495 -12.026  -0.554
  364    HD1  TYR  47           1HD      TYR  47  -6.761  -9.535  -0.146
  365    HD2  TYR  47           2HD      TYR  47 -10.835 -10.241  -1.153
  366    HE1  TYR  47           1HE      TYR  47  -6.957  -7.223  -0.969
  367    HE2  TYR  47           2HE      TYR  47 -11.044  -7.928  -1.952
  368    HH   TYR  47           HH       TYR  47  -9.938  -5.768  -1.599
  369    HA   PRO  48           HA       PRO  48  -5.509 -10.952   3.955
  370    HB2  PRO  48           1HB      PRO  48  -5.050 -13.126   5.446
  371    HB3  PRO  48           2HB      PRO  48  -6.335 -11.984   5.835
  372    HG2  PRO  48           1HG      PRO  48  -6.522 -14.623   4.431
  373    HG3  PRO  48           2HG      PRO  48  -7.570 -13.954   5.695
  374    HD2  PRO  48           1HD      PRO  48  -8.205 -13.890   3.048
  375    HD3  PRO  48           2HD      PRO  48  -8.754 -12.663   4.205
  376    H    GLN  49           H        GLN  49  -5.880 -13.229   1.573
  377    HA   GLN  49           HA       GLN  49  -3.394 -14.505   1.530
  378    HB2  GLN  49           1HB      GLN  49  -3.860 -14.881  -0.891
  379    HB3  GLN  49           2HB      GLN  49  -5.136 -15.403   0.195
  380    HG2  GLN  49           1HG      GLN  49  -6.366 -14.325  -1.340
  381    HG3  GLN  49           2HG      GLN  49  -5.990 -13.007  -0.235
  382   HE21  GLN  49          1HE2      GLN  49  -6.323 -11.487  -1.890
  383   HE22  GLN  49          2HE2      GLN  49  -5.147 -11.240  -3.131
  384    H    ALA  50           H        ALA  50  -4.195 -11.296   1.010
  385    HA   ALA  50           HA       ALA  50  -1.694 -10.743  -0.425
  386    HB1  ALA  50           1HB      ALA  50  -2.548  -8.442  -0.612
  387    HB2  ALA  50           2HB      ALA  50  -3.974  -8.901   0.317
  388    HB3  ALA  50           3HB      ALA  50  -3.696  -9.608  -1.274
  389    H    ASP  51           H        ASP  51  -0.109  -9.370   0.540
  390    HA   ASP  51           HA       ASP  51  -0.227  -9.559   3.436
  391    HB2  ASP  51           1HB      ASP  51   2.013  -9.183   1.501
  392    HB3  ASP  51           2HB      ASP  51   2.213  -8.611   3.148
  393    H    PHE  52           H        PHE  52  -0.686  -8.001   4.693
  394    HA   PHE  52           HA       PHE  52  -1.306  -5.423   3.520
  395    HB2  PHE  52           1HB      PHE  52  -2.340  -5.186   5.931
  396    HB3  PHE  52           2HB      PHE  52  -3.158  -6.117   4.685
  397    HD1  PHE  52           1HD      PHE  52  -1.016  -6.370   7.692
  398    HD2  PHE  52           2HD      PHE  52  -3.543  -8.427   4.955
  399    HE1  PHE  52           1HE      PHE  52  -1.027  -8.328   9.181
  400    HE2  PHE  52           2HE      PHE  52  -3.559 -10.389   6.438
  401    HZ   PHE  52           HZ       PHE  52  -2.300 -10.339   8.555
  402    H    TYR  53           H        TYR  53   0.127  -3.843   3.618
  403    HA   TYR  53           HA       TYR  53   1.378  -3.330   6.205
  404    HB2  TYR  53           1HB      TYR  53   2.922  -3.410   3.599
  405    HB3  TYR  53           2HB      TYR  53   3.548  -2.807   5.128
  406    HD1  TYR  53           1HD      TYR  53   3.733  -4.441   7.072
  407    HD2  TYR  53           2HD      TYR  53   3.039  -5.686   3.064
  408    HE1  TYR  53           1HE      TYR  53   4.500  -6.704   7.647
  409    HE2  TYR  53           2HE      TYR  53   3.809  -7.951   3.627
  410    HH   TYR  53           HH       TYR  53   4.212  -9.014   6.815
  411    H    LYS  54           H        LYS  54   2.193  -1.168   6.446
  412    HA   LYS  54           HA       LYS  54   1.036   0.821   4.659
  413    HB2  LYS  54           1HB      LYS  54  -0.342   1.783   6.448
  414    HB3  LYS  54           2HB      LYS  54  -0.813   0.123   6.089
  415    HG2  LYS  54           1HG      LYS  54   0.628  -0.557   8.050
  416    HG3  LYS  54           2HG      LYS  54   0.687   1.155   8.468
  417    HD2  LYS  54           1HD      LYS  54  -1.790  -0.552   8.228
  418    HD3  LYS  54           2HD      LYS  54  -1.067   0.037   9.723
  419    HE2  LYS  54           1HE      LYS  54  -1.503   2.346   8.989
  420    HE3  LYS  54           2HE      LYS  54  -2.277   1.721   7.534
  421    HZ1  LYS  54           3HZ      LYS  54  -3.889   2.299   9.251
  422    HZ2  LYS  54           1HZ      LYS  54  -3.181   1.194  10.314
  423    HZ3  LYS  54           2HZ      LYS  54  -3.937   0.648   8.908
  424    H    LEU  55           H        LEU  55   1.839   2.973   5.050
  425    HA   LEU  55           HA       LEU  55   3.582   3.454   7.287
  426    HB2  LEU  55           1HB      LEU  55   5.050   2.195   5.784
  427    HB3  LEU  55           2HB      LEU  55   4.700   3.317   4.486
  428    HG   LEU  55           HG       LEU  55   5.935   4.384   6.999
  429   HD11  LEU  55          1HD1      LEU  55   7.378   2.877   4.820
  430   HD12  LEU  55          2HD1      LEU  55   7.336   2.483   6.539
  431   HD13  LEU  55          3HD1      LEU  55   8.164   3.937   5.987
  432   HD21  LEU  55          3HD2      LEU  55   5.125   5.477   4.654
  433   HD22  LEU  55          1HD2      LEU  55   6.836   5.190   4.337
  434   HD23  LEU  55          2HD2      LEU  55   6.346   6.172   5.723
  435    H    ASP  56           H        ASP  56   4.004   5.642   7.605
  436    HA   ASP  56           HA       ASP  56   2.534   7.482   5.880
  437    HB2  ASP  56           1HB      ASP  56   2.956   9.071   7.832
  438    HB3  ASP  56           2HB      ASP  56   1.835   7.748   8.116
  439    H    VAL  57           H        VAL  57   3.586   8.680   4.471
  440    HA   VAL  57           HA       VAL  57   6.398   8.705   4.229
  441    HB   VAL  57           HB       VAL  57   5.037   8.886   2.273
  442   HG11  VAL  57          1HG1      VAL  57   3.556  10.728   1.885
  443   HG12  VAL  57          2HG1      VAL  57   4.035  11.463   3.414
  444   HG13  VAL  57          3HG1      VAL  57   3.157   9.938   3.407
  445   HG21  VAL  57          3HG2      VAL  57   6.524  11.457   2.808
  446   HG22  VAL  57          1HG2      VAL  57   5.911  10.971   1.226
  447   HG23  VAL  57          2HG2      VAL  57   7.148  10.004   2.027
  448    H    ASP  58           H        ASP  58   4.224  10.544   6.053
  449    HA   ASP  58           HA       ASP  58   5.384  13.035   6.325
  450    HB2  ASP  58           1HB      ASP  58   3.255  12.157   7.409
  451    HB3  ASP  58           2HB      ASP  58   4.282  11.404   8.621
  452    H    GLU  59           H        GLU  59   6.074  10.059   8.125
  453    HA   GLU  59           HA       GLU  59   8.503  11.231   9.207
  454    HB2  GLU  59           1HB      GLU  59   7.105   8.606   9.651
  455    HB3  GLU  59           2HB      GLU  59   8.693   8.951  10.324
  456    HG2  GLU  59           1HG      GLU  59   6.254  10.636  10.824
  457    HG3  GLU  59           2HG      GLU  59   6.792   9.335  11.883
  458    H    LEU  60           H        LEU  60   7.597   8.583   6.970
  459    HA   LEU  60           HA       LEU  60  10.475   8.244   6.442
  460    HB2  LEU  60           1HB      LEU  60   8.170   6.393   5.885
  461    HB3  LEU  60           2HB      LEU  60   9.807   6.100   5.351
  462    HG   LEU  60           HG       LEU  60   9.569   4.774   7.261
  463   HD11  LEU  60          1HD1      LEU  60  11.076   5.714   8.907
  464   HD12  LEU  60          2HD1      LEU  60  10.834   7.325   8.235
  465   HD13  LEU  60          3HD1      LEU  60  11.632   6.081   7.274
  466   HD21  LEU  60          3HD2      LEU  60   8.316   7.126   8.669
  467   HD22  LEU  60          1HD2      LEU  60   8.643   5.549   9.385
  468   HD23  LEU  60          2HD2      LEU  60   7.471   5.698   8.076
  469    H    GLY  61           H        GLY  61  10.394  10.222   5.183
  470    HA2  GLY  61           1HA      GLY  61   8.849  10.435   2.809
  471    HA3  GLY  61           2HA      GLY  61  10.222  11.434   3.244
  472    H    ASP  62           H        ASP  62  12.223   9.482   3.389
  473    HA   ASP  62           HA       ASP  62  12.883   9.288   0.637
  474    HB2  ASP  62           1HB      ASP  62  14.933   8.255   1.321
  475    HB3  ASP  62           2HB      ASP  62  14.563   9.517   2.488
  476    H    VAL  63           H        VAL  63  11.234   7.215   2.784
  477    HA   VAL  63           HA       VAL  63  11.577   4.796   1.335
  478    HB   VAL  63           HB       VAL  63   9.345   5.648   3.172
  479   HG11  VAL  63          1HG1      VAL  63   8.814   3.244   3.324
  480   HG12  VAL  63          2HG1      VAL  63  10.021   2.916   2.083
  481   HG13  VAL  63          3HG1      VAL  63   8.596   3.872   1.692
  482   HG21  VAL  63          3HG2      VAL  63  11.572   5.521   4.233
  483   HG22  VAL  63          1HG2      VAL  63  11.712   3.848   3.686
  484   HG23  VAL  63          2HG2      VAL  63  10.464   4.293   4.848
  485    H    ALA  64           H        ALA  64   8.954   7.207   1.459
  486    HA   ALA  64           HA       ALA  64   7.280   6.185  -0.466
  487    HB1  ALA  64           1HB      ALA  64   7.918   9.097  -0.040
  488    HB2  ALA  64           2HB      ALA  64   6.783   8.153   0.920
  489    HB3  ALA  64           3HB      ALA  64   6.462   8.439  -0.789
  490    H    GLN  65           H        GLN  65  10.187   8.101  -0.877
  491    HA   GLN  65           HA       GLN  65   9.852   8.585  -3.669
  492    HB2  GLN  65           1HB      GLN  65  11.787   9.793  -3.487
  493    HB3  GLN  65           2HB      GLN  65  11.422   9.625  -1.779
  494    HG2  GLN  65           1HG      GLN  65  13.011   7.959  -1.455
  495    HG3  GLN  65           2HG      GLN  65  13.198   7.688  -3.188
  496   HE21  GLN  65          1HE2      GLN  65  14.024   9.724  -0.503
  497   HE22  GLN  65          2HE2      GLN  65  15.260  10.623  -1.303
  498    H    LYS  66           H        LYS  66  11.472   6.181  -1.771
  499    HA   LYS  66           HA       LYS  66  12.777   4.746  -3.758
  500    HB2  LYS  66           1HB      LYS  66  13.462   3.838  -1.816
  501    HB3  LYS  66           2HB      LYS  66  12.043   4.439  -0.969
  502    HG2  LYS  66           1HG      LYS  66  11.971   2.154  -0.661
  503    HG3  LYS  66           2HG      LYS  66  10.813   2.467  -1.947
  504    HD2  LYS  66           1HD      LYS  66  12.144   0.485  -2.441
  505    HD3  LYS  66           2HD      LYS  66  12.469   1.766  -3.610
  506    HE2  LYS  66           1HE      LYS  66  14.548   2.282  -2.593
  507    HE3  LYS  66           2HE      LYS  66  14.181   1.285  -1.185
  508    HZ1  LYS  66           3HZ      LYS  66  15.735   0.239  -2.769
  509    HZ2  LYS  66           1HZ      LYS  66  14.510   0.223  -3.936
  510    HZ3  LYS  66           2HZ      LYS  66  14.331  -0.675  -2.509
  511    H    ASN  67           H        ASN  67   9.417   4.955  -2.972
  512    HA   ASN  67           HA       ASN  67   8.792   2.423  -4.311
  513    HB2  ASN  67           1HB      ASN  67   6.998   4.214  -2.709
  514    HB3  ASN  67           2HB      ASN  67   6.703   2.550  -3.166
  515   HD21  ASN  67          1HD2      ASN  67   7.023   4.172  -0.647
  516   HD22  ASN  67          2HD2      ASN  67   8.020   3.189   0.335
  517    H    GLU  68           H        GLU  68   8.784   5.754  -4.747
  518    HA   GLU  68           HA       GLU  68   8.153   7.041  -6.491
  519    HB2  GLU  68           1HB      GLU  68   8.272   4.970  -7.888
  520    HB3  GLU  68           2HB      GLU  68   6.560   4.709  -7.550
  521    HG2  GLU  68           1HG      GLU  68   6.787   5.714  -9.714
  522    HG3  GLU  68           2HG      GLU  68   6.090   6.905  -8.619
  523    H    VAL  69           H        VAL  69   6.557   6.312  -3.965
  524    HA   VAL  69           HA       VAL  69   4.010   7.453  -4.824
  525    HB   VAL  69           HB       VAL  69   3.370   5.857  -3.317
  526   HG11  VAL  69          1HG1      VAL  69   4.523   5.389  -1.146
  527   HG12  VAL  69          2HG1      VAL  69   5.846   6.421  -1.703
  528   HG13  VAL  69          3HG1      VAL  69   5.421   4.961  -2.594
  529   HG21  VAL  69          3HG2      VAL  69   2.432   7.944  -2.563
  530   HG22  VAL  69          1HG2      VAL  69   3.851   8.255  -1.562
  531   HG23  VAL  69          2HG2      VAL  69   2.777   6.913  -1.176
  532    H    SER  70           H        SER  70   3.721   9.537  -4.831
  533    HA   SER  70           HA       SER  70   5.190  11.197  -2.907
  534    HB2  SER  70           1HB      SER  70   4.903  11.815  -5.858
  535    HB3  SER  70           2HB      SER  70   5.721  12.816  -4.659
  536    HG   SER  70           HG       SER  70   6.759  10.411  -4.450
  537    H    ALA  71           H        ALA  71   2.328  10.170  -3.782
  538    HA   ALA  71           HA       ALA  71   1.006  12.734  -3.190
  539    HB1  ALA  71           1HB      ALA  71  -0.074  10.462  -4.859
  540    HB2  ALA  71           2HB      ALA  71   0.494  12.014  -5.472
  541    HB3  ALA  71           3HB      ALA  71  -0.938  11.942  -4.447
  542    H    MET  72           H        MET  72  -0.908  12.549  -1.840
  543    HA   MET  72           HA       MET  72  -0.952  10.070  -0.273
  544    HB2  MET  72           1HB      MET  72  -1.052  12.860   0.887
  545    HB3  MET  72           2HB      MET  72  -1.181  11.364   1.796
  546    HG2  MET  72           1HG      MET  72   1.007  12.018   2.139
  547    HG3  MET  72           2HG      MET  72   1.141  10.823   0.853
  548    HE1  MET  72           3HE      MET  72   3.576  11.657   0.107
  549    HE2  MET  72           1HE      MET  72   3.480  12.699   1.528
  550    HE3  MET  72           2HE      MET  72   3.977  13.369  -0.028
  551    HA   PRO  73           HA       PRO  73  -1.928   8.889   0.687
  552    HB2  PRO  73           1HB      PRO  73  -3.875   7.034   0.794
  553    HB3  PRO  73           2HB      PRO  73  -3.656   8.254   2.047
  554    HG2  PRO  73           1HG      PRO  73  -5.723   8.054  -0.057
  555    HG3  PRO  73           2HG      PRO  73  -5.815   8.825   1.542
  556    HD2  PRO  73           1HD      PRO  73  -5.395  10.086  -0.974
  557    HD3  PRO  73           2HD      PRO  73  -5.297  10.833   0.629
  558    H    THR  74           H        THR  74  -1.423   6.719  -0.172
  559    HA   THR  74           HA       THR  74  -2.142   6.278  -2.982
  560    HB   THR  74           HB       THR  74   0.657   6.714  -1.930
  561    HG1  THR  74           1HG      THR  74   0.028   8.569  -2.802
  562   HG21  THR  74          3HG2      THR  74  -0.100   5.406  -4.551
  563   HG22  THR  74          1HG2      THR  74   0.723   4.633  -3.194
  564   HG23  THR  74          2HG2      THR  74   1.526   5.923  -4.086
  565    H    LEU  75           H        LEU  75  -2.550   4.248  -3.347
  566    HA   LEU  75           HA       LEU  75  -1.615   2.185  -1.480
  567    HB2  LEU  75           1HB      LEU  75  -3.545   2.046  -3.797
  568    HB3  LEU  75           2HB      LEU  75  -3.170   0.723  -2.709
  569    HG   LEU  75           HG       LEU  75  -4.029   2.626  -0.957
  570   HD11  LEU  75          1HD1      LEU  75  -6.037   3.648  -1.846
  571   HD12  LEU  75          2HD1      LEU  75  -5.784   2.887  -3.416
  572   HD13  LEU  75          3HD1      LEU  75  -4.663   4.126  -2.844
  573   HD21  LEU  75          3HD2      LEU  75  -6.182   1.328  -1.049
  574   HD22  LEU  75          1HD2      LEU  75  -4.708   0.374  -0.860
  575   HD23  LEU  75          2HD2      LEU  75  -5.505   0.466  -2.430
  576    H    LEU  76           H        LEU  76   0.162   1.033  -2.045
  577    HA   LEU  76           HA       LEU  76   0.779   0.867  -4.916
  578    HB2  LEU  76           1HB      LEU  76   2.426   1.615  -2.666
  579    HB3  LEU  76           2HB      LEU  76   3.110   0.238  -3.507
  580    HG   LEU  76           HG       LEU  76   2.376   2.875  -4.786
  581   HD11  LEU  76          1HD1      LEU  76   4.808   3.153  -5.078
  582   HD12  LEU  76          2HD1      LEU  76   5.061   1.694  -4.105
  583   HD13  LEU  76          3HD1      LEU  76   4.320   3.117  -3.375
  584   HD21  LEU  76          3HD2      LEU  76   2.096   1.073  -6.354
  585   HD22  LEU  76          1HD2      LEU  76   3.663   0.396  -5.915
  586   HD23  LEU  76          2HD2      LEU  76   3.574   1.949  -6.743
  587    H    LEU  77           H        LEU  77   0.361  -1.002  -5.734
  588    HA   LEU  77           HA       LEU  77   0.368  -3.402  -4.038
  589    HB2  LEU  77           1HB      LEU  77  -0.830  -2.757  -6.731
  590    HB3  LEU  77           2HB      LEU  77  -0.721  -4.398  -6.141
  591    HG   LEU  77           HG       LEU  77  -2.388  -4.071  -4.534
  592   HD11  LEU  77          1HD1      LEU  77  -1.536  -2.007  -3.514
  593   HD12  LEU  77          2HD1      LEU  77  -3.264  -1.895  -3.852
  594   HD13  LEU  77          3HD1      LEU  77  -2.104  -1.087  -4.907
  595   HD21  LEU  77          3HD2      LEU  77  -3.181  -4.032  -6.864
  596   HD22  LEU  77          1HD2      LEU  77  -3.148  -2.268  -6.819
  597   HD23  LEU  77          2HD2      LEU  77  -4.241  -3.158  -5.759
  598    H    PHE  78           H        PHE  78   1.990  -4.848  -4.253
  599    HA   PHE  78           HA       PHE  78   3.555  -4.801  -6.746
  600    HB2  PHE  78           1HB      PHE  78   4.566  -4.938  -3.920
  601    HB3  PHE  78           2HB      PHE  78   5.520  -5.508  -5.280
  602    HD1  PHE  78           1HD      PHE  78   3.828  -2.487  -3.932
  603    HD2  PHE  78           2HD      PHE  78   6.809  -4.047  -6.532
  604    HE1  PHE  78           1HE      PHE  78   4.705  -0.222  -4.299
  605    HE2  PHE  78           2HE      PHE  78   7.681  -1.781  -6.905
  606    HZ   PHE  78           HZ       PHE  78   6.626   0.139  -5.785
  607    H    LYS  79           H        LYS  79   4.538  -6.807  -7.383
  608    HA   LYS  79           HA       LYS  79   4.055  -9.074  -5.592
  609    HB2  LYS  79           1HB      LYS  79   2.245  -8.969  -7.400
  610    HB3  LYS  79           2HB      LYS  79   3.523  -9.357  -8.545
  611    HG2  LYS  79           1HG      LYS  79   3.973 -11.438  -7.376
  612    HG3  LYS  79           2HG      LYS  79   2.744 -11.043  -6.172
  613    HD2  LYS  79           1HD      LYS  79   1.054 -11.009  -7.998
  614    HD3  LYS  79           2HD      LYS  79   2.306 -11.564  -9.111
  615    HE2  LYS  79           1HE      LYS  79   2.631 -13.560  -7.689
  616    HE3  LYS  79           2HE      LYS  79   1.312 -13.012  -6.660
  617    HZ1  LYS  79           3HZ      LYS  79   0.560 -14.652  -8.251
  618    HZ2  LYS  79           1HZ      LYS  79   1.088 -13.691  -9.537
  619    HZ3  LYS  79           2HZ      LYS  79  -0.184 -13.158  -8.550
  620    H    ASN  80           H        ASN  80   5.738 -10.410  -5.454
  621    HA   ASN  80           HA       ASN  80   7.847 -11.175  -5.592
  622    HB2  ASN  80           1HB      ASN  80   8.532 -12.145  -7.715
  623    HB3  ASN  80           2HB      ASN  80   6.834 -12.459  -7.409
  624   HD21  ASN  80          1HD2      ASN  80   5.310 -11.658  -8.800
  625   HD22  ASN  80          2HD2      ASN  80   5.701 -10.849 -10.277
  626    H    GLY  81           H        GLY  81   7.871  -8.396  -5.311
  627    HA2  GLY  81           1HA      GLY  81   9.709  -6.962  -5.106
  628    HA3  GLY  81           2HA      GLY  81  10.596  -7.994  -6.221
  629    H    LYS  82           H        LYS  82   7.683  -7.410  -7.604
  630    HA   LYS  82           HA       LYS  82   8.640  -5.000  -9.012
  631    HB2  LYS  82           1HB      LYS  82   6.895  -7.078 -10.315
  632    HB3  LYS  82           2HB      LYS  82   7.908  -5.864 -11.076
  633    HG2  LYS  82           1HG      LYS  82   8.898  -8.313  -9.634
  634    HG3  LYS  82           2HG      LYS  82   8.785  -8.121 -11.382
  635    HD2  LYS  82           1HD      LYS  82  10.397  -6.293 -11.295
  636    HD3  LYS  82           2HD      LYS  82  10.487  -6.444  -9.539
  637    HE2  LYS  82           1HE      LYS  82  11.218  -8.604 -11.512
  638    HE3  LYS  82           2HE      LYS  82  12.369  -7.548 -10.695
  639    HZ1  LYS  82           3HZ      LYS  82  12.052  -9.793  -9.676
  640    HZ2  LYS  82           1HZ      LYS  82  10.486  -9.325  -9.241
  641    HZ3  LYS  82           2HZ      LYS  82  11.825  -8.498  -8.615
  642    H    GLU  83           H        GLU  83   6.766  -3.695  -9.878
  643    HA   GLU  83           HA       GLU  83   4.714  -3.466  -7.931
  644    HB2  GLU  83           1HB      GLU  83   5.659  -1.607  -9.376
  645    HB3  GLU  83           2HB      GLU  83   4.739  -2.275 -10.715
  646    HG2  GLU  83           1HG      GLU  83   2.666  -1.814  -9.597
  647    HG3  GLU  83           2HG      GLU  83   3.522  -1.324  -8.134
  648    H    VAL  84           H        VAL  84   2.337  -3.401  -8.715
  649    HA   VAL  84           HA       VAL  84   1.777  -4.877 -11.137
  650    HB   VAL  84           HB       VAL  84  -0.254  -5.943  -9.924
  651   HG11  VAL  84          1HG1      VAL  84   1.553  -7.196 -11.023
  652   HG12  VAL  84          2HG1      VAL  84   0.973  -7.994  -9.561
  653   HG13  VAL  84          3HG1      VAL  84   2.499  -7.106  -9.535
  654   HG21  VAL  84          3HG2      VAL  84   0.115  -4.877  -7.789
  655   HG22  VAL  84          1HG2      VAL  84   1.698  -5.640  -7.660
  656   HG23  VAL  84          2HG2      VAL  84   0.235  -6.629  -7.632
  657    H    ALA  85           H        ALA  85   0.872  -2.677  -8.602
  658    HA   ALA  85           HA       ALA  85  -0.593  -1.095 -10.460
  659    HB1  ALA  85           1HB      ALA  85  -2.723  -1.098  -9.127
  660    HB2  ALA  85           2HB      ALA  85  -2.107  -2.538  -8.314
  661    HB3  ALA  85           3HB      ALA  85  -2.397  -2.564 -10.049
  662    H    LYS  86           H        LYS  86  -1.104   0.974  -9.705
  663    HA   LYS  86           HA       LYS  86  -0.324   1.671  -6.975
  664    HB2  LYS  86           1HB      LYS  86   1.699   2.044  -8.288
  665    HB3  LYS  86           2HB      LYS  86   0.797   3.001  -9.457
  666    HG2  LYS  86           1HG      LYS  86   0.228   4.501  -7.427
  667    HG3  LYS  86           2HG      LYS  86   1.592   3.694  -6.659
  668    HD2  LYS  86           1HD      LYS  86   1.759   5.106  -9.317
  669    HD3  LYS  86           2HD      LYS  86   2.118   5.883  -7.779
  670    HE2  LYS  86           1HE      LYS  86   4.215   5.263  -8.509
  671    HE3  LYS  86           2HE      LYS  86   3.780   3.915  -7.465
  672    HZ1  LYS  86           3HZ      LYS  86   3.379   2.535  -9.287
  673    HZ2  LYS  86           1HZ      LYS  86   4.780   3.380  -9.716
  674    HZ3  LYS  86           2HZ      LYS  86   3.292   3.828 -10.380
  675    H    VAL  87           H        VAL  87  -1.919   2.893  -6.129
  676    HA   VAL  87           HA       VAL  87  -3.574   4.483  -7.979
  677    HB   VAL  87           HB       VAL  87  -4.668   2.753  -5.755
  678   HG11  VAL  87          1HG1      VAL  87  -6.107   4.430  -7.807
  679   HG12  VAL  87          2HG1      VAL  87  -5.914   4.838  -6.102
  680   HG13  VAL  87          3HG1      VAL  87  -6.854   3.422  -6.569
  681   HG21  VAL  87          3HG2      VAL  87  -5.709   1.439  -7.548
  682   HG22  VAL  87          1HG2      VAL  87  -3.949   1.396  -7.646
  683   HG23  VAL  87          2HG2      VAL  87  -4.868   2.420  -8.748
  684    H    VAL  88           H        VAL  88  -3.919   6.500  -7.326
  685    HA   VAL  88           HA       VAL  88  -3.057   7.223  -4.620
  686    HB   VAL  88           HB       VAL  88  -3.036   9.570  -5.503
  687   HG11  VAL  88          1HG1      VAL  88  -0.995   9.283  -6.833
  688   HG12  VAL  88          2HG1      VAL  88  -1.348   7.562  -6.994
  689   HG13  VAL  88          3HG1      VAL  88  -0.996   8.245  -5.406
  690   HG21  VAL  88          3HG2      VAL  88  -3.504   8.217  -8.161
  691   HG22  VAL  88          1HG2      VAL  88  -3.109   9.919  -7.919
  692   HG23  VAL  88          2HG2      VAL  88  -4.643   9.277  -7.330
  693    H    GLY  89           H        GLY  89  -5.405   6.033  -4.378
  694    HA2  GLY  89           1HA      GLY  89  -7.134   7.962  -3.331
  695    HA3  GLY  89           2HA      GLY  89  -7.696   7.576  -4.948
  696    H    ALA  90           H        ALA  90  -8.209   6.941  -1.844
  697    HA   ALA  90           HA       ALA  90  -8.592   4.172  -1.684
  698    HB1  ALA  90           1HB      ALA  90 -10.233   6.238  -0.266
  699    HB2  ALA  90           2HB      ALA  90  -8.564   5.889   0.167
  700    HB3  ALA  90           3HB      ALA  90  -9.791   4.619   0.289
  701    H    ASN  91           H        ASN  91  -9.724   3.218  -3.317
  702    HA   ASN  91           HA       ASN  91 -12.522   4.083  -3.586
  703    HB2  ASN  91           1HB      ASN  91 -10.575   3.716  -5.579
  704    HB3  ASN  91           2HB      ASN  91 -11.654   2.327  -5.702
  705   HD21  ASN  91          1HD2      ASN  91 -13.935   3.882  -4.638
  706   HD22  ASN  91          2HD2      ASN  91 -14.454   4.888  -5.944
  707    HA   PRO  92           HA       PRO  92 -12.740   0.444  -0.796
  708    HB2  PRO  92           1HB      PRO  92 -15.539   1.023  -1.698
  709    HB3  PRO  92           2HB      PRO  92 -14.961   0.518  -0.106
  710    HG2  PRO  92           1HG      PRO  92 -15.478   3.093  -0.659
  711    HG3  PRO  92           2HG      PRO  92 -14.159   2.611   0.421
  712    HD2  PRO  92           1HD      PRO  92 -14.025   3.800  -2.249
  713    HD3  PRO  92           2HD      PRO  92 -12.754   3.649  -1.028
  714    H    ALA  93           H        ALA  93 -15.083   0.394  -3.503
  715    HA   ALA  93           HA       ALA  93 -14.880  -2.472  -3.562
  716    HB1  ALA  93           1HB      ALA  93 -16.650  -2.388  -5.213
  717    HB2  ALA  93           2HB      ALA  93 -16.450  -0.641  -5.367
  718    HB3  ALA  93           3HB      ALA  93 -17.035  -1.333  -3.854
  719    H    ALA  94           H        ALA  94 -13.981   0.161  -5.751
  720    HA   ALA  94           HA       ALA  94 -13.248  -1.540  -7.904
  721    HB1  ALA  94           1HB      ALA  94 -12.337   1.284  -7.357
  722    HB2  ALA  94           2HB      ALA  94 -13.823   0.836  -8.196
  723    HB3  ALA  94           3HB      ALA  94 -12.256   0.435  -8.900
  724    H    ILE  95           H        ILE  95 -11.528  -0.405  -5.080
  725    HA   ILE  95           HA       ILE  95  -8.998  -1.263  -6.224
  726    HB   ILE  95           HB       ILE  95  -9.529  -0.195  -3.453
  727   HG12  ILE  95          1HG1      ILE  95  -9.986   1.516  -5.092
  728   HG13  ILE  95          2HG1      ILE  95  -8.436   1.868  -4.338
  729   HG21  ILE  95          1HG2      ILE  95  -6.940  -0.664  -4.923
  730   HG22  ILE  95          2HG2      ILE  95  -7.534  -1.578  -3.536
  731   HG23  ILE  95          3HG2      ILE  95  -7.102   0.121  -3.355
  732   HD11  ILE  95          3HD1      ILE  95  -7.277   0.974  -6.272
  733   HD12  ILE  95          1HD1      ILE  95  -8.395   2.256  -6.741
  734   HD13  ILE  95          2HD1      ILE  95  -8.820   0.570  -7.024
  735    H    LYS  96           H        LYS  96 -11.336  -2.325  -3.798
  736    HA   LYS  96           HA       LYS  96  -9.939  -4.619  -2.974
  737    HB2  LYS  96           1HB      LYS  96 -11.784  -4.229  -1.655
  738    HB3  LYS  96           2HB      LYS  96 -12.813  -3.815  -3.024
  739    HG2  LYS  96           1HG      LYS  96 -11.928  -6.608  -2.926
  740    HG3  LYS  96           2HG      LYS  96 -12.967  -6.105  -1.593
  741    HD2  LYS  96           1HD      LYS  96 -14.558  -5.201  -3.306
  742    HD3  LYS  96           2HD      LYS  96 -13.555  -5.956  -4.546
  743    HE2  LYS  96           1HE      LYS  96 -15.418  -7.400  -4.011
  744    HE3  LYS  96           2HE      LYS  96 -13.914  -8.142  -3.470
  745    HZ1  LYS  96           3HZ      LYS  96 -15.644  -8.355  -1.805
  746    HZ2  LYS  96           1HZ      LYS  96 -15.840  -6.677  -1.749
  747    HZ3  LYS  96           2HZ      LYS  96 -14.396  -7.377  -1.224
  748    H    GLN  97           H        GLN  97 -11.871  -3.927  -5.804
  749    HA   GLN  97           HA       GLN  97 -11.647  -6.527  -6.936
  750    HB2  GLN  97           1HB      GLN  97 -13.338  -4.931  -7.720
  751    HB3  GLN  97           2HB      GLN  97 -12.073  -3.840  -8.279
  752    HG2  GLN  97           1HG      GLN  97 -11.307  -5.687  -9.801
  753    HG3  GLN  97           2HG      GLN  97 -12.765  -6.565  -9.350
  754   HE21  GLN  97          1HE2      GLN  97 -11.926  -5.610 -11.937
  755   HE22  GLN  97          2HE2      GLN  97 -13.169  -4.548 -12.498
  756    H    ALA  98           H        ALA  98  -9.601  -3.695  -6.861
  757    HA   ALA  98           HA       ALA  98  -7.875  -4.432  -8.974
  758    HB1  ALA  98           1HB      ALA  98  -7.995  -2.148  -8.133
  759    HB2  ALA  98           2HB      ALA  98  -6.349  -2.773  -8.080
  760    HB3  ALA  98           3HB      ALA  98  -7.303  -2.675  -6.600
  761    H    ILE  99           H        ILE  99  -7.586  -4.727  -5.460
  762    HA   ILE  99           HA       ILE  99  -5.112  -5.957  -5.342
  763    HB   ILE  99           HB       ILE  99  -7.336  -6.777  -3.463
  764   HG12  ILE  99          1HG1      ILE  99  -7.624  -4.444  -3.456
  765   HG13  ILE  99          2HG1      ILE  99  -6.545  -4.757  -2.098
  766   HG21  ILE  99          1HG2      ILE  99  -5.385  -6.689  -1.871
  767   HG22  ILE  99          2HG2      ILE  99  -4.356  -6.464  -3.286
  768   HG23  ILE  99          3HG2      ILE  99  -5.309  -7.937  -3.115
  769   HD11  ILE  99          3HD1      ILE  99  -4.647  -4.177  -3.599
  770   HD12  ILE  99          1HD1      ILE  99  -5.756  -2.849  -3.249
  771   HD13  ILE  99          2HD1      ILE  99  -5.847  -3.686  -4.803
  772    H    ALA 100           H        ALA 100  -8.290  -7.362  -5.957
  773    HA   ALA 100           HA       ALA 100  -7.365 -10.081  -5.954
  774    HB1  ALA 100           1HB      ALA 100  -9.697  -9.507  -5.461
  775    HB2  ALA 100           2HB      ALA 100  -9.573 -10.630  -6.815
  776    HB3  ALA 100           3HB      ALA 100  -9.898  -8.922  -7.113
  777    H    ALA 101           H        ALA 101  -7.702  -7.557  -8.338
  778    HA   ALA 101           HA       ALA 101  -7.421  -9.208 -10.648
  779    HB1  ALA 101           1HB      ALA 101  -8.459  -6.957 -10.678
  780    HB2  ALA 101           2HB      ALA 101  -7.177  -7.145 -11.874
  781    HB3  ALA 101           3HB      ALA 101  -6.866  -6.252 -10.382
  782    H    ASN 102           H        ASN 102  -5.202  -7.442  -8.591
  783    HA   ASN 102           HA       ASN 102  -2.974  -7.859 -10.400
  784    HB2  ASN 102           1HB      ASN 102  -3.076  -6.567  -7.678
  785    HB3  ASN 102           2HB      ASN 102  -1.677  -6.575  -8.739
  786   HD21  ASN 102          1HD2      ASN 102  -4.639  -5.109  -7.973
  787   HD22  ASN 102          2HD2      ASN 102  -4.670  -3.929  -9.235
  788    H    ALA 103           H        ALA 103  -4.370  -9.406  -7.694
  789    HA   ALA 103           HA       ALA 103  -2.076 -10.672  -6.630
  790    HB1  ALA 103           1HB      ALA 103  -3.652 -12.166  -5.509
  791    HB2  ALA 103           2HB      ALA 103  -4.958 -11.559  -6.527
  792    HB3  ALA 103           3HB      ALA 103  -4.165 -10.484  -5.376
  Start of MODEL   10
    1    H1   MET   1           1H       MET   1  -5.167  -7.563  10.770
    2    H2   MET   1           2H       MET   1  -6.238  -6.845   9.681
    3    H3   MET   1           3H       MET   1  -6.542  -6.765  11.343
    4    HA   MET   1           HA       MET   1  -5.727  -4.679  10.559
    5    HB2  MET   1           1HB      MET   1  -3.980  -4.319  12.150
    6    HB3  MET   1           2HB      MET   1  -5.093  -5.489  12.835
    7    HG2  MET   1           1HG      MET   1  -2.480  -6.188  11.514
    8    HG3  MET   1           2HG      MET   1  -2.707  -5.989  13.247
    9    HE1  MET   1           3HE      MET   1  -3.667  -8.015  10.082
   10    HE2  MET   1           1HE      MET   1  -3.523  -9.649  10.738
   11    HE3  MET   1           2HE      MET   1  -2.128  -8.570  10.746
   12    H    VAL   2           H        VAL   2  -3.606  -3.501  10.047
   13    HA   VAL   2           HA       VAL   2  -2.219  -4.938   7.887
   14    HB   VAL   2           HB       VAL   2  -3.121  -2.056   7.992
   15   HG11  VAL   2          1HG1      VAL   2  -0.973  -2.101   6.944
   16   HG12  VAL   2          2HG1      VAL   2  -2.197  -1.932   5.682
   17   HG13  VAL   2          3HG1      VAL   2  -1.426  -3.492   5.964
   18   HG21  VAL   2          3HG2      VAL   2  -4.413  -2.712   5.981
   19   HG22  VAL   2          1HG2      VAL   2  -4.917  -3.542   7.451
   20   HG23  VAL   2          2HG2      VAL   2  -3.925  -4.380   6.262
   21    H    THR   3           H        THR   3  -0.037  -4.821   7.866
   22    HA   THR   3           HA       THR   3   1.186  -4.188  10.375
   23    HB   THR   3           HB       THR   3   2.505  -5.147   7.832
   24    HG1  THR   3           1HG      THR   3   1.613  -7.017   8.241
   25   HG21  THR   3          3HG2      THR   3   4.091  -4.334   9.503
   26   HG22  THR   3          1HG2      THR   3   4.187  -6.090   9.358
   27   HG23  THR   3          2HG2      THR   3   3.344  -5.362  10.727
   28    H    GLN   4           H        GLN   4   2.867  -2.762  10.824
   29    HA   GLN   4           HA       GLN   4   2.831  -0.340   9.154
   30    HB2  GLN   4           1HB      GLN   4   2.101  -0.352  11.584
   31    HB3  GLN   4           2HB      GLN   4   3.779  -0.651  12.006
   32    HG2  GLN   4           1HG      GLN   4   3.120   1.711  12.213
   33    HG3  GLN   4           2HG      GLN   4   4.442   1.460  11.070
   34   HE21  GLN   4          1HE2      GLN   4   4.135   1.871   8.946
   35   HE22  GLN   4          2HE2      GLN   4   2.706   2.591   8.307
   36    H    PHE   5           H        PHE   5   4.564   0.084   7.932
   37    HA   PHE   5           HA       PHE   5   7.178  -1.104   8.433
   38    HB2  PHE   5           1HB      PHE   5   6.183   0.882   6.384
   39    HB3  PHE   5           2HB      PHE   5   7.861   0.386   6.494
   40    HD1  PHE   5           1HD      PHE   5   7.105  -2.585   7.152
   41    HD2  PHE   5           2HD      PHE   5   5.938   0.189   4.146
   42    HE1  PHE   5           1HE      PHE   5   6.688  -4.442   5.597
   43    HE2  PHE   5           2HE      PHE   5   5.513  -1.664   2.591
   44    HZ   PHE   5           HZ       PHE   5   5.892  -3.982   3.316
   45    H    LYS   6           H        LYS   6   9.118   0.156   8.816
   46    HA   LYS   6           HA       LYS   6   8.683   3.020   9.288
   47    HB2  LYS   6           1HB      LYS   6  10.146   3.067  11.187
   48    HB3  LYS   6           2HB      LYS   6   8.899   1.868  11.471
   49    HG2  LYS   6           1HG      LYS   6  10.409   0.079  11.056
   50    HG3  LYS   6           2HG      LYS   6  11.650   1.190  10.481
   51    HD2  LYS   6           1HD      LYS   6  12.307   0.620  12.663
   52    HD3  LYS   6           2HD      LYS   6  11.590   2.222  12.806
   53    HE2  LYS   6           1HE      LYS   6  10.043  -0.305  13.328
   54    HE3  LYS   6           2HE      LYS   6  10.967   0.514  14.582
   55    HZ1  LYS   6           3HZ      LYS   6   9.613   2.507  14.178
   56    HZ2  LYS   6           1HZ      LYS   6   8.681   1.186  14.678
   57    HZ3  LYS   6           2HZ      LYS   6   8.687   1.644  13.057
   58    H    THR   7           H        THR   7  10.217   0.733   7.475
   59    HA   THR   7           HA       THR   7  12.260   2.688   6.688
   60    HB   THR   7           HB       THR   7  13.863   0.723   6.330
   61    HG1  THR   7           1HG      THR   7  11.968  -0.451   8.113
   62   HG21  THR   7          3HG2      THR   7  14.699   0.831   8.637
   63   HG22  THR   7          1HG2      THR   7  13.181   1.567   9.147
   64   HG23  THR   7          2HG2      THR   7  14.245   2.423   8.032
   65    H    ALA   8           H        ALA   8  13.160   2.330   4.559
   66    HA   ALA   8           HA       ALA   8  11.201   1.495   2.662
   67    HB1  ALA   8           1HB      ALA   8  14.053   2.394   2.351
   68    HB2  ALA   8           2HB      ALA   8  12.582   3.315   2.030
   69    HB3  ALA   8           3HB      ALA   8  13.017   1.959   0.997
   70    H    SER   9           H        SER   9  14.056   0.069   4.089
   71    HA   SER   9           HA       SER   9  14.382  -2.135   2.400
   72    HB2  SER   9           1HB      SER   9  14.730  -2.111   5.408
   73    HB3  SER   9           2HB      SER   9  15.531  -3.179   4.255
   74    HG   SER   9           HG       SER   9  16.284  -1.029   3.326
   75    H    GLU  10           H        GLU  10  12.327  -1.682   5.255
   76    HA   GLU  10           HA       GLU  10  10.972  -4.072   5.298
   77    HB2  GLU  10           1HB      GLU  10  10.308  -1.269   6.044
   78    HB3  GLU  10           2HB      GLU  10   9.027  -2.469   6.081
   79    HG2  GLU  10           1HG      GLU  10  10.324  -3.825   7.592
   80    HG3  GLU  10           2HG      GLU  10  11.645  -2.669   7.532
   81    H    PHE  11           H        PHE  11  10.259  -1.174   3.333
   82    HA   PHE  11           HA       PHE  11   7.931  -2.136   2.125
   83    HB2  PHE  11           1HB      PHE  11   8.854   0.211   1.959
   84    HB3  PHE  11           2HB      PHE  11   9.991  -0.391   0.760
   85    HD1  PHE  11           2HD      PHE  11   8.984  -1.504  -1.342
   86    HD2  PHE  11           1HD      PHE  11   6.756   0.969   1.310
   87    HE1  PHE  11           2HE      PHE  11   7.326  -1.096  -3.112
   88    HE2  PHE  11           1HE      PHE  11   5.093   1.396  -0.477
   89    HZ   PHE  11           HZ       PHE  11   5.388   0.350  -2.677
   90    H    ASP  12           H        ASP  12  11.213  -2.179   0.766
   91    HA   ASP  12           HA       ASP  12  10.692  -3.751  -1.476
   92    HB2  ASP  12           1HB      ASP  12  13.212  -3.427   0.159
   93    HB3  ASP  12           2HB      ASP  12  13.163  -4.393  -1.307
   94    H    SER  13           H        SER  13  11.550  -4.779   1.811
   95    HA   SER  13           HA       SER  13  11.948  -7.498   1.296
   96    HB2  SER  13           1HB      SER  13  12.522  -6.401   3.437
   97    HB3  SER  13           2HB      SER  13  10.808  -6.234   3.804
   98    HG   SER  13           HG       SER  13  12.110  -8.717   3.339
   99    H    ALA  14           H        ALA  14   8.963  -5.771   2.165
  100    HA   ALA  14           HA       ALA  14   7.297  -8.035   2.168
  101    HB1  ALA  14           1HB      ALA  14   6.571  -5.156   1.641
  102    HB2  ALA  14           2HB      ALA  14   6.649  -5.927   3.225
  103    HB3  ALA  14           3HB      ALA  14   5.439  -6.446   2.051
  104    H    ILE  15           H        ILE  15   8.428  -5.888  -0.310
  105    HA   ILE  15           HA       ILE  15   6.604  -6.541  -2.359
  106    HB   ILE  15           HB       ILE  15   9.442  -5.580  -2.604
  107   HG12  ILE  15          1HG1      ILE  15   8.393  -3.902  -1.379
  108   HG13  ILE  15          2HG1      ILE  15   8.224  -3.372  -3.048
  109   HG21  ILE  15          1HG2      ILE  15   8.974  -4.905  -4.792
  110   HG22  ILE  15          2HG2      ILE  15   7.247  -5.196  -4.595
  111   HG23  ILE  15          3HG2      ILE  15   8.365  -6.558  -4.659
  112   HD11  ILE  15          3HD1      ILE  15   6.178  -3.014  -1.797
  113   HD12  ILE  15          1HD1      ILE  15   6.098  -4.733  -1.411
  114   HD13  ILE  15          2HD1      ILE  15   5.934  -4.196  -3.083
  115    H    ALA  16           H        ALA  16   9.586  -7.994  -1.279
  116    HA   ALA  16           HA       ALA  16  10.097  -9.408  -3.707
  117    HB1  ALA  16           1HB      ALA  16  11.904  -8.657  -2.280
  118    HB2  ALA  16           2HB      ALA  16  11.959 -10.409  -2.480
  119    HB3  ALA  16           3HB      ALA  16  11.342  -9.708  -0.981
  120    H    GLN  17           H        GLN  17   7.615  -9.994  -1.842
  121    HA   GLN  17           HA       GLN  17   7.929 -12.836  -1.454
  122    HB2  GLN  17           1HB      GLN  17   5.551 -11.020  -1.069
  123    HB3  GLN  17           2HB      GLN  17   5.656 -12.692  -0.576
  124    HG2  GLN  17           1HG      GLN  17   7.557 -12.066   0.903
  125    HG3  GLN  17           2HG      GLN  17   7.215 -10.382   0.507
  126   HE21  GLN  17          1HE2      GLN  17   5.248  -9.474   1.189
  127   HE22  GLN  17          2HE2      GLN  17   4.334 -10.169   2.491
  128    H    ASP  18           H        ASP  18   6.640 -14.402  -2.505
  129    HA   ASP  18           HA       ASP  18   6.034 -13.765  -5.261
  130    HB2  ASP  18           1HB      ASP  18   5.803 -16.370  -3.737
  131    HB3  ASP  18           2HB      ASP  18   5.566 -16.193  -5.472
  132    H    LYS  19           H        LYS  19   4.374 -12.427  -3.443
  133    HA   LYS  19           HA       LYS  19   1.752 -13.565  -4.109
  134    HB2  LYS  19           1HB      LYS  19   0.895 -13.123  -1.888
  135    HB3  LYS  19           2HB      LYS  19   2.313 -14.155  -1.741
  136    HG2  LYS  19           1HG      LYS  19   3.666 -12.327  -1.041
  137    HG3  LYS  19           2HG      LYS  19   2.394 -11.167  -1.417
  138    HD2  LYS  19           1HD      LYS  19   2.421 -11.466   0.943
  139    HD3  LYS  19           2HD      LYS  19   0.985 -12.280   0.324
  140    HE2  LYS  19           1HE      LYS  19   2.081 -14.423   0.498
  141    HE3  LYS  19           2HE      LYS  19   3.591 -13.647   0.975
  142    HZ1  LYS  19           3HZ      LYS  19   1.058 -13.711   2.509
  143    HZ2  LYS  19           1HZ      LYS  19   2.395 -12.762   2.938
  144    HZ3  LYS  19           2HZ      LYS  19   2.517 -14.453   2.921
  145    H    LEU  20           H        LEU  20   0.038 -11.781  -3.429
  146    HA   LEU  20           HA       LEU  20   0.864  -9.362  -4.778
  147    HB2  LEU  20           1HB      LEU  20  -1.374 -10.566  -5.037
  148    HB3  LEU  20           2HB      LEU  20  -1.802  -9.899  -3.478
  149    HG   LEU  20           HG       LEU  20  -2.722  -8.648  -5.426
  150   HD11  LEU  20          1HD1      LEU  20  -0.797  -7.063  -3.740
  151   HD12  LEU  20          2HD1      LEU  20  -2.418  -7.559  -3.255
  152   HD13  LEU  20          3HD1      LEU  20  -2.205  -6.437  -4.599
  153   HD21  LEU  20          3HD2      LEU  20  -0.646  -9.008  -6.818
  154   HD22  LEU  20          1HD2      LEU  20   0.083  -7.690  -5.902
  155   HD23  LEU  20          2HD2      LEU  20  -1.364  -7.393  -6.884
  156    H    VAL  21           H        VAL  21   1.759  -7.739  -3.757
  157    HA   VAL  21           HA       VAL  21   1.377  -7.472  -0.855
  158    HB   VAL  21           HB       VAL  21   3.356  -5.842  -2.385
  159   HG11  VAL  21          1HG1      VAL  21   3.385  -7.087   0.358
  160   HG12  VAL  21          2HG1      VAL  21   3.039  -5.400  -0.026
  161   HG13  VAL  21          3HG1      VAL  21   4.649  -6.059  -0.316
  162   HG21  VAL  21          3HG2      VAL  21   3.682  -8.764  -1.741
  163   HG22  VAL  21          1HG2      VAL  21   5.039  -7.679  -2.049
  164   HG23  VAL  21          2HG2      VAL  21   3.839  -7.966  -3.309
  165    H    VAL  22           H        VAL  22  -0.046  -5.955  -0.202
  166    HA   VAL  22           HA       VAL  22  -0.517  -3.659  -1.987
  167    HB   VAL  22           HB       VAL  22  -2.247  -4.535   0.329
  168   HG11  VAL  22          1HG1      VAL  22  -2.726  -2.579  -1.917
  169   HG12  VAL  22          2HG1      VAL  22  -2.447  -2.179  -0.223
  170   HG13  VAL  22          3HG1      VAL  22  -3.910  -3.043  -0.696
  171   HG21  VAL  22          3HG2      VAL  22  -3.808  -5.393  -1.356
  172   HG22  VAL  22          1HG2      VAL  22  -2.276  -6.265  -1.365
  173   HG23  VAL  22          2HG2      VAL  22  -2.614  -5.066  -2.613
  174    H    VAL  23           H        VAL  23   0.793  -2.046  -1.418
  175    HA   VAL  23           HA       VAL  23   1.330  -1.724   1.441
  176    HB   VAL  23           HB       VAL  23   2.832  -0.356  -0.782
  177   HG11  VAL  23          1HG1      VAL  23   3.471  -0.884   2.121
  178   HG12  VAL  23          2HG1      VAL  23   2.973   0.662   1.440
  179   HG13  VAL  23          3HG1      VAL  23   4.514  -0.052   0.968
  180   HG21  VAL  23          3HG2      VAL  23   4.557  -2.077  -0.438
  181   HG22  VAL  23          1HG2      VAL  23   3.054  -2.763  -1.058
  182   HG23  VAL  23          2HG2      VAL  23   3.460  -2.929   0.651
  183    H    ALA  24           H        ALA  24   0.536  -0.214   2.506
  184    HA   ALA  24           HA       ALA  24  -1.262   1.708   1.219
  185    HB1  ALA  24           1HB      ALA  24  -2.138   0.268   2.981
  186    HB2  ALA  24           2HB      ALA  24  -2.143   1.949   3.526
  187    HB3  ALA  24           3HB      ALA  24  -0.903   0.832   4.104
  188    H    PHE  25           H        PHE  25   0.080   3.434   0.597
  189    HA   PHE  25           HA       PHE  25   1.666   4.657   2.737
  190    HB2  PHE  25           1HB      PHE  25   1.927   4.572  -0.191
  191    HB3  PHE  25           2HB      PHE  25   2.325   6.120   0.556
  192    HD1  PHE  25           1HD      PHE  25   2.801   2.561   1.493
  193    HD2  PHE  25           2HD      PHE  25   4.582   6.366   0.876
  194    HE1  PHE  25           1HE      PHE  25   4.965   1.657   2.219
  195    HE2  PHE  25           2HE      PHE  25   6.755   5.468   1.596
  196    HZ   PHE  25           HZ       PHE  25   6.942   3.108   2.272
  197    H    TYR  26           H        TYR  26   1.076   6.404   3.712
  198    HA   TYR  26           HA       TYR  26  -0.595   8.372   2.414
  199    HB2  TYR  26           1HB      TYR  26  -2.250   8.375   4.301
  200    HB3  TYR  26           2HB      TYR  26  -2.327   6.945   3.280
  201    HD1  TYR  26           1HD      TYR  26  -1.275   4.807   4.115
  202    HD2  TYR  26           2HD      TYR  26  -1.875   8.186   6.621
  203    HE1  TYR  26           1HE      TYR  26  -1.068   3.365   6.087
  204    HE2  TYR  26           2HE      TYR  26  -1.664   6.759   8.605
  205    HH   TYR  26           HH       TYR  26  -0.370   3.759   8.595
  206    H    ALA  27           H        ALA  27  -1.060  10.168   4.181
  207    HA   ALA  27           HA       ALA  27   1.447  10.533   5.673
  208    HB1  ALA  27           1HB      ALA  27   1.478  12.864   5.008
  209    HB2  ALA  27           2HB      ALA  27  -0.010  12.641   4.091
  210    HB3  ALA  27           3HB      ALA  27   1.467  11.824   3.583
  211    H    THR  28           H        THR  28   1.140  10.928   7.748
  212    HA   THR  28           HA       THR  28  -1.387  11.086   8.923
  213    HB   THR  28           HB       THR  28   0.730  12.121  10.569
  214    HG1  THR  28           1HG      THR  28   1.177   9.511   9.542
  215   HG21  THR  28          3HG2      THR  28  -0.858   9.567  10.574
  216   HG22  THR  28          1HG2      THR  28  -1.271  11.046  11.438
  217   HG23  THR  28          2HG2      THR  28   0.163  10.127  11.898
  218    H    TRP  29           H        TRP  29   0.643  13.559   7.632
  219    HA   TRP  29           HA       TRP  29  -0.793  15.665   9.025
  220    HB2  TRP  29           1HB      TRP  29   0.675  17.205   7.708
  221    HB3  TRP  29           2HB      TRP  29   1.556  16.078   8.728
  222    HD1  TRP  29           HD       TRP  29   3.380  14.662   7.587
  223    HE1  TRP  29           1HE      TRP  29   4.179  14.316   5.165
  224    HE3  TRP  29           3HE      TRP  29  -0.365  17.132   5.135
  225    HZ2  TRP  29           2HZ      TRP  29   3.327  14.994   2.563
  226    HZ3  TRP  29           3HZ      TRP  29  -0.301  17.232   2.684
  227    HH2  TRP  29           HH       TRP  29   1.509  16.189   1.420
  228    H    CYS  30           H        CYS  30  -1.377  13.746   6.411
  229    HA   CYS  30           HA       CYS  30  -2.504  15.842   4.721
  230    HB2  CYS  30           1HB      CYS  30  -1.139  14.130   3.635
  231    HB3  CYS  30           2HB      CYS  30  -2.196  12.867   4.252
  232    HG   CYS  30           HG       CYS  30  -3.174  15.278   2.027
  233    H    GLY  31           H        GLY  31  -4.702  15.730   3.990
  234    HA2  GLY  31           1HA      GLY  31  -6.517  15.338   6.096
  235    HA3  GLY  31           2HA      GLY  31  -6.947  15.671   4.430
  236    HA   PRO  32           HA       PRO  32  -8.624  11.728   3.974
  237    HB2  PRO  32           1HB      PRO  32  -7.953  10.912   1.491
  238    HB3  PRO  32           2HB      PRO  32  -9.029  12.278   1.793
  239    HG2  PRO  32           1HG      PRO  32  -6.150  12.267   1.032
  240    HG3  PRO  32           2HG      PRO  32  -7.442  13.361   0.520
  241    HD2  PRO  32           1HD      PRO  32  -5.567  13.951   2.448
  242    HD3  PRO  32           2HD      PRO  32  -7.159  14.720   2.321
  243    H    CYS  33           H        CYS  33  -5.859  11.563   5.169
  244    HA   CYS  33           HA       CYS  33  -4.668   9.147   4.234
  245    HB2  CYS  33           1HB      CYS  33  -3.540   9.180   6.495
  246    HB3  CYS  33           2HB      CYS  33  -3.312  10.633   5.528
  247    HG   CYS  33           HG       CYS  33  -4.376  12.320   7.173
  248    H    LYS  34           H        LYS  34  -7.128   9.957   6.566
  249    HA   LYS  34           HA       LYS  34  -7.309   7.416   7.777
  250    HB2  LYS  34           1HB      LYS  34  -9.240   8.185   8.892
  251    HB3  LYS  34           2HB      LYS  34  -8.183   9.577   8.750
  252    HG2  LYS  34           1HG      LYS  34 -10.463   9.044   6.864
  253    HG3  LYS  34           2HG      LYS  34 -10.625   9.992   8.340
  254    HD2  LYS  34           1HD      LYS  34  -8.820  11.489   7.481
  255    HD3  LYS  34           2HD      LYS  34  -8.877  10.595   5.961
  256    HE2  LYS  34           1HE      LYS  34 -10.209  12.634   5.832
  257    HE3  LYS  34           2HE      LYS  34 -11.224  11.201   5.685
  258    HZ1  LYS  34           3HZ      LYS  34 -12.179  12.900   7.153
  259    HZ2  LYS  34           1HZ      LYS  34 -10.850  12.755   8.188
  260    HZ3  LYS  34           2HZ      LYS  34 -11.896  11.446   7.964
  261    H    MET  35           H        MET  35  -8.079   8.339   4.645
  262    HA   MET  35           HA       MET  35 -10.411   6.668   4.323
  263    HB2  MET  35           1HB      MET  35  -9.925   8.586   2.818
  264    HB3  MET  35           2HB      MET  35  -8.488   7.746   2.247
  265    HG2  MET  35           1HG      MET  35 -10.230   7.477   0.642
  266    HG3  MET  35           2HG      MET  35  -9.914   5.929   1.419
  267    HE1  MET  35           3HE      MET  35 -12.174   4.971   0.415
  268    HE2  MET  35           1HE      MET  35 -12.478   6.522  -0.365
  269    HE3  MET  35           2HE      MET  35 -13.736   5.763   0.607
  270    H    ILE  36           H        ILE  36  -6.950   6.393   4.041
  271    HA   ILE  36           HA       ILE  36  -7.023   3.812   2.775
  272    HB   ILE  36           HB       ILE  36  -4.966   5.769   3.512
  273   HG12  ILE  36          1HG1      ILE  36  -4.096   5.168   1.336
  274   HG13  ILE  36          2HG1      ILE  36  -5.150   3.763   1.270
  275   HG21  ILE  36          1HG2      ILE  36  -4.071   3.984   4.832
  276   HG22  ILE  36          2HG2      ILE  36  -3.114   4.125   3.358
  277   HG23  ILE  36          3HG2      ILE  36  -4.304   2.835   3.517
  278   HD11  ILE  36          3HD1      ILE  36  -5.918   6.649   1.140
  279   HD12  ILE  36          1HD1      ILE  36  -7.083   5.363   1.445
  280   HD13  ILE  36          2HD1      ILE  36  -6.168   5.387  -0.069
  281    H    ALA  37           H        ALA  37  -6.811   5.072   6.003
  282    HA   ALA  37           HA       ALA  37  -5.848   2.882   7.369
  283    HB1  ALA  37           1HB      ALA  37  -7.955   4.863   8.179
  284    HB2  ALA  37           2HB      ALA  37  -6.244   4.853   8.593
  285    HB3  ALA  37           3HB      ALA  37  -7.323   3.635   9.270
  286    HA   PRO  38           HA       PRO  38  -9.956   0.646   7.670
  287    HB2  PRO  38           1HB      PRO  38 -12.290   1.590   6.789
  288    HB3  PRO  38           2HB      PRO  38 -11.582   2.167   8.304
  289    HG2  PRO  38           1HG      PRO  38 -11.595   3.456   5.609
  290    HG3  PRO  38           2HG      PRO  38 -11.828   4.191   7.206
  291    HD2  PRO  38           1HD      PRO  38  -9.450   4.204   5.797
  292    HD3  PRO  38           2HD      PRO  38  -9.593   4.413   7.549
  293    H    MET  39           H        MET  39  -9.794   2.331   4.505
  294    HA   MET  39           HA       MET  39 -11.292   0.337   3.137
  295    HB2  MET  39           1HB      MET  39 -11.121   2.522   2.167
  296    HB3  MET  39           2HB      MET  39  -9.373   2.475   2.209
  297    HG2  MET  39           1HG      MET  39 -10.930   0.550   0.531
  298    HG3  MET  39           2HG      MET  39 -10.571   2.180  -0.034
  299    HE1  MET  39           3HE      MET  39  -6.571   2.005   0.435
  300    HE2  MET  39           1HE      MET  39  -7.570   1.977   1.892
  301    HE3  MET  39           2HE      MET  39  -7.967   3.072   0.560
  302    H    ILE  40           H        ILE  40  -7.889   0.777   3.808
  303    HA   ILE  40           HA       ILE  40  -7.097  -1.452   2.191
  304    HB   ILE  40           HB       ILE  40  -5.811   0.672   3.679
  305   HG12  ILE  40          1HG1      ILE  40  -4.418  -0.940   1.610
  306   HG13  ILE  40          2HG1      ILE  40  -5.899  -0.115   1.134
  307   HG21  ILE  40          1HG2      ILE  40  -5.002  -1.058   5.145
  308   HG22  ILE  40          2HG2      ILE  40  -3.685  -0.517   4.105
  309   HG23  ILE  40          3HG2      ILE  40  -4.504  -2.043   3.771
  310   HD11  ILE  40          3HD1      ILE  40  -3.809   1.155   0.709
  311   HD12  ILE  40          1HD1      ILE  40  -3.580   1.251   2.452
  312   HD13  ILE  40          2HD1      ILE  40  -4.989   1.993   1.711
  313    H    GLU  41           H        GLU  41  -7.642  -0.854   5.642
  314    HA   GLU  41           HA       GLU  41  -6.898  -3.449   6.483
  315    HB2  GLU  41           1HB      GLU  41  -7.322  -1.531   8.020
  316    HB3  GLU  41           2HB      GLU  41  -9.038  -1.637   7.653
  317    HG2  GLU  41           1HG      GLU  41  -9.009  -3.959   8.568
  318    HG3  GLU  41           2HG      GLU  41  -7.345  -3.675   9.079
  319    H    LYS  42           H        LYS  42  -9.658  -2.250   4.795
  320    HA   LYS  42           HA       LYS  42 -11.337  -4.472   5.429
  321    HB2  LYS  42           1HB      LYS  42 -11.640  -2.099   3.634
  322    HB3  LYS  42           2HB      LYS  42 -12.792  -3.429   3.581
  323    HG2  LYS  42           1HG      LYS  42 -13.268  -3.123   5.953
  324    HG3  LYS  42           2HG      LYS  42 -12.101  -1.803   6.020
  325    HD2  LYS  42           1HD      LYS  42 -13.440  -0.498   4.481
  326    HD3  LYS  42           2HD      LYS  42 -14.574  -1.837   4.290
  327    HE2  LYS  42           1HE      LYS  42 -15.100  -1.699   6.691
  328    HE3  LYS  42           2HE      LYS  42 -14.009  -0.324   6.836
  329    HZ1  LYS  42           3HZ      LYS  42 -16.395   0.259   6.618
  330    HZ2  LYS  42           1HZ      LYS  42 -16.373  -0.362   5.047
  331    HZ3  LYS  42           2HZ      LYS  42 -15.411   0.972   5.442
  332    H    PHE  43           H        PHE  43  -9.248  -3.633   2.651
  333    HA   PHE  43           HA       PHE  43 -10.274  -5.569   0.894
  334    HB2  PHE  43           1HB      PHE  43  -8.350  -5.370  -0.437
  335    HB3  PHE  43           2HB      PHE  43  -8.446  -3.810   0.371
  336    HD1  PHE  43           1HD      PHE  43  -6.745  -7.133   0.700
  337    HD2  PHE  43           2HD      PHE  43  -6.541  -2.935   1.297
  338    HE1  PHE  43           1HE      PHE  43  -4.390  -7.348   1.364
  339    HE2  PHE  43           2HE      PHE  43  -4.194  -3.145   1.987
  340    HZ   PHE  43           HZ       PHE  43  -3.115  -5.354   2.021
  341    H    SER  44           H        SER  44  -7.763  -5.946   3.464
  342    HA   SER  44           HA       SER  44  -7.606  -8.769   2.796
  343    HB2  SER  44           1HB      SER  44  -5.836  -8.896   4.367
  344    HB3  SER  44           2HB      SER  44  -5.594  -7.442   3.416
  345    HG   SER  44           HG       SER  44  -5.305  -6.763   5.458
  346    H    GLU  45           H        GLU  45  -9.394  -6.746   4.864
  347    HA   GLU  45           HA       GLU  45 -10.141  -8.425   6.941
  348    HB2  GLU  45           1HB      GLU  45 -10.840  -6.077   6.716
  349    HB3  GLU  45           2HB      GLU  45 -11.889  -6.516   5.378
  350    HG2  GLU  45           1HG      GLU  45 -13.258  -6.275   7.280
  351    HG3  GLU  45           2HG      GLU  45 -13.121  -8.003   6.968
  352    H    GLN  46           H        GLN  46 -11.289  -8.299   3.582
  353    HA   GLN  46           HA       GLN  46 -12.895 -10.668   4.022
  354    HB2  GLN  46           1HB      GLN  46 -12.496  -8.901   1.623
  355    HB3  GLN  46           2HB      GLN  46 -13.350 -10.436   1.519
  356    HG2  GLN  46           1HG      GLN  46 -15.135  -9.128   1.911
  357    HG3  GLN  46           2HG      GLN  46 -14.647  -9.366   3.586
  358   HE21  GLN  46          1HE2      GLN  46 -15.463  -7.481   4.346
  359   HE22  GLN  46          2HE2      GLN  46 -14.824  -5.930   3.927
  360    H    TYR  47           H        TYR  47  -9.891  -9.762   2.372
  361    HA   TYR  47           HA       TYR  47  -9.355 -12.628   2.132
  362    HB2  TYR  47           1HB      TYR  47  -8.156 -12.076  -0.057
  363    HB3  TYR  47           2HB      TYR  47  -9.908 -12.147  -0.052
  364    HD1  TYR  47           2HD      TYR  47  -7.039  -9.771  -0.023
  365    HD2  TYR  47           1HD      TYR  47 -11.200 -10.347  -0.730
  366    HE1  TYR  47           2HE      TYR  47  -7.173  -7.543  -1.088
  367    HE2  TYR  47           1HE      TYR  47 -11.341  -8.122  -1.765
  368    HH   TYR  47           HH       TYR  47  -8.707  -6.394  -2.762
  369    HA   PRO  48           HA       PRO  48  -5.710 -10.904   4.273
  370    HB2  PRO  48           1HB      PRO  48  -5.232 -13.142   5.714
  371    HB3  PRO  48           2HB      PRO  48  -6.388 -11.908   6.219
  372    HG2  PRO  48           1HG      PRO  48  -6.890 -14.519   4.841
  373    HG3  PRO  48           2HG      PRO  48  -7.770 -13.780   6.192
  374    HD2  PRO  48           1HD      PRO  48  -8.665 -13.669   3.642
  375    HD3  PRO  48           2HD      PRO  48  -8.956 -12.365   4.808
  376    H    GLN  49           H        GLN  49  -6.261 -13.166   1.909
  377    HA   GLN  49           HA       GLN  49  -3.841 -14.567   1.781
  378    HB2  GLN  49           1HB      GLN  49  -4.455 -14.970  -0.599
  379    HB3  GLN  49           2HB      GLN  49  -5.703 -15.400   0.558
  380    HG2  GLN  49           1HG      GLN  49  -7.078 -14.141  -0.589
  381    HG3  GLN  49           2HG      GLN  49  -6.126 -12.768  -0.033
  382   HE21  GLN  49          1HE2      GLN  49  -4.663 -11.797  -1.432
  383   HE22  GLN  49          2HE2      GLN  49  -4.650 -12.118  -3.129
  384    H    ALA  50           H        ALA  50  -4.520 -11.311   1.124
  385    HA   ALA  50           HA       ALA  50  -2.041 -11.023  -0.445
  386    HB1  ALA  50           1HB      ALA  50  -3.969  -9.877  -1.383
  387    HB2  ALA  50           2HB      ALA  50  -2.792  -8.699  -0.800
  388    HB3  ALA  50           3HB      ALA  50  -4.238  -9.041   0.147
  389    H    ASP  51           H        ASP  51  -0.462  -9.382   0.297
  390    HA   ASP  51           HA       ASP  51  -0.421  -9.481   3.203
  391    HB2  ASP  51           1HB      ASP  51   1.659  -9.665   1.291
  392    HB3  ASP  51           2HB      ASP  51   1.935  -8.205   2.224
  393    H    PHE  52           H        PHE  52  -0.674  -7.894   4.476
  394    HA   PHE  52           HA       PHE  52  -1.487  -5.332   3.329
  395    HB2  PHE  52           1HB      PHE  52  -2.357  -5.228   5.864
  396    HB3  PHE  52           2HB      PHE  52  -3.282  -5.991   4.581
  397    HD1  PHE  52           2HD      PHE  52  -1.010  -6.628   7.424
  398    HD2  PHE  52           1HD      PHE  52  -3.694  -8.324   4.593
  399    HE1  PHE  52           2HE      PHE  52  -0.980  -8.747   8.670
  400    HE2  PHE  52           1HE      PHE  52  -3.668 -10.447   5.833
  401    HZ   PHE  52           HZ       PHE  52  -2.309 -10.661   7.875
  402    H    TYR  53           H        TYR  53  -0.014  -3.748   3.419
  403    HA   TYR  53           HA       TYR  53   1.386  -3.368   5.972
  404    HB2  TYR  53           1HB      TYR  53   2.709  -3.295   3.246
  405    HB3  TYR  53           2HB      TYR  53   3.455  -2.740   4.738
  406    HD1  TYR  53           2HD      TYR  53   3.941  -4.398   6.548
  407    HD2  TYR  53           1HD      TYR  53   2.685  -5.595   2.664
  408    HE1  TYR  53           2HE      TYR  53   4.795  -6.660   6.978
  409    HE2  TYR  53           1HE      TYR  53   3.533  -7.871   3.079
  410    HH   TYR  53           HH       TYR  53   5.379  -8.878   4.640
  411    H    LYS  54           H        LYS  54   2.020  -1.249   6.424
  412    HA   LYS  54           HA       LYS  54   0.789   0.894   4.812
  413    HB2  LYS  54           1HB      LYS  54   0.348   0.139   7.646
  414    HB3  LYS  54           2HB      LYS  54   0.373   1.850   7.276
  415    HG2  LYS  54           1HG      LYS  54  -1.483   1.476   5.700
  416    HG3  LYS  54           2HG      LYS  54  -1.503  -0.225   6.165
  417    HD2  LYS  54           1HD      LYS  54  -2.084   2.170   7.904
  418    HD3  LYS  54           2HD      LYS  54  -3.213   0.911   7.406
  419    HE2  LYS  54           1HE      LYS  54  -1.900  -0.735   8.691
  420    HE3  LYS  54           2HE      LYS  54  -0.818   0.553   9.208
  421    HZ1  LYS  54           3HZ      LYS  54  -3.723   0.427   9.803
  422    HZ2  LYS  54           1HZ      LYS  54  -2.651   1.624  10.330
  423    HZ3  LYS  54           2HZ      LYS  54  -2.487   0.035  10.885
  424    H    LEU  55           H        LEU  55   1.782   2.998   5.140
  425    HA   LEU  55           HA       LEU  55   3.759   3.309   7.193
  426    HB2  LEU  55           1HB      LEU  55   5.134   2.250   5.519
  427    HB3  LEU  55           2HB      LEU  55   4.574   3.366   4.292
  428    HG   LEU  55           HG       LEU  55   5.968   4.499   6.671
  429   HD11  LEU  55          1HD1      LEU  55   8.136   4.156   5.513
  430   HD12  LEU  55          2HD1      LEU  55   7.324   3.060   4.395
  431   HD13  LEU  55          3HD1      LEU  55   7.417   2.661   6.109
  432   HD21  LEU  55          3HD2      LEU  55   4.875   5.715   4.667
  433   HD22  LEU  55          1HD2      LEU  55   6.312   5.205   3.784
  434   HD23  LEU  55          2HD2      LEU  55   6.470   6.233   5.210
  435    H    ASP  56           H        ASP  56   4.014   5.418   7.792
  436    HA   ASP  56           HA       ASP  56   2.369   7.419   6.461
  437    HB2  ASP  56           1HB      ASP  56   3.987   7.487   9.020
  438    HB3  ASP  56           2HB      ASP  56   3.064   8.841   8.402
  439    H    VAL  57           H        VAL  57   3.277   8.592   4.852
  440    HA   VAL  57           HA       VAL  57   6.067   8.788   4.411
  441    HB   VAL  57           HB       VAL  57   5.578  10.177   2.607
  442   HG11  VAL  57          1HG1      VAL  57   3.659   9.223   1.504
  443   HG12  VAL  57          2HG1      VAL  57   2.974   8.725   3.048
  444   HG13  VAL  57          3HG1      VAL  57   4.457   7.971   2.456
  445   HG21  VAL  57          3HG2      VAL  57   4.576  12.034   3.694
  446   HG22  VAL  57          1HG2      VAL  57   3.165  11.085   4.157
  447   HG23  VAL  57          2HG2      VAL  57   3.431  11.496   2.466
  448    H    ASP  58           H        ASP  58   3.889  10.429   6.445
  449    HA   ASP  58           HA       ASP  58   5.157  12.865   6.931
  450    HB2  ASP  58           1HB      ASP  58   2.976  12.483   7.829
  451    HB3  ASP  58           2HB      ASP  58   3.507  11.041   8.684
  452    H    GLU  59           H        GLU  59   5.722   9.639   8.170
  453    HA   GLU  59           HA       GLU  59   7.929  10.599   9.817
  454    HB2  GLU  59           1HB      GLU  59   6.258   9.023  10.767
  455    HB3  GLU  59           2HB      GLU  59   6.764   7.821   9.588
  456    HG2  GLU  59           1HG      GLU  59   9.009   7.831  10.544
  457    HG3  GLU  59           2HG      GLU  59   8.499   9.032  11.727
  458    H    LEU  60           H        LEU  60   7.281   8.501   7.029
  459    HA   LEU  60           HA       LEU  60  10.195   8.358   6.587
  460    HB2  LEU  60           1HB      LEU  60   8.100   6.289   5.976
  461    HB3  LEU  60           2HB      LEU  60   9.722   6.228   5.332
  462    HG   LEU  60           HG       LEU  60   9.792   4.760   7.119
  463   HD11  LEU  60          1HD1      LEU  60  10.682   7.374   8.310
  464   HD12  LEU  60          2HD1      LEU  60  11.620   6.381   7.196
  465   HD13  LEU  60          3HD1      LEU  60  11.206   5.761   8.794
  466   HD21  LEU  60          3HD2      LEU  60   8.230   6.754   8.743
  467   HD22  LEU  60          1HD2      LEU  60   8.848   5.214   9.335
  468   HD23  LEU  60          2HD2      LEU  60   7.621   5.244   8.069
  469    H    GLY  61           H        GLY  61   9.861  10.383   5.410
  470    HA2  GLY  61           1HA      GLY  61   8.308  10.467   3.024
  471    HA3  GLY  61           2HA      GLY  61   9.574  11.598   3.476
  472    H    ASP  62           H        ASP  62  11.671   9.685   3.709
  473    HA   ASP  62           HA       ASP  62  12.591   9.622   1.047
  474    HB2  ASP  62           1HB      ASP  62  14.174   9.704   2.868
  475    HB3  ASP  62           2HB      ASP  62  13.565   8.187   3.514
  476    H    VAL  63           H        VAL  63  11.043   7.249   3.046
  477    HA   VAL  63           HA       VAL  63  11.422   5.031   1.349
  478    HB   VAL  63           HB       VAL  63   9.154   5.547   3.255
  479   HG11  VAL  63          1HG1      VAL  63  10.145   3.006   1.968
  480   HG12  VAL  63          2HG1      VAL  63   8.600   3.800   1.684
  481   HG13  VAL  63          3HG1      VAL  63   8.943   3.075   3.255
  482   HG21  VAL  63          3HG2      VAL  63  11.671   3.948   3.707
  483   HG22  VAL  63          1HG2      VAL  63  10.412   4.306   4.886
  484   HG23  VAL  63          2HG2      VAL  63  11.439   5.605   4.271
  485    H    ALA  64           H        ALA  64   8.688   7.315   1.672
  486    HA   ALA  64           HA       ALA  64   7.044   6.320  -0.302
  487    HB1  ALA  64           1HB      ALA  64   6.158   8.591  -0.513
  488    HB2  ALA  64           2HB      ALA  64   7.551   9.215   0.371
  489    HB3  ALA  64           3HB      ALA  64   6.401   8.147   1.178
  490    H    GLN  65           H        GLN  65   9.887   8.361  -0.590
  491    HA   GLN  65           HA       GLN  65   9.522   8.833  -3.408
  492    HB2  GLN  65           1HB      GLN  65  11.933   9.256  -1.631
  493    HB3  GLN  65           2HB      GLN  65  11.789   9.827  -3.289
  494    HG2  GLN  65           1HG      GLN  65   9.995  10.638  -1.011
  495    HG3  GLN  65           2HG      GLN  65  11.342  11.588  -1.641
  496   HE21  GLN  65          1HE2      GLN  65   8.119  10.425  -2.252
  497   HE22  GLN  65          2HE2      GLN  65   7.781  11.456  -3.603
  498    H    LYS  66           H        LYS  66  11.195   6.511  -1.440
  499    HA   LYS  66           HA       LYS  66  12.784   5.287  -3.370
  500    HB2  LYS  66           1HB      LYS  66  13.390   4.306  -1.441
  501    HB3  LYS  66           2HB      LYS  66  11.909   4.839  -0.659
  502    HG2  LYS  66           1HG      LYS  66  11.832   2.569  -0.395
  503    HG3  LYS  66           2HG      LYS  66  10.820   2.837  -1.806
  504    HD2  LYS  66           1HD      LYS  66  12.258   0.914  -2.154
  505    HD3  LYS  66           2HD      LYS  66  12.698   2.214  -3.260
  506    HE2  LYS  66           1HE      LYS  66  14.629   2.750  -2.016
  507    HE3  LYS  66           2HE      LYS  66  14.101   1.786  -0.637
  508    HZ1  LYS  66           3HZ      LYS  66  14.860   0.709  -3.296
  509    HZ2  LYS  66           1HZ      LYS  66  14.372  -0.207  -1.955
  510    HZ3  LYS  66           2HZ      LYS  66  15.825   0.668  -1.906
  511    H    ASN  67           H        ASN  67   9.355   5.223  -2.887
  512    HA   ASN  67           HA       ASN  67   9.072   2.690  -4.346
  513    HB2  ASN  67           1HB      ASN  67   6.946   4.200  -2.865
  514    HB3  ASN  67           2HB      ASN  67   6.926   2.525  -3.365
  515   HD21  ASN  67          1HD2      ASN  67   6.892   4.218  -0.804
  516   HD22  ASN  67          2HD2      ASN  67   7.884   3.312   0.252
  517    H    GLU  68           H        GLU  68   8.789   6.017  -4.670
  518    HA   GLU  68           HA       GLU  68   8.154   7.316  -6.417
  519    HB2  GLU  68           1HB      GLU  68   6.975   4.791  -7.581
  520    HB3  GLU  68           2HB      GLU  68   7.008   6.362  -8.390
  521    HG2  GLU  68           1HG      GLU  68   9.391   6.342  -8.509
  522    HG3  GLU  68           2HG      GLU  68   9.480   4.906  -7.488
  523    H    VAL  69           H        VAL  69   6.634   6.692  -3.982
  524    HA   VAL  69           HA       VAL  69   4.037   7.653  -4.953
  525    HB   VAL  69           HB       VAL  69   3.473   5.863  -3.591
  526   HG11  VAL  69          1HG1      VAL  69   5.715   5.451  -2.638
  527   HG12  VAL  69          2HG1      VAL  69   4.412   5.268  -1.472
  528   HG13  VAL  69          3HG1      VAL  69   5.420   6.721  -1.452
  529   HG21  VAL  69          3HG2      VAL  69   2.204   7.817  -2.966
  530   HG22  VAL  69          1HG2      VAL  69   3.431   8.269  -1.783
  531   HG23  VAL  69          2HG2      VAL  69   2.480   6.804  -1.549
  532    H    SER  70           H        SER  70   4.047   9.766  -5.117
  533    HA   SER  70           HA       SER  70   5.271  11.339  -2.952
  534    HB2  SER  70           1HB      SER  70   4.885  12.086  -5.861
  535    HB3  SER  70           2HB      SER  70   5.548  13.151  -4.620
  536    HG   SER  70           HG       SER  70   6.693  10.948  -5.889
  537    H    ALA  71           H        ALA  71   2.383  10.465  -4.429
  538    HA   ALA  71           HA       ALA  71   0.976  12.776  -3.278
  539    HB1  ALA  71           1HB      ALA  71  -0.956  12.045  -4.604
  540    HB2  ALA  71           2HB      ALA  71  -0.014  10.689  -5.223
  541    HB3  ALA  71           3HB      ALA  71   0.452  12.342  -5.622
  542    H    MET  72           H        MET  72  -0.592  12.449  -1.695
  543    HA   MET  72           HA       MET  72  -0.861   9.693  -0.715
  544    HB2  MET  72           1HB      MET  72  -0.374  12.129   1.013
  545    HB3  MET  72           2HB      MET  72  -0.727  10.515   1.612
  546    HG2  MET  72           1HG      MET  72   1.563  10.640   1.818
  547    HG3  MET  72           2HG      MET  72   1.364   9.809   0.277
  548    HE1  MET  72           3HE      MET  72   4.148  10.935   0.881
  549    HE2  MET  72           1HE      MET  72   4.525  11.848  -0.581
  550    HE3  MET  72           2HE      MET  72   3.710  10.289  -0.699
  551    HA   PRO  73           HA       PRO  73  -1.854   8.631   0.671
  552    HB2  PRO  73           1HB      PRO  73  -3.966   6.955   0.705
  553    HB3  PRO  73           2HB      PRO  73  -3.607   8.071   2.023
  554    HG2  PRO  73           1HG      PRO  73  -5.688   8.230  -0.090
  555    HG3  PRO  73           2HG      PRO  73  -5.738   8.821   1.591
  556    HD2  PRO  73           1HD      PRO  73  -5.253  10.371  -0.703
  557    HD3  PRO  73           2HD      PRO  73  -4.927  10.853   0.970
  558    H    THR  74           H        THR  74  -1.511   6.498  -0.266
  559    HA   THR  74           HA       THR  74  -2.307   6.092  -3.041
  560    HB   THR  74           HB       THR  74   0.488   6.764  -2.156
  561    HG1  THR  74           1HG      THR  74  -0.046   8.437  -3.300
  562   HG21  THR  74          3HG2      THR  74  -0.191   5.130  -4.610
  563   HG22  THR  74          1HG2      THR  74   0.745   4.592  -3.211
  564   HG23  THR  74          2HG2      THR  74   1.382   5.858  -4.258
  565    H    LEU  75           H        LEU  75  -2.400   4.019  -3.579
  566    HA   LEU  75           HA       LEU  75  -1.346   2.022  -1.681
  567    HB2  LEU  75           1HB      LEU  75  -3.356   1.703  -3.906
  568    HB3  LEU  75           2HB      LEU  75  -2.877   0.458  -2.768
  569    HG   LEU  75           HG       LEU  75  -3.802   2.366  -1.074
  570   HD11  LEU  75          1HD1      LEU  75  -4.522   3.814  -2.946
  571   HD12  LEU  75          2HD1      LEU  75  -5.879   3.269  -1.963
  572   HD13  LEU  75          3HD1      LEU  75  -5.571   2.519  -3.528
  573   HD21  LEU  75          3HD2      LEU  75  -4.373   0.059  -0.958
  574   HD22  LEU  75          1HD2      LEU  75  -5.282   0.149  -2.469
  575   HD23  LEU  75          2HD2      LEU  75  -5.872   0.985  -1.036
  576    H    LEU  76           H        LEU  76   0.360   0.796  -2.353
  577    HA   LEU  76           HA       LEU  76   0.850   0.657  -5.252
  578    HB2  LEU  76           1HB      LEU  76   2.567   1.604  -3.210
  579    HB3  LEU  76           2HB      LEU  76   3.222   0.074  -3.757
  580    HG   LEU  76           HG       LEU  76   2.601   2.443  -5.526
  581   HD11  LEU  76          1HD1      LEU  76   4.537   2.787  -4.039
  582   HD12  LEU  76          2HD1      LEU  76   5.000   2.712  -5.746
  583   HD13  LEU  76          3HD1      LEU  76   5.273   1.319  -4.686
  584   HD21  LEU  76          3HD2      LEU  76   2.292   0.307  -6.674
  585   HD22  LEU  76          1HD2      LEU  76   3.904  -0.201  -6.178
  586   HD23  LEU  76          2HD2      LEU  76   3.710   1.160  -7.283
  587    H    LEU  77           H        LEU  77   0.400  -1.258  -6.017
  588    HA   LEU  77           HA       LEU  77   0.521  -3.624  -4.281
  589    HB2  LEU  77           1HB      LEU  77  -0.728  -3.099  -6.980
  590    HB3  LEU  77           2HB      LEU  77  -0.601  -4.704  -6.303
  591    HG   LEU  77           HG       LEU  77  -2.321  -4.360  -4.793
  592   HD11  LEU  77          1HD1      LEU  77  -3.102  -2.185  -4.005
  593   HD12  LEU  77          2HD1      LEU  77  -1.905  -1.372  -5.015
  594   HD13  LEU  77          3HD1      LEU  77  -1.383  -2.384  -3.669
  595   HD21  LEU  77          3HD2      LEU  77  -4.112  -3.275  -5.982
  596   HD22  LEU  77          1HD2      LEU  77  -3.095  -4.187  -7.106
  597   HD23  LEU  77          2HD2      LEU  77  -2.953  -2.424  -7.009
  598    H    PHE  78           H        PHE  78   2.032  -5.193  -4.603
  599    HA   PHE  78           HA       PHE  78   3.681  -5.003  -7.034
  600    HB2  PHE  78           1HB      PHE  78   4.580  -5.222  -4.181
  601    HB3  PHE  78           2HB      PHE  78   5.590  -5.799  -5.499
  602    HD1  PHE  78           1HD      PHE  78   4.020  -2.818  -4.018
  603    HD2  PHE  78           2HD      PHE  78   6.790  -4.301  -6.879
  604    HE1  PHE  78           1HE      PHE  78   4.923  -0.559  -4.322
  605    HE2  PHE  78           2HE      PHE  78   7.693  -2.037  -7.191
  606    HZ   PHE  78           HZ       PHE  78   6.760  -0.159  -5.906
  607    H    LYS  79           H        LYS  79   4.537  -6.968  -7.852
  608    HA   LYS  79           HA       LYS  79   3.886  -9.414  -6.304
  609    HB2  LYS  79           1HB      LYS  79   2.630  -9.091  -8.561
  610    HB3  LYS  79           2HB      LYS  79   4.211  -9.403  -9.283
  611    HG2  LYS  79           1HG      LYS  79   2.936 -11.433  -9.252
  612    HG3  LYS  79           2HG      LYS  79   4.315 -11.565  -8.163
  613    HD2  LYS  79           1HD      LYS  79   2.418 -12.532  -7.081
  614    HD3  LYS  79           2HD      LYS  79   2.785 -11.011  -6.273
  615    HE2  LYS  79           1HE      LYS  79   0.409 -11.181  -6.559
  616    HE3  LYS  79           2HE      LYS  79   1.019  -9.923  -7.633
  617    HZ1  LYS  79           3HZ      LYS  79   0.311 -12.697  -8.415
  618    HZ2  LYS  79           1HZ      LYS  79   0.957 -11.532  -9.455
  619    HZ3  LYS  79           2HZ      LYS  79  -0.574 -11.301  -8.773
  620    H    ASN  80           H        ASN  80   5.826  -9.937  -5.426
  621    HA   ASN  80           HA       ASN  80   7.890 -10.901  -5.364
  622    HB2  ASN  80           1HB      ASN  80   6.827 -12.467  -6.851
  623    HB3  ASN  80           2HB      ASN  80   7.127 -11.424  -8.227
  624   HD21  ASN  80          1HD2      ASN  80   8.191 -12.849  -9.385
  625   HD22  ASN  80          2HD2      ASN  80   9.764 -13.472  -8.986
  626    H    GLY  81           H        GLY  81   8.243  -8.311  -5.342
  627    HA2  GLY  81           1HA      GLY  81   9.966  -6.790  -5.599
  628    HA3  GLY  81           2HA      GLY  81  10.811  -7.994  -6.568
  629    H    LYS  82           H        LYS  82   7.689  -7.410  -7.704
  630    HA   LYS  82           HA       LYS  82   8.575  -5.283  -9.537
  631    HB2  LYS  82           1HB      LYS  82   6.812  -7.601 -10.354
  632    HB3  LYS  82           2HB      LYS  82   7.464  -6.346 -11.394
  633    HG2  LYS  82           1HG      LYS  82   9.720  -7.224 -11.023
  634    HG3  LYS  82           2HG      LYS  82   9.044  -8.500 -10.008
  635    HD2  LYS  82           1HD      LYS  82   8.495  -8.047 -12.939
  636    HD3  LYS  82           2HD      LYS  82   9.449  -9.352 -12.239
  637    HE2  LYS  82           1HE      LYS  82   6.489  -8.886 -11.901
  638    HE3  LYS  82           2HE      LYS  82   7.254 -10.175 -12.825
  639    HZ1  LYS  82           3HZ      LYS  82   8.218 -10.989 -10.722
  640    HZ2  LYS  82           1HZ      LYS  82   6.526 -11.031 -10.729
  641    HZ3  LYS  82           2HZ      LYS  82   7.337  -9.814  -9.879
  642    H    GLU  83           H        GLU  83   6.715  -4.026 -10.361
  643    HA   GLU  83           HA       GLU  83   4.715  -3.637  -8.364
  644    HB2  GLU  83           1HB      GLU  83   5.735  -1.884  -9.911
  645    HB3  GLU  83           2HB      GLU  83   4.731  -2.553 -11.187
  646    HG2  GLU  83           1HG      GLU  83   2.727  -1.931 -10.026
  647    HG3  GLU  83           2HG      GLU  83   3.663  -1.433  -8.610
  648    H    VAL  84           H        VAL  84   2.330  -3.531  -9.126
  649    HA   VAL  84           HA       VAL  84   1.700  -5.100 -11.467
  650    HB   VAL  84           HB       VAL  84  -0.325  -6.074 -10.115
  651   HG11  VAL  84          1HG1      VAL  84   2.394  -7.350  -9.910
  652   HG12  VAL  84          2HG1      VAL  84   1.388  -7.356 -11.361
  653   HG13  VAL  84          3HG1      VAL  84   0.827  -8.165  -9.897
  654   HG21  VAL  84          3HG2      VAL  84   0.360  -6.802  -7.875
  655   HG22  VAL  84          1HG2      VAL  84   0.227  -5.049  -8.009
  656   HG23  VAL  84          2HG2      VAL  84   1.815  -5.815  -8.025
  657    H    ALA  85           H        ALA  85   0.753  -2.908  -8.915
  658    HA   ALA  85           HA       ALA  85  -0.604  -1.247 -10.757
  659    HB1  ALA  85           1HB      ALA  85  -2.852  -1.354  -9.731
  660    HB2  ALA  85           2HB      ALA  85  -2.315  -2.746  -8.789
  661    HB3  ALA  85           3HB      ALA  85  -2.389  -2.846 -10.546
  662    H    LYS  86           H        LYS  86  -1.250   0.771  -9.875
  663    HA   LYS  86           HA       LYS  86  -0.776   1.221  -7.046
  664    HB2  LYS  86           1HB      LYS  86   0.706   3.153  -7.473
  665    HB3  LYS  86           2HB      LYS  86   1.430   1.629  -7.953
  666    HG2  LYS  86           1HG      LYS  86   0.872   2.107 -10.290
  667    HG3  LYS  86           2HG      LYS  86   0.170   3.649  -9.797
  668    HD2  LYS  86           1HD      LYS  86   3.046   2.821  -9.402
  669    HD3  LYS  86           2HD      LYS  86   2.459   3.908 -10.660
  670    HE2  LYS  86           1HE      LYS  86   1.664   5.458  -8.925
  671    HE3  LYS  86           2HE      LYS  86   2.286   4.375  -7.683
  672    HZ1  LYS  86           3HZ      LYS  86   3.942   5.681  -9.769
  673    HZ2  LYS  86           1HZ      LYS  86   4.505   4.724  -8.494
  674    HZ3  LYS  86           2HZ      LYS  86   3.795   6.228  -8.176
  675    H    VAL  87           H        VAL  87  -2.087   2.759  -6.220
  676    HA   VAL  87           HA       VAL  87  -3.612   4.411  -8.118
  677    HB   VAL  87           HB       VAL  87  -4.892   3.014  -5.764
  678   HG11  VAL  87          1HG1      VAL  87  -6.071   4.533  -8.088
  679   HG12  VAL  87          2HG1      VAL  87  -5.967   5.095  -6.419
  680   HG13  VAL  87          3HG1      VAL  87  -6.987   3.715  -6.823
  681   HG21  VAL  87          3HG2      VAL  87  -4.251   1.330  -7.390
  682   HG22  VAL  87          1HG2      VAL  87  -5.010   2.258  -8.682
  683   HG23  VAL  87          2HG2      VAL  87  -6.001   1.554  -7.404
  684    H    VAL  88           H        VAL  88  -3.510   6.485  -7.578
  685    HA   VAL  88           HA       VAL  88  -2.425   7.212  -4.987
  686    HB   VAL  88           HB       VAL  88  -2.442   9.554  -5.936
  687   HG11  VAL  88          1HG1      VAL  88  -0.442   8.177  -5.965
  688   HG12  VAL  88          2HG1      VAL  88  -0.546   9.133  -7.445
  689   HG13  VAL  88          3HG1      VAL  88  -0.963   7.420  -7.471
  690   HG21  VAL  88          3HG2      VAL  88  -3.172   8.119  -8.490
  691   HG22  VAL  88          1HG2      VAL  88  -2.750   9.823  -8.335
  692   HG23  VAL  88          2HG2      VAL  88  -4.230   9.211  -7.596
  693    H    GLY  89           H        GLY  89  -4.726   6.181  -4.360
  694    HA2  GLY  89           1HA      GLY  89  -6.093   7.889  -2.814
  695    HA3  GLY  89           2HA      GLY  89  -6.853   8.148  -4.379
  696    H    ALA  90           H        ALA  90  -7.604   6.802  -1.695
  697    HA   ALA  90           HA       ALA  90  -8.021   4.065  -2.252
  698    HB1  ALA  90           1HB      ALA  90  -9.442   5.877  -0.341
  699    HB2  ALA  90           2HB      ALA  90  -7.989   4.947  -0.010
  700    HB3  ALA  90           3HB      ALA  90  -9.514   4.115  -0.327
  701    H    ASN  91           H        ASN  91  -9.384   3.206  -3.619
  702    HA   ASN  91           HA       ASN  91 -11.945   4.567  -4.076
  703    HB2  ASN  91           1HB      ASN  91 -10.107   4.069  -5.976
  704    HB3  ASN  91           2HB      ASN  91 -10.974   2.537  -6.010
  705   HD21  ASN  91          1HD2      ASN  91 -12.595   5.504  -5.157
  706   HD22  ASN  91          2HD2      ASN  91 -13.537   5.635  -6.600
  707    HA   PRO  92           HA       PRO  92 -12.960   1.499  -0.914
  708    HB2  PRO  92           1HB      PRO  92 -15.501   1.862  -2.464
  709    HB3  PRO  92           2HB      PRO  92 -15.269   1.702  -0.719
  710    HG2  PRO  92           1HG      PRO  92 -15.487   4.111  -2.011
  711    HG3  PRO  92           2HG      PRO  92 -14.641   3.883  -0.473
  712    HD2  PRO  92           1HD      PRO  92 -13.520   4.633  -2.999
  713    HD3  PRO  92           2HD      PRO  92 -12.666   4.367  -1.479
  714    H    ALA  93           H        ALA  93 -15.022   0.677  -3.697
  715    HA   ALA  93           HA       ALA  93 -14.435  -2.126  -3.186
  716    HB1  ALA  93           1HB      ALA  93 -16.330  -0.853  -5.161
  717    HB2  ALA  93           2HB      ALA  93 -16.744  -1.405  -3.539
  718    HB3  ALA  93           3HB      ALA  93 -16.242  -2.568  -4.765
  719    H    ALA  94           H        ALA  94 -13.736   0.280  -5.641
  720    HA   ALA  94           HA       ALA  94 -12.904  -1.483  -7.680
  721    HB1  ALA  94           1HB      ALA  94 -11.781   0.427  -8.657
  722    HB2  ALA  94           2HB      ALA  94 -11.923   1.313  -7.141
  723    HB3  ALA  94           3HB      ALA  94 -13.371   0.900  -8.059
  724    H    ILE  95           H        ILE  95 -11.264  -0.166  -4.870
  725    HA   ILE  95           HA       ILE  95  -8.688  -1.144  -5.574
  726    HB   ILE  95           HB       ILE  95  -9.833  -0.409  -2.881
  727   HG12  ILE  95          1HG1      ILE  95  -9.601   1.485  -4.398
  728   HG13  ILE  95          2HG1      ILE  95  -8.390   1.585  -3.125
  729   HG21  ILE  95          1HG2      ILE  95  -7.004  -1.121  -3.630
  730   HG22  ILE  95          2HG2      ILE  95  -8.073  -2.031  -2.563
  731   HG23  ILE  95          3HG2      ILE  95  -7.499  -0.434  -2.082
  732   HD11  ILE  95          3HD1      ILE  95  -6.722   0.668  -4.692
  733   HD12  ILE  95          1HD1      ILE  95  -7.416   2.199  -5.230
  734   HD13  ILE  95          2HD1      ILE  95  -7.948   0.686  -5.961
  735    H    LYS  96           H        LYS  96 -11.356  -2.407  -3.603
  736    HA   LYS  96           HA       LYS  96 -10.029  -4.737  -2.743
  737    HB2  LYS  96           1HB      LYS  96 -12.998  -4.697  -3.265
  738    HB3  LYS  96           2HB      LYS  96 -12.095  -5.534  -1.987
  739    HG2  LYS  96           1HG      LYS  96 -12.365  -2.551  -2.137
  740    HG3  LYS  96           2HG      LYS  96 -13.485  -3.592  -1.262
  741    HD2  LYS  96           1HD      LYS  96 -11.595  -4.446   0.069
  742    HD3  LYS  96           2HD      LYS  96 -10.526  -3.316  -0.768
  743    HE2  LYS  96           1HE      LYS  96 -11.237  -2.442   1.403
  744    HE3  LYS  96           2HE      LYS  96 -11.827  -1.443   0.075
  745    HZ1  LYS  96           3HZ      LYS  96 -13.417  -3.487   1.534
  746    HZ2  LYS  96           1HZ      LYS  96 -13.977  -2.523   0.264
  747    HZ3  LYS  96           2HZ      LYS  96 -13.542  -1.813   1.732
  748    H    GLN  97           H        GLN  97 -11.864  -3.948  -5.624
  749    HA   GLN  97           HA       GLN  97 -11.748  -6.516  -6.824
  750    HB2  GLN  97           1HB      GLN  97 -13.320  -4.767  -7.559
  751    HB3  GLN  97           2HB      GLN  97 -11.972  -3.778  -8.103
  752    HG2  GLN  97           1HG      GLN  97 -11.373  -5.692  -9.647
  753    HG3  GLN  97           2HG      GLN  97 -12.945  -6.377  -9.241
  754   HE21  GLN  97          1HE2      GLN  97 -11.939  -5.463 -11.798
  755   HE22  GLN  97          2HE2      GLN  97 -13.022  -4.227 -12.338
  756    H    ALA  98           H        ALA  98  -9.582  -3.733  -6.791
  757    HA   ALA  98           HA       ALA  98  -7.880  -4.495  -8.890
  758    HB1  ALA  98           1HB      ALA  98  -7.834  -2.268  -7.879
  759    HB2  ALA  98           2HB      ALA  98  -6.241  -3.021  -7.884
  760    HB3  ALA  98           3HB      ALA  98  -7.184  -2.961  -6.395
  761    H    ILE  99           H        ILE  99  -7.441  -4.865  -5.411
  762    HA   ILE  99           HA       ILE  99  -5.113  -6.298  -5.361
  763    HB   ILE  99           HB       ILE  99  -7.363  -7.019  -3.484
  764   HG12  ILE  99          1HG1      ILE  99  -7.570  -4.679  -3.464
  765   HG13  ILE  99          2HG1      ILE  99  -6.522  -5.043  -2.095
  766   HG21  ILE  99          1HG2      ILE  99  -4.379  -6.763  -3.198
  767   HG22  ILE  99          2HG2      ILE  99  -5.333  -8.246  -3.173
  768   HG23  ILE  99          3HG2      ILE  99  -5.479  -7.079  -1.860
  769   HD11  ILE  99          3HD1      ILE  99  -5.722  -3.994  -4.785
  770   HD12  ILE  99          1HD1      ILE  99  -4.582  -4.499  -3.530
  771   HD13  ILE  99          2HD1      ILE  99  -5.672  -3.142  -3.235
  772    H    ALA 100           H        ALA 100  -8.381  -7.455  -6.008
  773    HA   ALA 100           HA       ALA 100  -7.691 -10.243  -5.876
  774    HB1  ALA 100           1HB      ALA 100  -9.942  -9.455  -5.335
  775    HB2  ALA 100           2HB      ALA 100  -9.964 -10.636  -6.645
  776    HB3  ALA 100           3HB      ALA 100 -10.153  -8.920  -7.003
  777    H    ALA 101           H        ALA 101  -7.472  -7.806  -8.308
  778    HA   ALA 101           HA       ALA 101  -7.615  -9.711 -10.504
  779    HB1  ALA 101           1HB      ALA 101  -7.426  -7.756 -11.941
  780    HB2  ALA 101           2HB      ALA 101  -7.123  -6.734 -10.535
  781    HB3  ALA 101           3HB      ALA 101  -8.694  -7.514 -10.739
  782    H    ASN 102           H        ASN 102  -5.327  -7.838  -8.670
  783    HA   ASN 102           HA       ASN 102  -3.155  -8.576 -10.456
  784    HB2  ASN 102           1HB      ASN 102  -1.810  -7.207  -8.674
  785    HB3  ASN 102           2HB      ASN 102  -2.812  -6.413  -9.846
  786   HD21  ASN 102          1HD2      ASN 102  -4.469  -5.164  -9.216
  787   HD22  ASN 102          2HD2      ASN 102  -4.821  -4.859  -7.562
  788    H    ALA 103           H        ALA 103  -4.626  -9.795  -7.667
  789    HA   ALA 103           HA       ALA 103  -2.308 -11.079  -6.577
  790    HB1  ALA 103           1HB      ALA 103  -4.254 -10.572  -5.178
  791    HB2  ALA 103           2HB      ALA 103  -3.870 -12.293  -5.160
  792    HB3  ALA 103           3HB      ALA 103  -5.224 -11.702  -6.123
  Start of MODEL   11
    1    H1   MET   1           1H       MET   1  -5.331  -6.995  10.708
    2    H2   MET   1           2H       MET   1  -6.209  -5.969   9.692
    3    H3   MET   1           3H       MET   1  -6.577  -6.043  11.339
    4    HA   MET   1           HA       MET   1  -5.360  -4.042  10.834
    5    HB2  MET   1           1HB      MET   1  -5.059  -5.110  13.027
    6    HB3  MET   1           2HB      MET   1  -3.732  -6.065  12.382
    7    HG2  MET   1           1HG      MET   1  -2.387  -4.121  12.072
    8    HG3  MET   1           2HG      MET   1  -3.740  -3.059  12.460
    9    HE1  MET   1           3HE      MET   1  -4.801  -2.815  14.815
   10    HE2  MET   1           1HE      MET   1  -4.264  -3.679  16.257
   11    HE3  MET   1           2HE      MET   1  -5.067  -4.551  14.952
   12    H    VAL   2           H        VAL   2  -3.757  -3.020   9.750
   13    HA   VAL   2           HA       VAL   2  -2.263  -4.666   7.848
   14    HB   VAL   2           HB       VAL   2  -3.111  -1.773   7.837
   15   HG11  VAL   2          1HG1      VAL   2  -0.881  -1.901   6.870
   16   HG12  VAL   2          2HG1      VAL   2  -2.087  -1.597   5.620
   17   HG13  VAL   2          3HG1      VAL   2  -1.403  -3.211   5.812
   18   HG21  VAL   2          3HG2      VAL   2  -3.768  -4.026   5.958
   19   HG22  VAL   2          1HG2      VAL   2  -4.460  -2.410   5.966
   20   HG23  VAL   2          2HG2      VAL   2  -4.784  -3.515   7.300
   21    H    THR   3           H        THR   3  -0.092  -4.742   7.824
   22    HA   THR   3           HA       THR   3   1.188  -4.164  10.301
   23    HB   THR   3           HB       THR   3   2.526  -5.165   7.791
   24    HG1  THR   3           1HG      THR   3   0.779  -6.457   9.611
   25   HG21  THR   3          3HG2      THR   3   3.051  -5.678  10.725
   26   HG22  THR   3          1HG2      THR   3   4.014  -4.642   9.671
   27   HG23  THR   3          2HG2      THR   3   3.947  -6.380   9.378
   28    H    GLN   4           H        GLN   4   2.913  -2.909  10.779
   29    HA   GLN   4           HA       GLN   4   3.179  -0.443   9.282
   30    HB2  GLN   4           1HB      GLN   4   3.878  -1.420  11.995
   31    HB3  GLN   4           2HB      GLN   4   4.762  -0.042  11.376
   32    HG2  GLN   4           1HG      GLN   4   1.767  -0.186  11.493
   33    HG3  GLN   4           2HG      GLN   4   2.768   0.475  12.792
   34   HE21  GLN   4          1HE2      GLN   4   1.922   0.780   9.439
   35   HE22  GLN   4          2HE2      GLN   4   2.347   2.434   9.283
   36    H    PHE   5           H        PHE   5   4.911   0.197   8.148
   37    HA   PHE   5           HA       PHE   5   7.413  -1.374   8.253
   38    HB2  PHE   5           1HB      PHE   5   6.383   0.731   6.341
   39    HB3  PHE   5           2HB      PHE   5   8.062   0.222   6.358
   40    HD1  PHE   5           2HD      PHE   5   7.435  -2.754   6.893
   41    HD2  PHE   5           1HD      PHE   5   5.908   0.102   4.134
   42    HE1  PHE   5           2HE      PHE   5   6.914  -4.563   5.312
   43    HE2  PHE   5           1HE      PHE   5   5.385  -1.701   2.551
   44    HZ   PHE   5           HZ       PHE   5   5.890  -4.035   3.139
   45    H    LYS   6           H        LYS   6   9.347  -0.364   8.915
   46    HA   LYS   6           HA       LYS   6   9.118   2.485   9.572
   47    HB2  LYS   6           1HB      LYS   6  10.529   2.191  11.534
   48    HB3  LYS   6           2HB      LYS   6   9.075   1.219  11.654
   49    HG2  LYS   6           1HG      LYS   6  10.390  -0.758  10.969
   50    HG3  LYS   6           2HG      LYS   6  11.842   0.247  10.991
   51    HD2  LYS   6           1HD      LYS   6  11.478   0.731  13.359
   52    HD3  LYS   6           2HD      LYS   6  10.014  -0.252  13.341
   53    HE2  LYS   6           1HE      LYS   6  11.805  -1.543  14.287
   54    HE3  LYS   6           2HE      LYS   6  11.393  -2.211  12.709
   55    HZ1  LYS   6           3HZ      LYS   6  13.788  -2.063  13.046
   56    HZ2  LYS   6           1HZ      LYS   6  13.673  -0.388  13.251
   57    HZ3  LYS   6           2HZ      LYS   6  13.293  -1.086  11.761
   58    H    THR   7           H        THR   7  10.499   0.294   7.623
   59    HA   THR   7           HA       THR   7  12.650   2.178   6.980
   60    HB   THR   7           HB       THR   7  14.152   0.212   6.430
   61    HG1  THR   7           1HG      THR   7  12.196  -1.128   8.020
   62   HG21  THR   7          3HG2      THR   7  14.576   1.598   8.383
   63   HG22  THR   7          1HG2      THR   7  14.922  -0.092   8.746
   64   HG23  THR   7          2HG2      THR   7  13.431   0.646   9.327
   65    H    ALA   8           H        ALA   8  13.375   2.059   4.770
   66    HA   ALA   8           HA       ALA   8  11.322   1.388   2.901
   67    HB1  ALA   8           1HB      ALA   8  14.192   2.091   2.328
   68    HB2  ALA   8           2HB      ALA   8  12.898   3.262   2.561
   69    HB3  ALA   8           3HB      ALA   8  12.838   2.147   1.203
   70    H    SER   9           H        SER   9  14.240  -0.113   4.073
   71    HA   SER   9           HA       SER   9  14.489  -2.213   2.259
   72    HB2  SER   9           1HB      SER   9  14.962  -2.333   5.248
   73    HB3  SER   9           2HB      SER   9  15.689  -3.374   4.023
   74    HG   SER   9           HG       SER   9  16.415  -1.180   3.138
   75    H    GLU  10           H        GLU  10  12.505  -1.938   5.196
   76    HA   GLU  10           HA       GLU  10  11.169  -4.337   5.122
   77    HB2  GLU  10           1HB      GLU  10  10.577  -1.614   6.118
   78    HB3  GLU  10           2HB      GLU  10   9.242  -2.751   6.036
   79    HG2  GLU  10           1HG      GLU  10  10.445  -4.300   7.399
   80    HG3  GLU  10           2HG      GLU  10  11.847  -3.245   7.437
   81    H    PHE  11           H        PHE  11  10.258  -1.286   3.452
   82    HA   PHE  11           HA       PHE  11   7.905  -2.243   2.285
   83    HB2  PHE  11           1HB      PHE  11   8.691   0.141   2.207
   84    HB3  PHE  11           2HB      PHE  11   9.874  -0.328   0.991
   85    HD1  PHE  11           2HD      PHE  11   8.964  -1.346  -1.193
   86    HD2  PHE  11           1HD      PHE  11   6.551   0.793   1.582
   87    HE1  PHE  11           2HE      PHE  11   7.300  -0.929  -2.959
   88    HE2  PHE  11           1HE      PHE  11   4.888   1.223  -0.192
   89    HZ   PHE  11           HZ       PHE  11   5.265   0.353  -2.454
   90    H    ASP  12           H        ASP  12  11.128  -2.114   0.883
   91    HA   ASP  12           HA       ASP  12  10.604  -3.496  -1.488
   92    HB2  ASP  12           1HB      ASP  12  12.620  -2.144  -1.029
   93    HB3  ASP  12           2HB      ASP  12  13.177  -3.364   0.107
   94    H    SER  13           H        SER  13  11.368  -4.679   1.729
   95    HA   SER  13           HA       SER  13  11.978  -7.341   1.040
   96    HB2  SER  13           1HB      SER  13  12.515  -6.298   3.236
   97    HB3  SER  13           2HB      SER  13  10.796  -6.307   3.629
   98    HG   SER  13           HG       SER  13  12.434  -8.571   3.110
   99    H    ALA  14           H        ALA  14   8.949  -5.847   2.182
  100    HA   ALA  14           HA       ALA  14   7.382  -8.161   1.997
  101    HB1  ALA  14           1HB      ALA  14   6.490  -5.292   1.732
  102    HB2  ALA  14           2HB      ALA  14   6.673  -6.176   3.248
  103    HB3  ALA  14           3HB      ALA  14   5.451  -6.679   2.077
  104    H    ILE  15           H        ILE  15   8.299  -5.726  -0.323
  105    HA   ILE  15           HA       ILE  15   6.527  -6.374  -2.402
  106    HB   ILE  15           HB       ILE  15   9.340  -5.345  -2.648
  107   HG12  ILE  15          1HG1      ILE  15   8.258  -3.769  -1.301
  108   HG13  ILE  15          2HG1      ILE  15   8.115  -3.142  -2.939
  109   HG21  ILE  15          1HG2      ILE  15   8.872  -4.665  -4.801
  110   HG22  ILE  15          2HG2      ILE  15   7.132  -4.799  -4.567
  111   HG23  ILE  15          3HG2      ILE  15   8.112  -6.257  -4.707
  112   HD11  ILE  15          3HD1      ILE  15   5.966  -4.605  -1.424
  113   HD12  ILE  15          1HD1      ILE  15   5.827  -3.967  -3.062
  114   HD13  ILE  15          2HD1      ILE  15   6.044  -2.865  -1.704
  115    H    ALA  16           H        ALA  16   9.657  -7.673  -1.480
  116    HA   ALA  16           HA       ALA  16   9.971  -9.213  -3.889
  117    HB1  ALA  16           1HB      ALA  16  11.897  -8.258  -2.706
  118    HB2  ALA  16           2HB      ALA  16  12.028 -10.008  -2.877
  119    HB3  ALA  16           3HB      ALA  16  11.562  -9.307  -1.328
  120    H    GLN  17           H        GLN  17   7.779  -9.653  -1.726
  121    HA   GLN  17           HA       GLN  17   8.210 -12.457  -1.097
  122    HB2  GLN  17           1HB      GLN  17   7.237 -10.907   0.572
  123    HB3  GLN  17           2HB      GLN  17   5.876 -10.629  -0.504
  124    HG2  GLN  17           1HG      GLN  17   5.188 -12.925  -0.295
  125    HG3  GLN  17           2HG      GLN  17   6.609 -13.290   0.681
  126   HE21  GLN  17          1HE2      GLN  17   4.944 -10.264   1.055
  127   HE22  GLN  17          2HE2      GLN  17   4.204 -10.632   2.578
  128    H    ASP  18           H        ASP  18   6.821 -14.123  -1.836
  129    HA   ASP  18           HA       ASP  18   6.102 -13.739  -4.606
  130    HB2  ASP  18           1HB      ASP  18   5.778 -16.196  -4.615
  131    HB3  ASP  18           2HB      ASP  18   7.355 -15.721  -3.996
  132    H    LYS  19           H        LYS  19   4.344 -12.235  -3.320
  133    HA   LYS  19           HA       LYS  19   1.848 -13.521  -4.000
  134    HB2  LYS  19           1HB      LYS  19   0.723 -13.105  -1.905
  135    HB3  LYS  19           2HB      LYS  19   2.149 -14.082  -1.577
  136    HG2  LYS  19           1HG      LYS  19   3.338 -12.181  -0.742
  137    HG3  LYS  19           2HG      LYS  19   2.045 -11.093  -1.243
  138    HD2  LYS  19           1HD      LYS  19   1.873 -11.447   1.121
  139    HD3  LYS  19           2HD      LYS  19   0.525 -12.267   0.336
  140    HE2  LYS  19           1HE      LYS  19   1.555 -14.389   0.620
  141    HE3  LYS  19           2HE      LYS  19   3.078 -13.655   1.121
  142    HZ1  LYS  19           3HZ      LYS  19   1.933 -14.449   3.045
  143    HZ2  LYS  19           1HZ      LYS  19   0.516 -13.627   2.617
  144    HZ3  LYS  19           2HZ      LYS  19   1.893 -12.755   3.075
  145    H    LEU  20           H        LEU  20   0.018 -11.797  -3.556
  146    HA   LEU  20           HA       LEU  20   0.839  -9.347  -4.786
  147    HB2  LEU  20           1HB      LEU  20  -1.394 -10.567  -5.064
  148    HB3  LEU  20           2HB      LEU  20  -1.831  -9.909  -3.497
  149    HG   LEU  20           HG       LEU  20  -2.752  -8.640  -5.436
  150   HD11  LEU  20          1HD1      LEU  20  -2.234  -6.438  -4.623
  151   HD12  LEU  20          2HD1      LEU  20  -0.788  -7.041  -3.813
  152   HD13  LEU  20          3HD1      LEU  20  -2.383  -7.546  -3.258
  153   HD21  LEU  20          3HD2      LEU  20  -0.792  -9.006  -6.901
  154   HD22  LEU  20          1HD2      LEU  20   0.104  -7.839  -5.926
  155   HD23  LEU  20          2HD2      LEU  20  -1.324  -7.322  -6.825
  156    H    VAL  21           H        VAL  21   1.723  -7.722  -3.748
  157    HA   VAL  21           HA       VAL  21   1.284  -7.434  -0.855
  158    HB   VAL  21           HB       VAL  21   3.224  -5.661  -2.191
  159   HG11  VAL  21          1HG1      VAL  21   2.957  -5.669   0.209
  160   HG12  VAL  21          2HG1      VAL  21   4.576  -6.220  -0.225
  161   HG13  VAL  21          3HG1      VAL  21   3.350  -7.387   0.272
  162   HG21  VAL  21          3HG2      VAL  21   3.798  -7.523  -3.507
  163   HG22  VAL  21          1HG2      VAL  21   3.626  -8.640  -2.146
  164   HG23  VAL  21          2HG2      VAL  21   4.969  -7.502  -2.185
  165    H    VAL  22           H        VAL  22  -0.072  -5.868  -0.176
  166    HA   VAL  22           HA       VAL  22  -0.508  -3.570  -1.977
  167    HB   VAL  22           HB       VAL  22  -2.369  -4.419   0.237
  168   HG11  VAL  22          1HG1      VAL  22  -2.530  -2.089  -0.425
  169   HG12  VAL  22          2HG1      VAL  22  -3.967  -2.975  -0.934
  170   HG13  VAL  22          3HG1      VAL  22  -2.721  -2.564  -2.112
  171   HG21  VAL  22          3HG2      VAL  22  -2.552  -5.078  -2.694
  172   HG22  VAL  22          1HG2      VAL  22  -3.824  -5.349  -1.503
  173   HG23  VAL  22          2HG2      VAL  22  -2.294  -6.220  -1.373
  174    H    VAL  23           H        VAL  23   0.644  -1.896  -1.310
  175    HA   VAL  23           HA       VAL  23   1.068  -1.652   1.583
  176    HB   VAL  23           HB       VAL  23   2.757  -0.327  -0.530
  177   HG11  VAL  23          1HG1      VAL  23   3.205  -0.895   2.401
  178   HG12  VAL  23          2HG1      VAL  23   2.786   0.670   1.711
  179   HG13  VAL  23          3HG1      VAL  23   4.332  -0.079   1.320
  180   HG21  VAL  23          3HG2      VAL  23   4.398  -2.118  -0.066
  181   HG22  VAL  23          1HG2      VAL  23   2.927  -2.727  -0.828
  182   HG23  VAL  23          2HG2      VAL  23   3.177  -2.942   0.905
  183    H    ALA  24           H        ALA  24   0.392  -0.036   2.626
  184    HA   ALA  24           HA       ALA  24  -1.299   1.938   1.264
  185    HB1  ALA  24           1HB      ALA  24  -2.113   0.471   3.151
  186    HB2  ALA  24           2HB      ALA  24  -2.358   2.203   3.384
  187    HB3  ALA  24           3HB      ALA  24  -1.047   1.376   4.219
  188    H    PHE  25           H        PHE  25   0.044   3.651   0.669
  189    HA   PHE  25           HA       PHE  25   1.707   4.771   2.830
  190    HB2  PHE  25           1HB      PHE  25   2.097   4.560  -0.074
  191    HB3  PHE  25           2HB      PHE  25   2.547   6.115   0.627
  192    HD1  PHE  25           1HD      PHE  25   2.781   2.590   1.773
  193    HD2  PHE  25           2HD      PHE  25   4.809   6.237   0.990
  194    HE1  PHE  25           1HE      PHE  25   4.863   1.601   2.614
  195    HE2  PHE  25           2HE      PHE  25   6.901   5.256   1.825
  196    HZ   PHE  25           HZ       PHE  25   6.927   2.931   2.640
  197    H    TYR  26           H        TYR  26   0.906   6.416   3.846
  198    HA   TYR  26           HA       TYR  26  -0.511   8.487   2.348
  199    HB2  TYR  26           1HB      TYR  26  -2.227   8.617   4.177
  200    HB3  TYR  26           2HB      TYR  26  -2.321   7.158   3.201
  201    HD1  TYR  26           1HD      TYR  26  -1.680   4.992   4.138
  202    HD2  TYR  26           2HD      TYR  26  -1.617   8.519   6.508
  203    HE1  TYR  26           1HE      TYR  26  -1.561   3.614   6.161
  204    HE2  TYR  26           2HE      TYR  26  -1.490   7.155   8.541
  205    HH   TYR  26           HH       TYR  26  -0.623   4.030   8.608
  206    H    ALA  27           H        ALA  27  -0.967  10.380   4.012
  207    HA   ALA  27           HA       ALA  27   1.471  10.684   5.633
  208    HB1  ALA  27           1HB      ALA  27   1.528  11.962   3.489
  209    HB2  ALA  27           2HB      ALA  27   1.684  12.957   4.937
  210    HB3  ALA  27           3HB      ALA  27   0.148  12.893   4.072
  211    H    THR  28           H        THR  28   1.183  11.348   7.651
  212    HA   THR  28           HA       THR  28  -1.334  11.325   8.845
  213    HB   THR  28           HB       THR  28   0.638  12.698  10.410
  214    HG1  THR  28           1HG      THR  28   1.362  10.181   9.257
  215   HG21  THR  28          3HG2      THR  28  -0.550   9.939  10.565
  216   HG22  THR  28          1HG2      THR  28  -1.224  11.386  11.314
  217   HG23  THR  28          2HG2      THR  28   0.330  10.751  11.860
  218    H    TRP  29           H        TRP  29   0.543  13.967   7.551
  219    HA   TRP  29           HA       TRP  29  -1.067  15.985   8.827
  220    HB2  TRP  29           1HB      TRP  29   0.197  17.571   7.364
  221    HB3  TRP  29           2HB      TRP  29   1.219  16.566   8.379
  222    HD1  TRP  29           HD       TRP  29   3.094  15.242   7.192
  223    HE1  TRP  29           1HE      TRP  29   3.784  14.864   4.741
  224    HE3  TRP  29           3HE      TRP  29  -0.972  17.301   4.872
  225    HZ2  TRP  29           2HZ      TRP  29   2.738  15.365   2.167
  226    HZ3  TRP  29           3HZ      TRP  29  -1.055  17.307   2.421
  227    HH2  TRP  29           HH       TRP  29   0.766  16.362   1.092
  228    H    CYS  30           H        CYS  30  -1.555  13.921   6.286
  229    HA   CYS  30           HA       CYS  30  -3.042  15.764   4.597
  230    HB2  CYS  30           1HB      CYS  30  -1.653  14.010   3.567
  231    HB3  CYS  30           2HB      CYS  30  -2.601  12.772   4.378
  232    HG   CYS  30           HG       CYS  30  -3.733  14.885   1.931
  233    H    GLY  31           H        GLY  31  -5.304  15.266   4.021
  234    HA2  GLY  31           1HA      GLY  31  -6.817  14.747   6.434
  235    HA3  GLY  31           2HA      GLY  31  -7.454  15.323   4.904
  236    HA   PRO  32           HA       PRO  32  -9.080  11.427   3.839
  237    HB2  PRO  32           1HB      PRO  32  -8.170  10.839   1.339
  238    HB3  PRO  32           2HB      PRO  32  -9.380  12.083   1.674
  239    HG2  PRO  32           1HG      PRO  32  -6.442  12.380   1.200
  240    HG3  PRO  32           2HG      PRO  32  -7.780  13.363   0.581
  241    HD2  PRO  32           1HD      PRO  32  -6.258  14.150   2.665
  242    HD3  PRO  32           2HD      PRO  32  -7.984  14.547   2.551
  243    H    CYS  33           H        CYS  33  -5.957  11.465   4.685
  244    HA   CYS  33           HA       CYS  33  -4.920   8.994   3.815
  245    HB2  CYS  33           1HB      CYS  33  -3.457   9.158   5.817
  246    HB3  CYS  33           2HB      CYS  33  -3.501  10.655   4.891
  247    HG   CYS  33           HG       CYS  33  -4.294  12.187   6.804
  248    H    LYS  34           H        LYS  34  -7.097   9.907   6.373
  249    HA   LYS  34           HA       LYS  34  -7.100   7.447   7.761
  250    HB2  LYS  34           1HB      LYS  34  -9.102   8.273   8.875
  251    HB3  LYS  34           2HB      LYS  34  -7.875   9.528   8.798
  252    HG2  LYS  34           1HG      LYS  34  -9.036  10.651   7.037
  253    HG3  LYS  34           2HG      LYS  34 -10.181   9.318   6.876
  254    HD2  LYS  34           1HD      LYS  34  -9.862  11.045   9.332
  255    HD3  LYS  34           2HD      LYS  34 -11.119  11.245   8.111
  256    HE2  LYS  34           1HE      LYS  34 -11.907   8.956   8.597
  257    HE3  LYS  34           2HE      LYS  34 -10.690   8.824   9.863
  258    HZ1  LYS  34           3HZ      LYS  34 -11.738  10.664  11.016
  259    HZ2  LYS  34           1HZ      LYS  34 -12.844   9.410  10.766
  260    HZ3  LYS  34           2HZ      LYS  34 -12.905  10.796   9.800
  261    H    MET  35           H        MET  35  -8.274   8.187   4.668
  262    HA   MET  35           HA       MET  35 -10.539   6.368   4.834
  263    HB2  MET  35           1HB      MET  35 -10.396   8.362   3.219
  264    HB3  MET  35           2HB      MET  35  -9.286   7.354   2.278
  265    HG2  MET  35           1HG      MET  35 -11.013   5.619   2.135
  266    HG3  MET  35           2HG      MET  35 -12.125   6.663   3.014
  267    HE1  MET  35           3HE      MET  35 -13.823   6.120   0.820
  268    HE2  MET  35           1HE      MET  35 -12.447   5.152   0.280
  269    HE3  MET  35           2HE      MET  35 -13.208   6.304  -0.825
  270    H    ILE  36           H        ILE  36  -7.192   6.350   4.025
  271    HA   ILE  36           HA       ILE  36  -7.235   3.781   2.762
  272    HB   ILE  36           HB       ILE  36  -5.225   5.809   3.387
  273   HG12  ILE  36          1HG1      ILE  36  -4.427   5.163   1.172
  274   HG13  ILE  36          2HG1      ILE  36  -5.500   3.769   1.187
  275   HG21  ILE  36          1HG2      ILE  36  -3.316   4.221   3.131
  276   HG22  ILE  36          2HG2      ILE  36  -4.450   2.905   3.438
  277   HG23  ILE  36          3HG2      ILE  36  -4.157   4.122   4.678
  278   HD11  ILE  36          3HD1      ILE  36  -6.577   5.401  -0.106
  279   HD12  ILE  36          1HD1      ILE  36  -6.253   6.660   1.087
  280   HD13  ILE  36          2HD1      ILE  36  -7.405   5.381   1.458
  281    H    ALA  37           H        ALA  37  -6.909   5.027   5.970
  282    HA   ALA  37           HA       ALA  37  -5.934   2.826   7.305
  283    HB1  ALA  37           1HB      ALA  37  -6.320   4.823   8.513
  284    HB2  ALA  37           2HB      ALA  37  -7.338   3.578   9.238
  285    HB3  ALA  37           3HB      ALA  37  -8.044   4.785   8.167
  286    HA   PRO  38           HA       PRO  38 -10.015   0.573   7.697
  287    HB2  PRO  38           1HB      PRO  38 -12.392   1.503   6.941
  288    HB3  PRO  38           2HB      PRO  38 -11.606   2.097   8.410
  289    HG2  PRO  38           1HG      PRO  38 -11.757   3.356   5.702
  290    HG3  PRO  38           2HG      PRO  38 -11.934   4.109   7.298
  291    HD2  PRO  38           1HD      PRO  38  -9.613   4.133   5.797
  292    HD3  PRO  38           2HD      PRO  38  -9.688   4.353   7.553
  293    H    MET  39           H        MET  39  -9.912   2.218   4.535
  294    HA   MET  39           HA       MET  39 -11.427   0.194   3.178
  295    HB2  MET  39           1HB      MET  39 -11.378   2.415   2.224
  296    HB3  MET  39           2HB      MET  39  -9.627   2.440   2.241
  297    HG2  MET  39           1HG      MET  39 -11.109   0.463   0.559
  298    HG3  MET  39           2HG      MET  39 -10.859   2.119   0.014
  299    HE1  MET  39           3HE      MET  39  -8.300   3.175   0.510
  300    HE2  MET  39           1HE      MET  39  -6.846   2.188   0.359
  301    HE3  MET  39           2HE      MET  39  -7.802   2.114   1.838
  302    H    ILE  40           H        ILE  40  -8.071   0.738   3.885
  303    HA   ILE  40           HA       ILE  40  -7.193  -1.401   2.170
  304    HB   ILE  40           HB       ILE  40  -5.996   0.793   3.607
  305   HG12  ILE  40          1HG1      ILE  40  -4.749  -0.864   1.440
  306   HG13  ILE  40          2HG1      ILE  40  -6.118   0.194   1.107
  307   HG21  ILE  40          1HG2      ILE  40  -3.783  -0.275   3.964
  308   HG22  ILE  40          2HG2      ILE  40  -4.546  -1.846   3.713
  309   HG23  ILE  40          3HG2      ILE  40  -5.031  -0.835   5.074
  310   HD11  ILE  40          3HD1      ILE  40  -4.894   2.107   1.689
  311   HD12  ILE  40          1HD1      ILE  40  -3.848   1.148   0.654
  312   HD13  ILE  40          2HD1      ILE  40  -3.599   1.156   2.397
  313    H    GLU  41           H        GLU  41  -7.673  -0.870   5.646
  314    HA   GLU  41           HA       GLU  41  -6.859  -3.488   6.369
  315    HB2  GLU  41           1HB      GLU  41  -8.857  -1.608   7.661
  316    HB3  GLU  41           2HB      GLU  41  -8.423  -3.170   8.350
  317    HG2  GLU  41           1HG      GLU  41  -6.024  -2.357   8.311
  318    HG3  GLU  41           2HG      GLU  41  -6.680  -0.759   7.965
  319    H    LYS  42           H        LYS  42  -9.542  -2.272   4.658
  320    HA   LYS  42           HA       LYS  42 -11.359  -4.395   5.262
  321    HB2  LYS  42           1HB      LYS  42 -12.003  -2.028   4.696
  322    HB3  LYS  42           2HB      LYS  42 -11.570  -2.371   3.032
  323    HG2  LYS  42           1HG      LYS  42 -13.293  -4.069   2.903
  324    HG3  LYS  42           2HG      LYS  42 -13.673  -3.846   4.613
  325    HD2  LYS  42           1HD      LYS  42 -14.100  -1.389   3.983
  326    HD3  LYS  42           2HD      LYS  42 -14.143  -1.968   2.318
  327    HE2  LYS  42           1HE      LYS  42 -15.872  -3.050   4.539
  328    HE3  LYS  42           2HE      LYS  42 -16.379  -1.792   3.415
  329    HZ1  LYS  42           3HZ      LYS  42 -16.116  -3.334   1.597
  330    HZ2  LYS  42           1HZ      LYS  42 -17.154  -3.991   2.755
  331    HZ3  LYS  42           2HZ      LYS  42 -15.563  -4.540   2.644
  332    H    PHE  43           H        PHE  43  -9.137  -3.643   2.570
  333    HA   PHE  43           HA       PHE  43 -10.125  -5.591   0.810
  334    HB2  PHE  43           1HB      PHE  43  -8.221  -5.331  -0.528
  335    HB3  PHE  43           2HB      PHE  43  -8.344  -3.784   0.298
  336    HD1  PHE  43           2HD      PHE  43  -6.589  -7.073   0.551
  337    HD2  PHE  43           1HD      PHE  43  -6.471  -2.893   1.289
  338    HE1  PHE  43           2HE      PHE  43  -4.247  -7.275   1.261
  339    HE2  PHE  43           1HE      PHE  43  -4.125  -3.082   1.996
  340    HZ   PHE  43           HZ       PHE  43  -3.012  -5.278   1.990
  341    H    SER  44           H        SER  44  -7.646  -5.926   3.387
  342    HA   SER  44           HA       SER  44  -7.424  -8.748   2.743
  343    HB2  SER  44           1HB      SER  44  -5.785  -8.813   4.551
  344    HB3  SER  44           2HB      SER  44  -5.414  -7.555   3.378
  345    HG   SER  44           HG       SER  44  -5.370  -6.271   5.033
  346    H    GLU  45           H        GLU  45  -9.314  -6.743   4.749
  347    HA   GLU  45           HA       GLU  45 -10.086  -8.535   6.757
  348    HB2  GLU  45           1HB      GLU  45 -10.713  -6.072   6.482
  349    HB3  GLU  45           2HB      GLU  45 -11.964  -6.624   5.378
  350    HG2  GLU  45           1HG      GLU  45 -12.995  -6.339   7.475
  351    HG3  GLU  45           2HG      GLU  45 -12.808  -8.077   7.242
  352    H    GLN  46           H        GLN  46 -10.946  -8.217   3.386
  353    HA   GLN  46           HA       GLN  46 -12.891 -10.336   3.442
  354    HB2  GLN  46           1HB      GLN  46 -11.517  -8.962   1.121
  355    HB3  GLN  46           2HB      GLN  46 -12.842 -10.105   0.975
  356    HG2  GLN  46           1HG      GLN  46 -14.308  -8.575   2.170
  357    HG3  GLN  46           2HG      GLN  46 -12.975  -7.430   2.344
  358   HE21  GLN  46          1HE2      GLN  46 -15.197  -8.920   0.122
  359   HE22  GLN  46          2HE2      GLN  46 -14.980  -7.792  -1.167
  360    H    TYR  47           H        TYR  47  -9.597  -9.844   2.221
  361    HA   TYR  47           HA       TYR  47  -9.225 -12.732   2.271
  362    HB2  TYR  47           1HB      TYR  47  -7.972 -12.508   0.080
  363    HB3  TYR  47           2HB      TYR  47  -9.720 -12.418   0.039
  364    HD1  TYR  47           1HD      TYR  47  -6.801 -10.067   0.293
  365    HD2  TYR  47           2HD      TYR  47 -10.661 -10.856  -1.312
  366    HE1  TYR  47           1HE      TYR  47  -6.659  -8.021  -1.064
  367    HE2  TYR  47           2HE      TYR  47 -10.540  -8.795  -2.645
  368    HH   TYR  47           HH       TYR  47  -9.398  -6.829  -2.894
  369    HA   PRO  48           HA       PRO  48  -5.616 -10.944   4.401
  370    HB2  PRO  48           1HB      PRO  48  -5.156 -13.105   5.954
  371    HB3  PRO  48           2HB      PRO  48  -6.349 -11.875   6.364
  372    HG2  PRO  48           1HG      PRO  48  -6.764 -14.545   5.074
  373    HG3  PRO  48           2HG      PRO  48  -7.697 -13.775   6.371
  374    HD2  PRO  48           1HD      PRO  48  -8.523 -13.766   3.800
  375    HD3  PRO  48           2HD      PRO  48  -8.855 -12.416   4.904
  376    H    GLN  49           H        GLN  49  -6.080 -13.336   2.141
  377    HA   GLN  49           HA       GLN  49  -3.600 -14.644   2.123
  378    HB2  GLN  49           1HB      GLN  49  -4.187 -15.272  -0.206
  379    HB3  GLN  49           2HB      GLN  49  -5.435 -15.637   0.972
  380    HG2  GLN  49           1HG      GLN  49  -6.731 -14.666  -0.552
  381    HG3  GLN  49           2HG      GLN  49  -6.169 -13.225   0.290
  382   HE21  GLN  49          1HE2      GLN  49  -6.503 -11.941  -1.540
  383   HE22  GLN  49          2HE2      GLN  49  -5.445 -12.004  -2.901
  384    H    ALA  50           H        ALA  50  -4.473 -11.491   1.202
  385    HA   ALA  50           HA       ALA  50  -1.984 -11.131  -0.337
  386    HB1  ALA  50           1HB      ALA  50  -4.315  -9.269   0.144
  387    HB2  ALA  50           2HB      ALA  50  -3.962 -10.142  -1.349
  388    HB3  ALA  50           3HB      ALA  50  -2.877  -8.866  -0.792
  389    H    ASP  51           H        ASP  51  -0.484  -9.419   0.393
  390    HA   ASP  51           HA       ASP  51  -0.543  -9.432   3.297
  391    HB2  ASP  51           1HB      ASP  51   1.604  -9.620   1.459
  392    HB3  ASP  51           2HB      ASP  51   1.826  -8.149   2.390
  393    H    PHE  52           H        PHE  52  -0.415  -7.730   4.572
  394    HA   PHE  52           HA       PHE  52  -1.381  -5.239   3.357
  395    HB2  PHE  52           1HB      PHE  52  -2.307  -5.087   5.863
  396    HB3  PHE  52           2HB      PHE  52  -3.206  -5.886   4.581
  397    HD1  PHE  52           1HD      PHE  52  -1.042  -6.422   7.521
  398    HD2  PHE  52           2HD      PHE  52  -3.577  -8.236   4.624
  399    HE1  PHE  52           1HE      PHE  52  -1.050  -8.502   8.833
  400    HE2  PHE  52           2HE      PHE  52  -3.589 -10.317   5.932
  401    HZ   PHE  52           HZ       PHE  52  -2.326 -10.453   8.039
  402    H    TYR  53           H        TYR  53   0.118  -3.686   3.448
  403    HA   TYR  53           HA       TYR  53   1.438  -3.256   6.028
  404    HB2  TYR  53           1HB      TYR  53   2.880  -3.268   3.359
  405    HB3  TYR  53           2HB      TYR  53   3.575  -2.726   4.882
  406    HD1  TYR  53           1HD      TYR  53   4.048  -4.357   6.672
  407    HD2  TYR  53           2HD      TYR  53   2.693  -5.593   2.835
  408    HE1  TYR  53           1HE      TYR  53   4.786  -6.648   7.156
  409    HE2  TYR  53           2HE      TYR  53   3.423  -7.896   3.308
  410    HH   TYR  53           HH       TYR  53   4.191  -8.961   6.396
  411    H    LYS  54           H        LYS  54   2.017  -1.111   6.471
  412    HA   LYS  54           HA       LYS  54   1.045   0.926   4.622
  413    HB2  LYS  54           1HB      LYS  54  -0.547   1.844   6.135
  414    HB3  LYS  54           2HB      LYS  54  -0.860   0.114   6.054
  415    HG2  LYS  54           1HG      LYS  54   0.115  -0.247   8.191
  416    HG3  LYS  54           2HG      LYS  54   0.728   1.407   8.256
  417    HD2  LYS  54           1HD      LYS  54  -1.660   2.189   8.155
  418    HD3  LYS  54           2HD      LYS  54  -2.149   0.506   8.352
  419    HE2  LYS  54           1HE      LYS  54  -0.294   1.852  10.292
  420    HE3  LYS  54           2HE      LYS  54  -2.043   1.989  10.444
  421    HZ1  LYS  54           3HZ      LYS  54  -0.610  -0.609  10.345
  422    HZ2  LYS  54           1HZ      LYS  54  -2.231  -0.342  10.736
  423    HZ3  LYS  54           2HZ      LYS  54  -1.014   0.183  11.784
  424    H    LEU  55           H        LEU  55   1.757   3.082   5.154
  425    HA   LEU  55           HA       LEU  55   3.494   3.498   7.408
  426    HB2  LEU  55           1HB      LEU  55   4.992   2.293   5.945
  427    HB3  LEU  55           2HB      LEU  55   4.574   3.329   4.597
  428    HG   LEU  55           HG       LEU  55   5.855   4.565   7.000
  429   HD11  LEU  55          1HD1      LEU  55   7.267   2.655   6.606
  430   HD12  LEU  55          2HD1      LEU  55   8.064   4.087   5.955
  431   HD13  LEU  55          3HD1      LEU  55   7.258   2.956   4.870
  432   HD21  LEU  55          3HD2      LEU  55   6.202   5.063   4.053
  433   HD22  LEU  55          1HD2      LEU  55   6.676   6.114   5.388
  434   HD23  LEU  55          2HD2      LEU  55   4.964   5.847   5.034
  435    H    ASP  56           H        ASP  56   3.869   5.681   7.804
  436    HA   ASP  56           HA       ASP  56   2.306   7.585   6.247
  437    HB2  ASP  56           1HB      ASP  56   3.661   7.664   8.933
  438    HB3  ASP  56           2HB      ASP  56   3.128   9.141   8.152
  439    H    VAL  57           H        VAL  57   3.240   8.822   4.698
  440    HA   VAL  57           HA       VAL  57   6.047   8.710   4.215
  441    HB   VAL  57           HB       VAL  57   5.682   9.951   2.305
  442   HG11  VAL  57          1HG1      VAL  57   3.612   9.240   1.292
  443   HG12  VAL  57          2HG1      VAL  57   2.905   8.934   2.877
  444   HG13  VAL  57          3HG1      VAL  57   4.251   7.943   2.304
  445   HG21  VAL  57          3HG2      VAL  57   3.356  11.306   3.657
  446   HG22  VAL  57          1HG2      VAL  57   3.896  11.608   2.006
  447   HG23  VAL  57          2HG2      VAL  57   4.949  12.001   3.365
  448    H    ASP  58           H        ASP  58   4.091  10.630   6.217
  449    HA   ASP  58           HA       ASP  58   5.687  12.949   6.463
  450    HB2  ASP  58           1HB      ASP  58   3.434  12.960   7.326
  451    HB3  ASP  58           2HB      ASP  58   3.780  11.600   8.387
  452    H    GLU  59           H        GLU  59   5.676   9.814   8.022
  453    HA   GLU  59           HA       GLU  59   7.799  10.455   9.849
  454    HB2  GLU  59           1HB      GLU  59   6.047   8.813  10.406
  455    HB3  GLU  59           2HB      GLU  59   6.588   7.790   9.084
  456    HG2  GLU  59           1HG      GLU  59   7.446   6.896  11.108
  457    HG3  GLU  59           2HG      GLU  59   8.791   7.602  10.216
  458    H    LEU  60           H        LEU  60   7.465   8.693   6.795
  459    HA   LEU  60           HA       LEU  60  10.391   8.689   6.547
  460    HB2  LEU  60           1HB      LEU  60   8.574   6.318   6.166
  461    HB3  LEU  60           2HB      LEU  60  10.246   6.362   5.644
  462    HG   LEU  60           HG       LEU  60   9.444   6.797   8.512
  463   HD11  LEU  60          1HD1      LEU  60   8.633   4.615   7.850
  464   HD12  LEU  60          2HD1      LEU  60  10.040   4.456   8.899
  465   HD13  LEU  60          3HD1      LEU  60  10.206   4.218   7.160
  466   HD21  LEU  60          3HD2      LEU  60  11.657   7.587   7.905
  467   HD22  LEU  60          1HD2      LEU  60  12.041   6.020   7.192
  468   HD23  LEU  60          2HD2      LEU  60  11.775   6.158   8.931
  469    H    GLY  61           H        GLY  61  10.101  10.402   5.075
  470    HA2  GLY  61           1HA      GLY  61   8.466  10.152   2.741
  471    HA3  GLY  61           2HA      GLY  61   9.680  11.389   3.036
  472    H    ASP  62           H        ASP  62  11.889   9.621   3.425
  473    HA   ASP  62           HA       ASP  62  12.717   9.321   0.742
  474    HB2  ASP  62           1HB      ASP  62  14.771   8.479   1.587
  475    HB3  ASP  62           2HB      ASP  62  14.224   9.668   2.763
  476    H    VAL  63           H        VAL  63  11.209   7.188   2.990
  477    HA   VAL  63           HA       VAL  63  11.587   4.773   1.547
  478    HB   VAL  63           HB       VAL  63   9.362   5.567   3.425
  479   HG11  VAL  63          1HG1      VAL  63  10.105   2.867   2.304
  480   HG12  VAL  63          2HG1      VAL  63   8.618   3.765   2.005
  481   HG13  VAL  63          3HG1      VAL  63   8.954   3.130   3.614
  482   HG21  VAL  63          3HG2      VAL  63  10.551   4.380   5.120
  483   HG22  VAL  63          1HG2      VAL  63  11.690   5.497   4.368
  484   HG23  VAL  63          2HG2      VAL  63  11.730   3.779   3.958
  485    H    ALA  64           H        ALA  64   8.777   6.986   1.733
  486    HA   ALA  64           HA       ALA  64   7.197   5.876  -0.213
  487    HB1  ALA  64           1HB      ALA  64   7.608   8.813   0.326
  488    HB2  ALA  64           2HB      ALA  64   6.501   7.746   1.188
  489    HB3  ALA  64           3HB      ALA  64   6.234   8.101  -0.519
  490    H    GLN  65           H        GLN  65   9.924   8.055  -0.606
  491    HA   GLN  65           HA       GLN  65   9.579   8.443  -3.405
  492    HB2  GLN  65           1HB      GLN  65  12.009   8.821  -1.653
  493    HB3  GLN  65           2HB      GLN  65  11.879   9.375  -3.317
  494    HG2  GLN  65           1HG      GLN  65   9.955  10.777  -2.658
  495    HG3  GLN  65           2HG      GLN  65  10.207  10.277  -0.985
  496   HE21  GLN  65          1HE2      GLN  65  11.481  12.093  -3.658
  497   HE22  GLN  65          2HE2      GLN  65  12.598  13.040  -2.738
  498    H    LYS  66           H        LYS  66  11.304   6.079  -1.489
  499    HA   LYS  66           HA       LYS  66  12.819   4.901  -3.518
  500    HB2  LYS  66           1HB      LYS  66  13.557   4.032  -1.565
  501    HB3  LYS  66           2HB      LYS  66  12.029   4.364  -0.759
  502    HG2  LYS  66           1HG      LYS  66  12.296   2.070  -0.598
  503    HG3  LYS  66           2HG      LYS  66  11.141   2.305  -1.897
  504    HD2  LYS  66           1HD      LYS  66  12.954   1.980  -3.542
  505    HD3  LYS  66           2HD      LYS  66  14.086   1.703  -2.214
  506    HE2  LYS  66           1HE      LYS  66  12.769  -0.228  -1.494
  507    HE3  LYS  66           2HE      LYS  66  11.631   0.049  -2.810
  508    HZ1  LYS  66           3HZ      LYS  66  13.386  -0.391  -4.393
  509    HZ2  LYS  66           1HZ      LYS  66  13.235  -1.702  -3.331
  510    HZ3  LYS  66           2HZ      LYS  66  14.509  -0.600  -3.150
  511    H    ASN  67           H        ASN  67   9.452   4.860  -2.834
  512    HA   ASN  67           HA       ASN  67   9.046   2.285  -4.173
  513    HB2  ASN  67           1HB      ASN  67   7.016   3.895  -2.673
  514    HB3  ASN  67           2HB      ASN  67   6.986   2.185  -3.038
  515   HD21  ASN  67          1HD2      ASN  67   7.008   4.003  -0.599
  516   HD22  ASN  67          2HD2      ASN  67   8.094   3.223   0.462
  517    H    GLU  68           H        GLU  68   8.810   5.607  -4.623
  518    HA   GLU  68           HA       GLU  68   8.155   6.837  -6.407
  519    HB2  GLU  68           1HB      GLU  68   8.476   4.839  -7.822
  520    HB3  GLU  68           2HB      GLU  68   6.837   4.322  -7.449
  521    HG2  GLU  68           1HG      GLU  68   7.029   5.342  -9.668
  522    HG3  GLU  68           2HG      GLU  68   5.936   6.233  -8.615
  523    H    VAL  69           H        VAL  69   6.661   6.274  -3.893
  524    HA   VAL  69           HA       VAL  69   4.074   7.300  -4.823
  525    HB   VAL  69           HB       VAL  69   3.433   5.617  -3.395
  526   HG11  VAL  69          1HG1      VAL  69   4.463   5.037  -1.268
  527   HG12  VAL  69          2HG1      VAL  69   5.674   6.304  -1.493
  528   HG13  VAL  69          3HG1      VAL  69   5.610   4.933  -2.595
  529   HG21  VAL  69          3HG2      VAL  69   2.625   6.616  -1.322
  530   HG22  VAL  69          1HG2      VAL  69   2.400   7.704  -2.691
  531   HG23  VAL  69          2HG2      VAL  69   3.717   7.980  -1.550
  532    H    SER  70           H        SER  70   3.862   9.382  -4.849
  533    HA   SER  70           HA       SER  70   5.429  11.000  -2.952
  534    HB2  SER  70           1HB      SER  70   6.102  11.185  -5.369
  535    HB3  SER  70           2HB      SER  70   4.498  11.825  -5.713
  536    HG   SER  70           HG       SER  70   5.332  13.676  -5.215
  537    H    ALA  71           H        ALA  71   2.348  10.437  -4.484
  538    HA   ALA  71           HA       ALA  71   1.100  12.684  -3.120
  539    HB1  ALA  71           1HB      ALA  71  -0.107  10.599  -4.940
  540    HB2  ALA  71           2HB      ALA  71   0.451  12.198  -5.435
  541    HB3  ALA  71           3HB      ALA  71  -0.917  12.043  -4.332
  542    H    MET  72           H        MET  72  -0.995  12.207  -1.944
  543    HA   MET  72           HA       MET  72  -1.104   9.601  -0.685
  544    HB2  MET  72           1HB      MET  72  -1.057  10.544   1.606
  545    HB3  MET  72           2HB      MET  72   0.476  10.702   0.766
  546    HG2  MET  72           1HG      MET  72  -1.519  12.938   0.870
  547    HG3  MET  72           2HG      MET  72  -0.330  12.680   2.141
  548    HE1  MET  72           3HE      MET  72   3.042  13.150   0.224
  549    HE2  MET  72           1HE      MET  72   2.185  11.615   0.358
  550    HE3  MET  72           2HE      MET  72   2.265  12.701   1.743
  551    HA   PRO  73           HA       PRO  73  -2.096   8.648   0.765
  552    HB2  PRO  73           1HB      PRO  73  -4.191   6.964   0.882
  553    HB3  PRO  73           2HB      PRO  73  -3.857   8.159   2.133
  554    HG2  PRO  73           1HG      PRO  73  -5.906   8.189  -0.021
  555    HG3  PRO  73           2HG      PRO  73  -5.997   8.849   1.631
  556    HD2  PRO  73           1HD      PRO  73  -5.501  10.313  -0.705
  557    HD3  PRO  73           2HD      PRO  73  -5.162  10.858   0.947
  558    H    THR  74           H        THR  74  -1.387   6.747  -0.165
  559    HA   THR  74           HA       THR  74  -2.202   6.223  -2.946
  560    HB   THR  74           HB       THR  74   0.587   6.642  -1.867
  561    HG1  THR  74           1HG      THR  74   0.212   8.488  -2.804
  562   HG21  THR  74          3HG2      THR  74   1.400   5.945  -4.135
  563   HG22  THR  74          1HG2      THR  74  -0.206   5.266  -4.440
  564   HG23  THR  74          2HG2      THR  74   0.798   4.631  -3.127
  565    H    LEU  75           H        LEU  75  -2.355   4.162  -3.500
  566    HA   LEU  75           HA       LEU  75  -1.430   2.113  -1.596
  567    HB2  LEU  75           1HB      LEU  75  -3.414   1.916  -3.851
  568    HB3  LEU  75           2HB      LEU  75  -2.979   0.618  -2.755
  569    HG   LEU  75           HG       LEU  75  -3.857   2.511  -1.012
  570   HD11  LEU  75          1HD1      LEU  75  -5.613   2.730  -3.467
  571   HD12  LEU  75          2HD1      LEU  75  -4.567   4.005  -2.839
  572   HD13  LEU  75          3HD1      LEU  75  -5.935   3.437  -1.883
  573   HD21  LEU  75          3HD2      LEU  75  -5.928   1.143  -0.983
  574   HD22  LEU  75          1HD2      LEU  75  -4.436   0.203  -0.953
  575   HD23  LEU  75          2HD2      LEU  75  -5.364   0.342  -2.448
  576    H    LEU  76           H        LEU  76   0.216   0.829  -2.235
  577    HA   LEU  76           HA       LEU  76   0.819   0.732  -5.116
  578    HB2  LEU  76           1HB      LEU  76   2.516   1.351  -2.848
  579    HB3  LEU  76           2HB      LEU  76   3.146   0.006  -3.780
  580    HG   LEU  76           HG       LEU  76   2.420   2.694  -4.950
  581   HD11  LEU  76          1HD1      LEU  76   5.113   1.561  -4.203
  582   HD12  LEU  76          2HD1      LEU  76   4.311   2.947  -3.466
  583   HD13  LEU  76          3HD1      LEU  76   4.857   3.033  -5.147
  584   HD21  LEU  76          3HD2      LEU  76   3.926   0.362  -6.130
  585   HD22  LEU  76          1HD2      LEU  76   3.578   1.897  -6.926
  586   HD23  LEU  76          2HD2      LEU  76   2.262   0.800  -6.511
  587    H    LEU  77           H        LEU  77   0.384  -1.113  -5.973
  588    HA   LEU  77           HA       LEU  77   0.371  -3.562  -4.347
  589    HB2  LEU  77           1HB      LEU  77  -0.802  -2.861  -7.038
  590    HB3  LEU  77           2HB      LEU  77  -0.702  -4.509  -6.466
  591    HG   LEU  77           HG       LEU  77  -2.313  -4.125  -4.755
  592   HD11  LEU  77          1HD1      LEU  77  -2.209  -1.192  -5.478
  593   HD12  LEU  77          2HD1      LEU  77  -1.581  -1.911  -3.994
  594   HD13  LEU  77          3HD1      LEU  77  -3.314  -1.935  -4.321
  595   HD21  LEU  77          3HD2      LEU  77  -3.103  -4.396  -7.086
  596   HD22  LEU  77          1HD2      LEU  77  -3.215  -2.639  -7.213
  597   HD23  LEU  77          2HD2      LEU  77  -4.231  -3.507  -6.056
  598    H    PHE  78           H        PHE  78   1.954  -5.016  -4.595
  599    HA   PHE  78           HA       PHE  78   3.582  -4.911  -7.044
  600    HB2  PHE  78           1HB      PHE  78   4.518  -5.000  -4.187
  601    HB3  PHE  78           2HB      PHE  78   5.527  -5.587  -5.504
  602    HD1  PHE  78           2HD      PHE  78   6.487  -4.062  -7.112
  603    HD2  PHE  78           1HD      PHE  78   4.067  -2.641  -3.918
  604    HE1  PHE  78           2HE      PHE  78   7.318  -1.783  -7.505
  605    HE2  PHE  78           1HE      PHE  78   4.902  -0.366  -4.305
  606    HZ   PHE  78           HZ       PHE  78   6.524   0.071  -6.095
  607    H    LYS  79           H        LYS  79   4.504  -6.945  -7.717
  608    HA   LYS  79           HA       LYS  79   3.923  -9.226  -5.940
  609    HB2  LYS  79           1HB      LYS  79   2.320  -9.150  -7.885
  610    HB3  LYS  79           2HB      LYS  79   3.705  -9.366  -8.947
  611    HG2  LYS  79           1HG      LYS  79   4.211 -11.498  -7.836
  612    HG3  LYS  79           2HG      LYS  79   2.779 -11.291  -6.825
  613    HD2  LYS  79           1HD      LYS  79   2.743 -11.425  -9.837
  614    HD3  LYS  79           2HD      LYS  79   2.427 -12.794  -8.772
  615    HE2  LYS  79           1HE      LYS  79   0.540 -11.565  -7.785
  616    HE3  LYS  79           2HE      LYS  79   0.844 -10.230  -8.895
  617    HZ1  LYS  79           3HZ      LYS  79   0.190 -12.992  -9.744
  618    HZ2  LYS  79           1HZ      LYS  79   0.337 -11.637 -10.743
  619    HZ3  LYS  79           2HZ      LYS  79  -0.941 -11.740  -9.634
  620    H    ASN  80           H        ASN  80   5.697 -10.302  -5.440
  621    HA   ASN  80           HA       ASN  80   7.887 -10.836  -5.266
  622    HB2  ASN  80           1HB      ASN  80   8.808 -12.002  -7.341
  623    HB3  ASN  80           2HB      ASN  80   7.375 -12.681  -6.582
  624   HD21  ASN  80          1HD2      ASN  80   8.606 -10.882  -9.306
  625   HD22  ASN  80          2HD2      ASN  80   7.257 -11.169 -10.354
  626    H    GLY  81           H        GLY  81   8.034  -8.271  -5.285
  627    HA2  GLY  81           1HA      GLY  81   9.768  -6.732  -5.380
  628    HA3  GLY  81           2HA      GLY  81  10.652  -7.846  -6.423
  629    H    LYS  82           H        LYS  82   7.690  -7.554  -7.763
  630    HA   LYS  82           HA       LYS  82   8.551  -5.325  -9.484
  631    HB2  LYS  82           1HB      LYS  82   6.978  -7.787 -10.282
  632    HB3  LYS  82           2HB      LYS  82   7.498  -6.494 -11.354
  633    HG2  LYS  82           1HG      LYS  82   9.832  -7.082 -10.939
  634    HG3  LYS  82           2HG      LYS  82   9.311  -8.373  -9.849
  635    HD2  LYS  82           1HD      LYS  82   8.299  -9.576 -11.634
  636    HD3  LYS  82           2HD      LYS  82   8.495  -8.219 -12.746
  637    HE2  LYS  82           1HE      LYS  82  10.150 -10.019 -13.111
  638    HE3  LYS  82           2HE      LYS  82  10.888  -8.472 -12.709
  639    HZ1  LYS  82           3HZ      LYS  82  10.474 -10.738 -10.832
  640    HZ2  LYS  82           1HZ      LYS  82  11.164  -9.244 -10.431
  641    HZ3  LYS  82           2HZ      LYS  82  11.947 -10.274 -11.520
  642    H    GLU  83           H        GLU  83   6.676  -4.186 -10.491
  643    HA   GLU  83           HA       GLU  83   4.743  -3.594  -8.480
  644    HB2  GLU  83           1HB      GLU  83   5.797  -2.005 -10.180
  645    HB3  GLU  83           2HB      GLU  83   4.710  -2.709 -11.366
  646    HG2  GLU  83           1HG      GLU  83   2.789  -1.892 -10.205
  647    HG3  GLU  83           2HG      GLU  83   3.785  -1.389  -8.831
  648    H    VAL  84           H        VAL  84   2.351  -3.434  -9.192
  649    HA   VAL  84           HA       VAL  84   1.592  -5.023 -11.461
  650    HB   VAL  84           HB       VAL  84  -0.392  -5.977 -10.064
  651   HG11  VAL  84          1HG1      VAL  84   1.316  -7.294 -11.303
  652   HG12  VAL  84          2HG1      VAL  84   0.735  -8.076  -9.835
  653   HG13  VAL  84          3HG1      VAL  84   2.316  -7.283  -9.844
  654   HG21  VAL  84          3HG2      VAL  84   0.258  -4.884  -7.994
  655   HG22  VAL  84          1HG2      VAL  84   1.772  -5.782  -7.995
  656   HG23  VAL  84          2HG2      VAL  84   0.241  -6.639  -7.821
  657    H    ALA  85           H        ALA  85   0.800  -2.767  -8.891
  658    HA   ALA  85           HA       ALA  85  -0.605  -1.112 -10.698
  659    HB1  ALA  85           1HB      ALA  85  -2.441  -2.578 -10.509
  660    HB2  ALA  85           2HB      ALA  85  -2.819  -1.197  -9.476
  661    HB3  ALA  85           3HB      ALA  85  -2.245  -2.706  -8.765
  662    H    LYS  86           H        LYS  86  -1.297   0.902  -9.791
  663    HA   LYS  86           HA       LYS  86  -0.774   1.388  -6.985
  664    HB2  LYS  86           1HB      LYS  86   0.718   3.272  -7.359
  665    HB3  LYS  86           2HB      LYS  86   1.424   1.801  -7.994
  666    HG2  LYS  86           1HG      LYS  86  -0.042   3.736  -9.756
  667    HG3  LYS  86           2HG      LYS  86   1.667   3.933  -9.366
  668    HD2  LYS  86           1HD      LYS  86   2.046   1.619 -10.236
  669    HD3  LYS  86           2HD      LYS  86   0.367   1.608 -10.777
  670    HE2  LYS  86           1HE      LYS  86   0.802   3.542 -12.196
  671    HE3  LYS  86           2HE      LYS  86   2.472   3.591 -11.632
  672    HZ1  LYS  86           3HZ      LYS  86   2.727   1.311 -12.544
  673    HZ2  LYS  86           1HZ      LYS  86   2.430   2.494 -13.722
  674    HZ3  LYS  86           2HZ      LYS  86   1.187   1.458 -13.235
  675    H    VAL  87           H        VAL  87  -2.131   2.881  -6.156
  676    HA   VAL  87           HA       VAL  87  -3.639   4.575  -8.026
  677    HB   VAL  87           HB       VAL  87  -4.936   2.953  -5.826
  678   HG11  VAL  87          1HG1      VAL  87  -7.045   3.815  -6.767
  679   HG12  VAL  87          2HG1      VAL  87  -6.118   4.830  -7.868
  680   HG13  VAL  87          3HG1      VAL  87  -6.020   5.099  -6.128
  681   HG21  VAL  87          3HG2      VAL  87  -6.072   1.748  -7.634
  682   HG22  VAL  87          1HG2      VAL  87  -4.322   1.539  -7.714
  683   HG23  VAL  87          2HG2      VAL  87  -5.130   2.648  -8.822
  684    H    VAL  88           H        VAL  88  -3.927   6.614  -7.323
  685    HA   VAL  88           HA       VAL  88  -2.836   7.242  -4.679
  686    HB   VAL  88           HB       VAL  88  -2.770   9.606  -5.530
  687   HG11  VAL  88          1HG1      VAL  88  -0.820   9.237  -6.965
  688   HG12  VAL  88          2HG1      VAL  88  -1.265   7.541  -7.133
  689   HG13  VAL  88          3HG1      VAL  88  -0.797   8.177  -5.556
  690   HG21  VAL  88          3HG2      VAL  88  -3.453   8.302  -8.168
  691   HG22  VAL  88          1HG2      VAL  88  -2.973   9.983  -7.936
  692   HG23  VAL  88          2HG2      VAL  88  -4.495   9.399  -7.265
  693    H    GLY  89           H        GLY  89  -5.266   6.171  -4.348
  694    HA2  GLY  89           1HA      GLY  89  -6.683   8.031  -2.893
  695    HA3  GLY  89           2HA      GLY  89  -7.404   8.042  -4.496
  696    H    ALA  90           H        ALA  90  -8.107   7.003  -1.653
  697    HA   ALA  90           HA       ALA  90  -8.507   4.230  -1.866
  698    HB1  ALA  90           1HB      ALA  90  -8.601   5.689   0.189
  699    HB2  ALA  90           2HB      ALA  90  -9.813   4.412   0.063
  700    HB3  ALA  90           3HB      ALA  90 -10.246   6.084  -0.296
  701    H    ASN  91           H        ASN  91  -9.627   3.316  -3.404
  702    HA   ASN  91           HA       ASN  91 -12.289   4.405  -3.993
  703    HB2  ASN  91           1HB      ASN  91 -10.215   3.869  -5.762
  704    HB3  ASN  91           2HB      ASN  91 -11.268   2.463  -5.908
  705   HD21  ASN  91          1HD2      ASN  91 -12.433   5.644  -5.048
  706   HD22  ASN  91          2HD2      ASN  91 -13.319   5.917  -6.503
  707    HA   PRO  92           HA       PRO  92 -13.058   1.172  -0.917
  708    HB2  PRO  92           1HB      PRO  92 -15.673   1.545  -2.336
  709    HB3  PRO  92           2HB      PRO  92 -15.361   1.308  -0.613
  710    HG2  PRO  92           1HG      PRO  92 -15.757   3.758  -1.687
  711    HG3  PRO  92           2HG      PRO  92 -14.699   3.484  -0.294
  712    HD2  PRO  92           1HD      PRO  92 -13.987   4.296  -2.997
  713    HD3  PRO  92           2HD      PRO  92 -12.970   4.244  -1.548
  714    H    ALA  93           H        ALA  93 -15.017   0.637  -3.857
  715    HA   ALA  93           HA       ALA  93 -14.568  -2.206  -3.551
  716    HB1  ALA  93           1HB      ALA  93 -16.226  -2.459  -5.323
  717    HB2  ALA  93           2HB      ALA  93 -16.227  -0.714  -5.581
  718    HB3  ALA  93           3HB      ALA  93 -16.812  -1.381  -4.057
  719    H    ALA  94           H        ALA  94 -13.721   0.332  -5.858
  720    HA   ALA  94           HA       ALA  94 -12.781  -1.401  -7.883
  721    HB1  ALA  94           1HB      ALA  94 -13.368   0.975  -8.246
  722    HB2  ALA  94           2HB      ALA  94 -11.788   0.538  -8.892
  723    HB3  ALA  94           3HB      ALA  94 -11.903   1.434  -7.381
  724    H    ILE  95           H        ILE  95 -11.266  -0.092  -5.015
  725    HA   ILE  95           HA       ILE  95  -8.598  -0.815  -5.782
  726    HB   ILE  95           HB       ILE  95  -9.789  -0.108  -3.107
  727   HG12  ILE  95          1HG1      ILE  95  -9.576   1.748  -4.684
  728   HG13  ILE  95          2HG1      ILE  95  -8.432   1.927  -3.358
  729   HG21  ILE  95          1HG2      ILE  95  -7.980  -1.660  -2.721
  730   HG22  ILE  95          2HG2      ILE  95  -7.479  -0.034  -2.258
  731   HG23  ILE  95          3HG2      ILE  95  -6.925  -0.731  -3.782
  732   HD11  ILE  95          3HD1      ILE  95  -7.850   1.035  -6.167
  733   HD12  ILE  95          1HD1      ILE  95  -6.683   0.963  -4.847
  734   HD13  ILE  95          2HD1      ILE  95  -7.328   2.517  -5.368
  735    H    LYS  96           H        LYS  96 -10.980  -2.172  -3.539
  736    HA   LYS  96           HA       LYS  96  -9.472  -4.447  -2.849
  737    HB2  LYS  96           1HB      LYS  96 -12.464  -4.033  -2.803
  738    HB3  LYS  96           2HB      LYS  96 -11.597  -5.326  -1.963
  739    HG2  LYS  96           1HG      LYS  96 -10.355  -3.556  -0.707
  740    HG3  LYS  96           2HG      LYS  96 -11.432  -2.367  -1.437
  741    HD2  LYS  96           1HD      LYS  96 -12.296  -4.681   0.298
  742    HD3  LYS  96           2HD      LYS  96 -12.129  -3.011   0.835
  743    HE2  LYS  96           1HE      LYS  96 -14.409  -3.235   0.431
  744    HE3  LYS  96           2HE      LYS  96 -13.806  -2.458  -1.030
  745    HZ1  LYS  96           3HZ      LYS  96 -15.392  -4.328  -1.393
  746    HZ2  LYS  96           1HZ      LYS  96 -14.217  -5.386  -0.793
  747    HZ3  LYS  96           2HZ      LYS  96 -13.924  -4.499  -2.202
  748    H    GLN  97           H        GLN  97 -11.469  -3.692  -5.565
  749    HA   GLN  97           HA       GLN  97 -11.537  -6.405  -6.544
  750    HB2  GLN  97           1HB      GLN  97 -13.334  -4.789  -7.076
  751    HB3  GLN  97           2HB      GLN  97 -12.178  -3.808  -7.964
  752    HG2  GLN  97           1HG      GLN  97 -13.563  -5.166  -9.445
  753    HG3  GLN  97           2HG      GLN  97 -11.856  -5.591  -9.570
  754   HE21  GLN  97          1HE2      GLN  97 -11.158  -7.578  -8.832
  755   HE22  GLN  97          2HE2      GLN  97 -12.251  -8.869  -8.453
  756    H    ALA  98           H        ALA  98  -9.406  -3.682  -6.740
  757    HA   ALA  98           HA       ALA  98  -8.084  -4.441  -9.164
  758    HB1  ALA  98           1HB      ALA  98  -6.417  -2.792  -8.551
  759    HB2  ALA  98           2HB      ALA  98  -7.123  -2.654  -6.941
  760    HB3  ALA  98           3HB      ALA  98  -8.040  -2.134  -8.354
  761    H    ILE  99           H        ILE  99  -7.255  -4.560  -5.761
  762    HA   ILE  99           HA       ILE  99  -4.889  -5.936  -5.841
  763    HB   ILE  99           HB       ILE  99  -7.099  -6.196  -3.803
  764   HG12  ILE  99          1HG1      ILE  99  -4.704  -4.456  -3.484
  765   HG13  ILE  99          2HG1      ILE  99  -5.955  -3.924  -4.612
  766   HG21  ILE  99          1HG2      ILE  99  -5.449  -7.960  -3.565
  767   HG22  ILE  99          2HG2      ILE  99  -5.263  -6.776  -2.270
  768   HG23  ILE  99          3HG2      ILE  99  -4.147  -6.775  -3.637
  769   HD11  ILE  99          3HD1      ILE  99  -7.591  -3.957  -2.903
  770   HD12  ILE  99          1HD1      ILE  99  -6.210  -3.015  -2.351
  771   HD13  ILE  99          2HD1      ILE  99  -6.452  -4.657  -1.750
  772    H    ALA 100           H        ALA 100  -8.180  -7.302  -5.812
  773    HA   ALA 100           HA       ALA 100  -7.401 -10.018  -5.830
  774    HB1  ALA 100           1HB      ALA 100  -9.693 -10.483  -6.516
  775    HB2  ALA 100           2HB      ALA 100  -9.938  -8.778  -6.893
  776    HB3  ALA 100           3HB      ALA 100  -9.657  -9.281  -5.226
  777    H    ALA 101           H        ALA 101  -7.809  -7.644  -8.366
  778    HA   ALA 101           HA       ALA 101  -7.737  -9.473 -10.559
  779    HB1  ALA 101           1HB      ALA 101  -7.103  -6.518 -10.557
  780    HB2  ALA 101           2HB      ALA 101  -8.730  -7.200 -10.679
  781    HB3  ALA 101           3HB      ALA 101  -7.546  -7.512 -11.949
  782    H    ASN 102           H        ASN 102  -5.341  -7.604  -8.798
  783    HA   ASN 102           HA       ASN 102  -3.235  -8.195 -10.688
  784    HB2  ASN 102           1HB      ASN 102  -3.165  -6.817  -8.005
  785    HB3  ASN 102           2HB      ASN 102  -1.788  -6.956  -9.089
  786   HD21  ASN 102          1HD2      ASN 102  -4.697  -5.327  -8.381
  787   HD22  ASN 102          2HD2      ASN 102  -4.687  -4.208  -9.699
  788    H    ALA 103           H        ALA 103  -4.560  -9.651  -7.903
  789    HA   ALA 103           HA       ALA 103  -2.244 -11.185  -7.188
  790    HB1  ALA 103           1HB      ALA 103  -4.000 -10.701  -5.550
  791    HB2  ALA 103           2HB      ALA 103  -3.770 -12.438  -5.748
  792    HB3  ALA 103           3HB      ALA 103  -5.150 -11.641  -6.503
  Start of MODEL   12
    1    H1   MET   1           1H       MET   1  -6.153  -5.777  10.170
    2    H2   MET   1           2H       MET   1  -6.511  -5.397  11.776
    3    H3   MET   1           3H       MET   1  -5.184  -6.380  11.414
    4    HA   MET   1           HA       MET   1  -5.488  -3.533  10.674
    5    HB2  MET   1           1HB      MET   1  -5.054  -3.655  13.018
    6    HB3  MET   1           2HB      MET   1  -3.863  -4.926  12.803
    7    HG2  MET   1           1HG      MET   1  -2.811  -2.800  13.324
    8    HG3  MET   1           2HG      MET   1  -2.351  -3.367  11.722
    9    HE1  MET   1           3HE      MET   1  -5.590  -1.501  13.052
   10    HE2  MET   1           1HE      MET   1  -5.182   0.157  12.615
   11    HE3  MET   1           2HE      MET   1  -4.223  -0.699  13.820
   12    H    VAL   2           H        VAL   2  -3.940  -2.677   9.417
   13    HA   VAL   2           HA       VAL   2  -2.348  -4.516   7.827
   14    HB   VAL   2           HB       VAL   2  -3.057  -1.597   7.569
   15   HG11  VAL   2          1HG1      VAL   2  -1.374  -3.270   5.708
   16   HG12  VAL   2          2HG1      VAL   2  -0.809  -1.911   6.676
   17   HG13  VAL   2          3HG1      VAL   2  -1.971  -1.644   5.376
   18   HG21  VAL   2          3HG2      VAL   2  -3.863  -4.084   6.094
   19   HG22  VAL   2          1HG2      VAL   2  -4.230  -2.454   5.544
   20   HG23  VAL   2          2HG2      VAL   2  -4.874  -3.034   7.076
   21    H    THR   3           H        THR   3  -0.155  -4.623   7.863
   22    HA   THR   3           HA       THR   3   1.046  -3.879  10.344
   23    HB   THR   3           HB       THR   3   2.364  -5.157   7.943
   24    HG1  THR   3           1HG      THR   3   0.539  -6.107   9.824
   25   HG21  THR   3          3HG2      THR   3   3.922  -4.381   9.683
   26   HG22  THR   3          1HG2      THR   3   3.873  -6.142   9.594
   27   HG23  THR   3          2HG2      THR   3   3.022  -5.301  10.890
   28    H    GLN   4           H        GLN   4   2.768  -2.600  10.780
   29    HA   GLN   4           HA       GLN   4   3.104  -0.300   9.025
   30    HB2  GLN   4           1HB      GLN   4   2.577  -0.097  11.456
   31    HB3  GLN   4           2HB      GLN   4   4.137  -0.814  11.818
   32    HG2  GLN   4           1HG      GLN   4   4.182   1.618  12.037
   33    HG3  GLN   4           2HG      GLN   4   5.290   1.042  10.794
   34   HE21  GLN   4          1HE2      GLN   4   1.837   1.247  10.353
   35   HE22  GLN   4          2HE2      GLN   4   1.869   2.530   9.201
   36    H    PHE   5           H        PHE   5   4.935   0.145   7.923
   37    HA   PHE   5           HA       PHE   5   7.246  -1.625   8.026
   38    HB2  PHE   5           1HB      PHE   5   6.562   0.849   6.454
   39    HB3  PHE   5           2HB      PHE   5   8.178   0.154   6.430
   40    HD1  PHE   5           1HD      PHE   5   7.089  -2.784   6.587
   41    HD2  PHE   5           2HD      PHE   5   6.197   0.563   4.119
   42    HE1  PHE   5           1HE      PHE   5   6.415  -4.302   4.780
   43    HE2  PHE   5           2HE      PHE   5   5.519  -0.954   2.309
   44    HZ   PHE   5           HZ       PHE   5   5.628  -3.387   2.637
   45    H    LYS   6           H        LYS   6   9.415  -0.562   8.068
   46    HA   LYS   6           HA       LYS   6   9.544   1.468  10.170
   47    HB2  LYS   6           1HB      LYS   6  11.520  -0.795  10.036
   48    HB3  LYS   6           2HB      LYS   6  11.158   0.262  11.393
   49    HG2  LYS   6           1HG      LYS   6   8.971  -0.819  11.640
   50    HG3  LYS   6           2HG      LYS   6   9.363  -1.890  10.294
   51    HD2  LYS   6           1HD      LYS   6  11.315  -2.716  11.584
   52    HD3  LYS   6           2HD      LYS   6  10.797  -1.718  12.944
   53    HE2  LYS   6           1HE      LYS   6   9.992  -3.906  13.364
   54    HE3  LYS   6           2HE      LYS   6   8.602  -2.944  12.868
   55    HZ1  LYS   6           3HZ      LYS   6  10.098  -4.906  11.215
   56    HZ2  LYS   6           1HZ      LYS   6   8.908  -3.870  10.593
   57    HZ3  LYS   6           2HZ      LYS   6   8.504  -5.031  11.758
   58    H    THR   7           H        THR   7  10.841   0.041   7.314
   59    HA   THR   7           HA       THR   7  12.465   2.409   6.801
   60    HB   THR   7           HB       THR   7  14.344   0.925   5.976
   61    HG1  THR   7           1HG      THR   7  14.166  -1.182   7.389
   62   HG21  THR   7          3HG2      THR   7  15.334   0.555   8.197
   63   HG22  THR   7          1HG2      THR   7  13.759   0.835   8.940
   64   HG23  THR   7          2HG2      THR   7  14.573   2.143   8.080
   65    H    ALA   8           H        ALA   8  13.397   2.214   4.454
   66    HA   ALA   8           HA       ALA   8  11.343   1.439   2.641
   67    HB1  ALA   8           1HB      ALA   8  13.038   1.859   0.885
   68    HB2  ALA   8           2HB      ALA   8  14.230   2.137   2.152
   69    HB3  ALA   8           3HB      ALA   8  12.833   3.204   2.002
   70    H    SER   9           H        SER   9  14.127  -0.091   4.020
   71    HA   SER   9           HA       SER   9  14.322  -2.356   2.397
   72    HB2  SER   9           1HB      SER   9  14.768  -2.171   5.387
   73    HB3  SER   9           2HB      SER   9  15.426  -3.399   4.305
   74    HG   SER   9           HG       SER   9  16.641  -1.804   3.287
   75    H    GLU  10           H        GLU  10  12.343  -1.711   5.288
   76    HA   GLU  10           HA       GLU  10  10.912  -4.056   5.453
   77    HB2  GLU  10           1HB      GLU  10  10.327  -1.215   6.081
   78    HB3  GLU  10           2HB      GLU  10   8.970  -2.330   6.049
   79    HG2  GLU  10           1HG      GLU  10  11.412  -2.986   7.594
   80    HG3  GLU  10           2HG      GLU  10  10.222  -1.897   8.261
   81    H    PHE  11           H        PHE  11  10.288  -1.240   3.362
   82    HA   PHE  11           HA       PHE  11   7.922  -2.202   2.199
   83    HB2  PHE  11           1HB      PHE  11   8.869   0.151   2.031
   84    HB3  PHE  11           2HB      PHE  11   9.964  -0.457   0.796
   85    HD1  PHE  11           2HD      PHE  11   8.913  -1.493  -1.300
   86    HD2  PHE  11           1HD      PHE  11   6.727   0.882   1.474
   87    HE1  PHE  11           2HE      PHE  11   7.206  -1.053  -3.017
   88    HE2  PHE  11           1HE      PHE  11   5.017   1.336  -0.260
   89    HZ   PHE  11           HZ       PHE  11   5.265   0.357  -2.492
   90    H    ASP  12           H        ASP  12  11.179  -2.216   0.814
   91    HA   ASP  12           HA       ASP  12  10.575  -3.747  -1.447
   92    HB2  ASP  12           1HB      ASP  12  12.585  -2.466  -1.414
   93    HB3  ASP  12           2HB      ASP  12  13.168  -3.289   0.027
   94    H    SER  13           H        SER  13  11.612  -4.779   1.776
   95    HA   SER  13           HA       SER  13  12.113  -7.470   1.168
   96    HB2  SER  13           1HB      SER  13  12.773  -6.402   3.299
   97    HB3  SER  13           2HB      SER  13  11.077  -6.316   3.770
   98    HG   SER  13           HG       SER  13  12.343  -8.760   3.095
   99    H    ALA  14           H        ALA  14   9.118  -5.873   2.255
  100    HA   ALA  14           HA       ALA  14   7.543  -8.207   2.256
  101    HB1  ALA  14           1HB      ALA  14   5.612  -6.682   2.252
  102    HB2  ALA  14           2HB      ALA  14   6.702  -5.329   1.923
  103    HB3  ALA  14           3HB      ALA  14   6.827  -6.214   3.443
  104    H    ILE  15           H        ILE  15   8.379  -5.850  -0.170
  105    HA   ILE  15           HA       ILE  15   6.533  -6.572  -2.163
  106    HB   ILE  15           HB       ILE  15   9.286  -5.419  -2.504
  107   HG12  ILE  15          1HG1      ILE  15   8.182  -3.835  -1.205
  108   HG13  ILE  15          2HG1      ILE  15   7.892  -3.298  -2.855
  109   HG21  ILE  15          1HG2      ILE  15   8.751  -4.836  -4.668
  110   HG22  ILE  15          2HG2      ILE  15   7.026  -5.053  -4.400
  111   HG23  ILE  15          3HG2      ILE  15   8.080  -6.460  -4.507
  112   HD11  ILE  15          3HD1      ILE  15   5.896  -3.113  -1.471
  113   HD12  ILE  15          1HD1      ILE  15   5.949  -4.847  -1.160
  114   HD13  ILE  15          2HD1      ILE  15   5.665  -4.252  -2.794
  115    H    ALA  16           H        ALA  16   9.686  -7.825  -1.310
  116    HA   ALA  16           HA       ALA  16  10.152  -9.198  -3.744
  117    HB1  ALA  16           1HB      ALA  16  11.946  -8.455  -2.253
  118    HB2  ALA  16           2HB      ALA  16  12.058 -10.176  -2.625
  119    HB3  ALA  16           3HB      ALA  16  11.434  -9.650  -1.062
  120    H    GLN  17           H        GLN  17   7.886  -9.843  -1.522
  121    HA   GLN  17           HA       GLN  17   8.034 -12.698  -1.464
  122    HB2  GLN  17           1HB      GLN  17   5.934 -10.672  -0.728
  123    HB3  GLN  17           2HB      GLN  17   5.638 -12.393  -0.656
  124    HG2  GLN  17           1HG      GLN  17   7.449 -12.659   0.939
  125    HG3  GLN  17           2HG      GLN  17   7.769 -10.930   0.857
  126   HE21  GLN  17          1HE2      GLN  17   5.045 -10.085   0.806
  127   HE22  GLN  17          2HE2      GLN  17   4.358 -10.413   2.363
  128    H    ASP  18           H        ASP  18   7.053 -14.119  -2.846
  129    HA   ASP  18           HA       ASP  18   6.094 -13.057  -5.355
  130    HB2  ASP  18           1HB      ASP  18   7.587 -15.052  -5.246
  131    HB3  ASP  18           2HB      ASP  18   6.280 -15.947  -4.479
  132    H    LYS  19           H        LYS  19   4.476 -12.234  -3.400
  133    HA   LYS  19           HA       LYS  19   1.953 -13.598  -4.064
  134    HB2  LYS  19           1HB      LYS  19   1.103 -13.121  -1.831
  135    HB3  LYS  19           2HB      LYS  19   2.584 -14.061  -1.691
  136    HG2  LYS  19           1HG      LYS  19   3.838 -12.130  -1.090
  137    HG3  LYS  19           2HG      LYS  19   2.485 -11.065  -1.461
  138    HD2  LYS  19           1HD      LYS  19   2.635 -11.306   0.913
  139    HD3  LYS  19           2HD      LYS  19   1.200 -12.168   0.357
  140    HE2  LYS  19           1HE      LYS  19   2.483 -14.273   0.444
  141    HE3  LYS  19           2HE      LYS  19   3.864 -13.380   1.076
  142    HZ1  LYS  19           3HZ      LYS  19   2.691 -14.352   2.891
  143    HZ2  LYS  19           1HZ      LYS  19   1.216 -13.706   2.371
  144    HZ3  LYS  19           2HZ      LYS  19   2.433 -12.677   2.947
  145    H    LEU  20           H        LEU  20   0.097 -11.904  -3.430
  146    HA   LEU  20           HA       LEU  20   0.807  -9.416  -4.719
  147    HB2  LEU  20           1HB      LEU  20  -1.403 -10.698  -4.989
  148    HB3  LEU  20           2HB      LEU  20  -1.839 -10.045  -3.419
  149    HG   LEU  20           HG       LEU  20  -2.776  -8.785  -5.367
  150   HD11  LEU  20          1HD1      LEU  20  -2.449  -7.708  -3.175
  151   HD12  LEU  20          2HD1      LEU  20  -2.292  -6.584  -4.525
  152   HD13  LEU  20          3HD1      LEU  20  -0.852  -7.179  -3.701
  153   HD21  LEU  20          3HD2      LEU  20  -0.779  -9.096  -6.810
  154   HD22  LEU  20          1HD2      LEU  20   0.066  -7.910  -5.813
  155   HD23  LEU  20          2HD2      LEU  20  -1.361  -7.429  -6.730
  156    H    VAL  21           H        VAL  21   1.762  -7.874  -3.623
  157    HA   VAL  21           HA       VAL  21   1.242  -7.617  -0.738
  158    HB   VAL  21           HB       VAL  21   3.417  -6.181  -2.239
  159   HG11  VAL  21          1HG1      VAL  21   2.926  -5.428   0.023
  160   HG12  VAL  21          2HG1      VAL  21   4.521  -6.176  -0.059
  161   HG13  VAL  21          3HG1      VAL  21   3.166  -7.067   0.631
  162   HG21  VAL  21          3HG2      VAL  21   3.726  -8.507  -2.798
  163   HG22  VAL  21          1HG2      VAL  21   3.569  -8.970  -1.102
  164   HG23  VAL  21          2HG2      VAL  21   4.954  -8.015  -1.631
  165    H    VAL  22           H        VAL  22  -0.096  -6.021  -0.127
  166    HA   VAL  22           HA       VAL  22  -0.413  -3.717  -1.940
  167    HB   VAL  22           HB       VAL  22  -2.286  -4.505   0.289
  168   HG11  VAL  22          1HG1      VAL  22  -3.850  -3.002  -0.840
  169   HG12  VAL  22          2HG1      VAL  22  -2.619  -2.622  -2.043
  170   HG13  VAL  22          3HG1      VAL  22  -2.378  -2.158  -0.359
  171   HG21  VAL  22          3HG2      VAL  22  -3.774  -5.381  -1.447
  172   HG22  VAL  22          1HG2      VAL  22  -2.263  -6.286  -1.351
  173   HG23  VAL  22          2HG2      VAL  22  -2.511  -5.117  -2.649
  174    H    VAL  23           H        VAL  23   0.702  -2.004  -1.305
  175    HA   VAL  23           HA       VAL  23   1.149  -1.700   1.577
  176    HB   VAL  23           HB       VAL  23   2.729  -0.384  -0.625
  177   HG11  VAL  23          1HG1      VAL  23   2.674   0.754   1.567
  178   HG12  VAL  23          2HG1      VAL  23   4.277   0.162   1.144
  179   HG13  VAL  23          3HG1      VAL  23   3.294  -0.714   2.318
  180   HG21  VAL  23          3HG2      VAL  23   4.484  -2.031  -0.038
  181   HG22  VAL  23          1HG2      VAL  23   3.051  -2.780  -0.746
  182   HG23  VAL  23          2HG2      VAL  23   3.317  -2.855   0.997
  183    H    ALA  24           H        ALA  24   0.385  -0.100   2.616
  184    HA   ALA  24           HA       ALA  24  -1.286   1.871   1.216
  185    HB1  ALA  24           1HB      ALA  24  -1.133   1.391   4.186
  186    HB2  ALA  24           2HB      ALA  24  -2.108   0.383   3.125
  187    HB3  ALA  24           3HB      ALA  24  -2.449   2.108   3.257
  188    H    PHE  25           H        PHE  25   0.087   3.561   0.637
  189    HA   PHE  25           HA       PHE  25   1.736   4.674   2.799
  190    HB2  PHE  25           1HB      PHE  25   2.058   4.546  -0.108
  191    HB3  PHE  25           2HB      PHE  25   2.450   6.114   0.594
  192    HD1  PHE  25           2HD      PHE  25   2.888   2.595   1.675
  193    HD2  PHE  25           1HD      PHE  25   4.706   6.356   0.936
  194    HE1  PHE  25           2HE      PHE  25   5.033   1.698   2.459
  195    HE2  PHE  25           1HE      PHE  25   6.861   5.473   1.727
  196    HZ   PHE  25           HZ       PHE  25   7.022   3.137   2.490
  197    H    TYR  26           H        TYR  26   1.068   6.333   3.858
  198    HA   TYR  26           HA       TYR  26  -0.313   8.498   2.535
  199    HB2  TYR  26           1HB      TYR  26  -2.183   8.521   4.151
  200    HB3  TYR  26           2HB      TYR  26  -2.201   7.095   3.129
  201    HD1  TYR  26           2HD      TYR  26  -1.484   4.893   4.091
  202    HD2  TYR  26           1HD      TYR  26  -2.044   8.334   6.525
  203    HE1  TYR  26           2HE      TYR  26  -1.658   3.453   6.070
  204    HE2  TYR  26           1HE      TYR  26  -2.215   6.906   8.515
  205    HH   TYR  26           HH       TYR  26  -2.824   4.561   9.047
  206    H    ALA  27           H        ALA  27  -0.535  10.377   4.001
  207    HA   ALA  27           HA       ALA  27   1.624  10.343   5.999
  208    HB1  ALA  27           1HB      ALA  27   2.093  11.744   4.031
  209    HB2  ALA  27           2HB      ALA  27   1.991  12.688   5.516
  210    HB3  ALA  27           3HB      ALA  27   0.646  12.689   4.376
  211    H    THR  28           H        THR  28   1.189  10.983   8.016
  212    HA   THR  28           HA       THR  28  -1.498  11.056   8.875
  213    HB   THR  28           HB       THR  28  -0.454  11.755  11.103
  214    HG1  THR  28           1HG      THR  28   2.028  10.946  10.104
  215   HG21  THR  28          3HG2      THR  28   0.442   9.526  11.497
  216   HG22  THR  28          1HG2      THR  28   0.580   9.254   9.761
  217   HG23  THR  28          2HG2      THR  28  -1.009   9.428  10.501
  218    H    TRP  29           H        TRP  29   0.639  13.615   7.891
  219    HA   TRP  29           HA       TRP  29  -0.877  15.684   9.185
  220    HB2  TRP  29           1HB      TRP  29   0.453  17.260   7.833
  221    HB3  TRP  29           2HB      TRP  29   1.469  16.105   8.679
  222    HD1  TRP  29           HD       TRP  29   3.116  14.707   7.255
  223    HE1  TRP  29           1HE      TRP  29   3.660  14.556   4.742
  224    HE3  TRP  29           3HE      TRP  29  -0.783  17.451   5.410
  225    HZ2  TRP  29           2HZ      TRP  29   2.579  15.476   2.308
  226    HZ3  TRP  29           3HZ      TRP  29  -0.956  17.765   2.981
  227    HH2  TRP  29           HH       TRP  29   0.693  16.802   1.459
  228    H    CYS  30           H        CYS  30  -1.261  13.793   6.417
  229    HA   CYS  30           HA       CYS  30  -2.751  15.735   4.881
  230    HB2  CYS  30           1HB      CYS  30  -1.358  14.024   3.775
  231    HB3  CYS  30           2HB      CYS  30  -2.360  12.758   4.474
  232    HG   CYS  30           HG       CYS  30  -3.291  15.030   2.094
  233    H    GLY  31           H        GLY  31  -4.977  15.660   4.493
  234    HA2  GLY  31           1HA      GLY  31  -6.552  14.767   6.711
  235    HA3  GLY  31           2HA      GLY  31  -7.142  15.577   5.270
  236    HA   PRO  32           HA       PRO  32  -8.886  11.968   3.588
  237    HB2  PRO  32           1HB      PRO  32  -7.849  11.584   1.105
  238    HB3  PRO  32           2HB      PRO  32  -8.971  12.888   1.505
  239    HG2  PRO  32           1HG      PRO  32  -5.985  12.964   1.286
  240    HG3  PRO  32           2HG      PRO  32  -7.181  14.116   0.662
  241    HD2  PRO  32           1HD      PRO  32  -5.810  14.583   2.927
  242    HD3  PRO  32           2HD      PRO  32  -7.497  15.101   2.731
  243    H    CYS  33           H        CYS  33  -5.821  11.629   4.624
  244    HA   CYS  33           HA       CYS  33  -5.009   9.161   3.481
  245    HB2  CYS  33           1HB      CYS  33  -3.512   8.993   5.427
  246    HB3  CYS  33           2HB      CYS  33  -3.442  10.595   4.702
  247    HG   CYS  33           HG       CYS  33  -4.073  11.923   6.813
  248    H    LYS  34           H        LYS  34  -7.293  10.062   5.871
  249    HA   LYS  34           HA       LYS  34  -7.504   7.693   7.349
  250    HB2  LYS  34           1HB      LYS  34  -9.689   9.676   6.708
  251    HB3  LYS  34           2HB      LYS  34  -9.702   8.506   8.018
  252    HG2  LYS  34           1HG      LYS  34  -7.780   9.641   9.033
  253    HG3  LYS  34           2HG      LYS  34  -7.819  10.835   7.732
  254    HD2  LYS  34           1HD      LYS  34 -10.122  11.428   8.392
  255    HD3  LYS  34           2HD      LYS  34 -10.012  10.286   9.730
  256    HE2  LYS  34           1HE      LYS  34  -9.585  12.530  10.520
  257    HE3  LYS  34           2HE      LYS  34  -8.120  11.556  10.637
  258    HZ1  LYS  34           3HZ      LYS  34  -8.721  13.468   8.450
  259    HZ2  LYS  34           1HZ      LYS  34  -7.295  12.580   8.634
  260    HZ3  LYS  34           2HZ      LYS  34  -7.693  13.778   9.756
  261    H    MET  35           H        MET  35  -8.468   8.435   4.122
  262    HA   MET  35           HA       MET  35 -10.627   6.587   3.906
  263    HB2  MET  35           1HB      MET  35  -9.574   8.518   2.271
  264    HB3  MET  35           2HB      MET  35  -9.003   7.044   1.485
  265    HG2  MET  35           1HG      MET  35 -11.833   7.925   1.992
  266    HG3  MET  35           2HG      MET  35 -11.048   7.579   0.453
  267    HE1  MET  35           3HE      MET  35 -13.626   4.691   0.453
  268    HE2  MET  35           1HE      MET  35 -12.815   5.912  -0.530
  269    HE3  MET  35           2HE      MET  35 -13.838   6.403   0.823
  270    H    ILE  36           H        ILE  36  -7.154   6.417   3.478
  271    HA   ILE  36           HA       ILE  36  -7.151   3.782   2.383
  272    HB   ILE  36           HB       ILE  36  -5.203   5.846   2.977
  273   HG12  ILE  36          1HG1      ILE  36  -4.162   5.030   0.996
  274   HG13  ILE  36          2HG1      ILE  36  -4.972   3.477   1.137
  275   HG21  ILE  36          1HG2      ILE  36  -4.457   3.018   3.641
  276   HG22  ILE  36          2HG2      ILE  36  -4.260   4.465   4.629
  277   HG23  ILE  36          3HG2      ILE  36  -3.273   4.242   3.185
  278   HD11  ILE  36          3HD1      ILE  36  -6.530   6.005   0.798
  279   HD12  ILE  36          1HD1      ILE  36  -7.016   4.340   0.486
  280   HD13  ILE  36          2HD1      ILE  36  -5.855   5.132  -0.585
  281    H    ALA  37           H        ALA  37  -7.076   5.177   5.555
  282    HA   ALA  37           HA       ALA  37  -6.120   3.071   7.046
  283    HB1  ALA  37           1HB      ALA  37  -6.603   5.138   8.114
  284    HB2  ALA  37           2HB      ALA  37  -7.576   3.889   8.892
  285    HB3  ALA  37           3HB      ALA  37  -8.317   4.999   7.744
  286    HA   PRO  38           HA       PRO  38 -10.130   0.729   7.426
  287    HB2  PRO  38           1HB      PRO  38 -12.522   1.538   6.585
  288    HB3  PRO  38           2HB      PRO  38 -11.789   2.221   8.043
  289    HG2  PRO  38           1HG      PRO  38 -11.946   3.361   5.287
  290    HG3  PRO  38           2HG      PRO  38 -12.156   4.171   6.850
  291    HD2  PRO  38           1HD      PRO  38  -9.824   4.190   5.353
  292    HD3  PRO  38           2HD      PRO  38  -9.926   4.515   7.091
  293    H    MET  39           H        MET  39 -10.030   2.248   4.188
  294    HA   MET  39           HA       MET  39 -11.509   0.147   2.929
  295    HB2  MET  39           1HB      MET  39 -11.447   2.305   1.862
  296    HB3  MET  39           2HB      MET  39  -9.697   2.338   1.902
  297    HG2  MET  39           1HG      MET  39 -11.155   0.274   0.304
  298    HG3  MET  39           2HG      MET  39 -10.892   1.899  -0.324
  299    HE1  MET  39           3HE      MET  39  -6.897   2.004   0.056
  300    HE2  MET  39           1HE      MET  39  -7.837   1.952   1.553
  301    HE3  MET  39           2HE      MET  39  -8.366   2.968   0.202
  302    H    ILE  40           H        ILE  40  -8.164   0.741   3.630
  303    HA   ILE  40           HA       ILE  40  -7.247  -1.482   2.059
  304    HB   ILE  40           HB       ILE  40  -6.072   0.756   3.492
  305   HG12  ILE  40          1HG1      ILE  40  -5.028  -0.890   1.199
  306   HG13  ILE  40          2HG1      ILE  40  -6.242   0.372   1.024
  307   HG21  ILE  40          1HG2      ILE  40  -4.599  -1.875   3.488
  308   HG22  ILE  40          2HG2      ILE  40  -5.066  -0.915   4.892
  309   HG23  ILE  40          3HG2      ILE  40  -3.850  -0.305   3.774
  310   HD11  ILE  40          3HD1      ILE  40  -4.253   1.412   0.475
  311   HD12  ILE  40          1HD1      ILE  40  -3.369   0.624   1.778
  312   HD13  ILE  40          2HD1      ILE  40  -4.529   1.893   2.145
  313    H    GLU  41           H        GLU  41  -7.725  -0.795   5.528
  314    HA   GLU  41           HA       GLU  41  -6.878  -3.359   6.377
  315    HB2  GLU  41           1HB      GLU  41  -8.807  -1.360   7.567
  316    HB3  GLU  41           2HB      GLU  41  -8.491  -2.915   8.331
  317    HG2  GLU  41           1HG      GLU  41  -6.067  -2.313   8.357
  318    HG3  GLU  41           2HG      GLU  41  -6.527  -0.701   7.812
  319    H    LYS  42           H        LYS  42  -9.645  -2.250   4.711
  320    HA   LYS  42           HA       LYS  42 -11.387  -4.388   5.427
  321    HB2  LYS  42           1HB      LYS  42 -12.196  -2.141   4.796
  322    HB3  LYS  42           2HB      LYS  42 -11.623  -2.407   3.157
  323    HG2  LYS  42           1HG      LYS  42 -13.943  -2.828   3.143
  324    HG3  LYS  42           2HG      LYS  42 -13.158  -4.406   3.076
  325    HD2  LYS  42           1HD      LYS  42 -13.491  -4.665   5.491
  326    HD3  LYS  42           2HD      LYS  42 -14.287  -3.092   5.544
  327    HE2  LYS  42           1HE      LYS  42 -16.005  -3.936   3.997
  328    HE3  LYS  42           2HE      LYS  42 -15.223  -5.515   4.015
  329    HZ1  LYS  42           3HZ      LYS  42 -15.588  -5.516   6.473
  330    HZ2  LYS  42           1HZ      LYS  42 -17.004  -5.589   5.543
  331    HZ3  LYS  42           2HZ      LYS  42 -16.550  -4.136   6.277
  332    H    PHE  43           H        PHE  43  -9.229  -3.730   2.651
  333    HA   PHE  43           HA       PHE  43 -10.238  -5.772   1.010
  334    HB2  PHE  43           1HB      PHE  43  -8.393  -5.525  -0.397
  335    HB3  PHE  43           2HB      PHE  43  -8.484  -3.959   0.393
  336    HD1  PHE  43           2HD      PHE  43  -6.735  -7.250   0.702
  337    HD2  PHE  43           1HD      PHE  43  -6.550  -3.033   1.236
  338    HE1  PHE  43           2HE      PHE  43  -4.363  -7.437   1.313
  339    HE2  PHE  43           1HE      PHE  43  -4.175  -3.217   1.842
  340    HZ   PHE  43           HZ       PHE  43  -3.080  -5.420   1.888
  341    H    SER  44           H        SER  44  -7.778  -5.942   3.614
  342    HA   SER  44           HA       SER  44  -7.408  -8.780   3.118
  343    HB2  SER  44           1HB      SER  44  -6.397  -7.800   5.671
  344    HB3  SER  44           2HB      SER  44  -5.553  -8.587   4.330
  345    HG   SER  44           HG       SER  44  -5.133  -6.666   3.447
  346    H    GLU  45           H        GLU  45  -9.484  -6.797   5.039
  347    HA   GLU  45           HA       GLU  45 -10.250  -8.739   6.942
  348    HB2  GLU  45           1HB      GLU  45 -10.878  -6.310   7.028
  349    HB3  GLU  45           2HB      GLU  45 -12.003  -6.601   5.709
  350    HG2  GLU  45           1HG      GLU  45 -13.259  -8.151   7.093
  351    HG3  GLU  45           2HG      GLU  45 -12.114  -7.920   8.413
  352    H    GLN  46           H        GLN  46 -10.934  -8.263   3.580
  353    HA   GLN  46           HA       GLN  46 -12.969 -10.322   3.523
  354    HB2  GLN  46           1HB      GLN  46 -11.670  -8.849   1.221
  355    HB3  GLN  46           2HB      GLN  46 -13.106  -9.857   1.135
  356    HG2  GLN  46           1HG      GLN  46 -12.847  -7.236   2.590
  357    HG3  GLN  46           2HG      GLN  46 -13.702  -7.518   1.075
  358   HE21  GLN  46          1HE2      GLN  46 -13.751  -7.919   4.512
  359   HE22  GLN  46          2HE2      GLN  46 -15.408  -8.390   4.646
  360    H    TYR  47           H        TYR  47  -9.697  -9.733   2.276
  361    HA   TYR  47           HA       TYR  47  -9.253 -12.606   2.345
  362    HB2  TYR  47           1HB      TYR  47  -7.967 -12.386   0.171
  363    HB3  TYR  47           2HB      TYR  47  -9.718 -12.346   0.095
  364    HD1  TYR  47           2HD      TYR  47  -6.788 -10.022   0.215
  365    HD2  TYR  47           1HD      TYR  47 -10.761 -10.720  -1.129
  366    HE1  TYR  47           2HE      TYR  47  -6.693  -7.970  -1.133
  367    HE2  TYR  47           1HE      TYR  47 -10.677  -8.665  -2.473
  368    HH   TYR  47           HH       TYR  47  -9.514  -6.740  -2.812
  369    HA   PRO  48           HA       PRO  48  -5.666 -10.724   4.426
  370    HB2  PRO  48           1HB      PRO  48  -5.217 -12.822   6.065
  371    HB3  PRO  48           2HB      PRO  48  -6.382 -11.551   6.436
  372    HG2  PRO  48           1HG      PRO  48  -6.860 -14.285   5.325
  373    HG3  PRO  48           2HG      PRO  48  -7.789 -13.392   6.541
  374    HD2  PRO  48           1HD      PRO  48  -8.548 -13.583   3.932
  375    HD3  PRO  48           2HD      PRO  48  -8.946 -12.192   4.958
  376    H    GLN  49           H        GLN  49  -6.191 -13.070   2.218
  377    HA   GLN  49           HA       GLN  49  -3.862 -14.629   2.141
  378    HB2  GLN  49           1HB      GLN  49  -5.811 -15.218   0.839
  379    HB3  GLN  49           2HB      GLN  49  -5.733 -13.701  -0.043
  380    HG2  GLN  49           1HG      GLN  49  -3.286 -14.753  -0.566
  381    HG3  GLN  49           2HG      GLN  49  -4.279 -16.206  -0.462
  382   HE21  GLN  49          1HE2      GLN  49  -5.286 -13.013  -1.581
  383   HE22  GLN  49          2HE2      GLN  49  -5.626 -13.507  -3.203
  384    H    ALA  50           H        ALA  50  -4.448 -11.346   1.287
  385    HA   ALA  50           HA       ALA  50  -1.927 -11.195  -0.225
  386    HB1  ALA  50           1HB      ALA  50  -3.939 -10.209  -1.245
  387    HB2  ALA  50           2HB      ALA  50  -2.690  -8.998  -0.919
  388    HB3  ALA  50           3HB      ALA  50  -4.091  -9.128   0.143
  389    H    ASP  51           H        ASP  51  -0.397  -9.440   0.412
  390    HA   ASP  51           HA       ASP  51  -0.370  -9.460   3.315
  391    HB2  ASP  51           1HB      ASP  51   1.710  -9.663   1.394
  392    HB3  ASP  51           2HB      ASP  51   1.994  -8.212   2.339
  393    H    PHE  52           H        PHE  52  -0.817  -7.873   4.507
  394    HA   PHE  52           HA       PHE  52  -1.372  -5.280   3.310
  395    HB2  PHE  52           1HB      PHE  52  -2.325  -4.979   5.755
  396    HB3  PHE  52           2HB      PHE  52  -3.240  -5.839   4.531
  397    HD1  PHE  52           2HD      PHE  52  -1.312  -6.136   7.621
  398    HD2  PHE  52           1HD      PHE  52  -3.517  -8.245   4.657
  399    HE1  PHE  52           2HE      PHE  52  -1.436  -8.089   9.107
  400    HE2  PHE  52           1HE      PHE  52  -3.644 -10.202   6.139
  401    HZ   PHE  52           HZ       PHE  52  -2.601 -10.126   8.367
  402    H    TYR  53           H        TYR  53   0.177  -3.802   3.394
  403    HA   TYR  53           HA       TYR  53   1.490  -3.374   5.972
  404    HB2  TYR  53           1HB      TYR  53   2.947  -3.473   3.317
  405    HB3  TYR  53           2HB      TYR  53   3.643  -2.889   4.820
  406    HD1  TYR  53           2HD      TYR  53   4.060  -4.491   6.682
  407    HD2  TYR  53           1HD      TYR  53   2.815  -5.794   2.829
  408    HE1  TYR  53           2HE      TYR  53   4.826  -6.766   7.211
  409    HE2  TYR  53           1HE      TYR  53   3.577  -8.077   3.342
  410    HH   TYR  53           HH       TYR  53   4.288  -9.117   6.438
  411    H    LYS  54           H        LYS  54   2.226  -1.236   6.306
  412    HA   LYS  54           HA       LYS  54   1.321   0.788   4.425
  413    HB2  LYS  54           1HB      LYS  54  -0.215   1.817   5.946
  414    HB3  LYS  54           2HB      LYS  54  -0.634   0.110   5.827
  415    HG2  LYS  54           1HG      LYS  54   0.461  -0.329   7.950
  416    HG3  LYS  54           2HG      LYS  54   0.920   1.371   8.074
  417    HD2  LYS  54           1HD      LYS  54  -1.460   1.995   8.064
  418    HD3  LYS  54           2HD      LYS  54  -1.896   0.286   7.992
  419    HE2  LYS  54           1HE      LYS  54  -0.778  -0.083  10.137
  420    HE3  LYS  54           2HE      LYS  54  -0.344   1.625  10.204
  421    HZ1  LYS  54           3HZ      LYS  54  -2.707   2.167  10.215
  422    HZ2  LYS  54           1HZ      LYS  54  -2.294   1.190  11.531
  423    HZ3  LYS  54           2HZ      LYS  54  -3.099   0.525  10.204
  424    H    LEU  55           H        LEU  55   1.957   2.991   5.131
  425    HA   LEU  55           HA       LEU  55   3.805   3.234   7.316
  426    HB2  LEU  55           1HB      LEU  55   5.255   2.212   5.677
  427    HB3  LEU  55           2HB      LEU  55   4.742   3.352   4.451
  428    HG   LEU  55           HG       LEU  55   6.092   4.417   6.894
  429   HD11  LEU  55          1HD1      LEU  55   7.456   3.021   4.599
  430   HD12  LEU  55          2HD1      LEU  55   7.554   2.607   6.310
  431   HD13  LEU  55          3HD1      LEU  55   8.272   4.106   5.721
  432   HD21  LEU  55          3HD2      LEU  55   6.298   5.166   3.987
  433   HD22  LEU  55          1HD2      LEU  55   6.812   6.116   5.382
  434   HD23  LEU  55          2HD2      LEU  55   5.092   5.834   5.086
  435    H    ASP  56           H        ASP  56   4.138   5.354   7.899
  436    HA   ASP  56           HA       ASP  56   2.417   7.330   6.628
  437    HB2  ASP  56           1HB      ASP  56   2.285   7.173   9.041
  438    HB3  ASP  56           2HB      ASP  56   4.025   7.373   9.191
  439    H    VAL  57           H        VAL  57   3.190   8.593   5.097
  440    HA   VAL  57           HA       VAL  57   5.902   8.638   4.309
  441    HB   VAL  57           HB       VAL  57   3.796  10.679   3.580
  442   HG11  VAL  57          1HG1      VAL  57   6.034  11.302   2.899
  443   HG12  VAL  57          2HG1      VAL  57   5.078  10.852   1.487
  444   HG13  VAL  57          3HG1      VAL  57   6.268   9.729   2.142
  445   HG21  VAL  57          3HG2      VAL  57   4.332   7.976   2.359
  446   HG22  VAL  57          1HG2      VAL  57   3.292   9.215   1.655
  447   HG23  VAL  57          2HG2      VAL  57   2.869   8.485   3.203
  448    H    ASP  58           H        ASP  58   4.095  10.536   6.581
  449    HA   ASP  58           HA       ASP  58   5.802  12.809   6.626
  450    HB2  ASP  58           1HB      ASP  58   3.503  12.808   7.566
  451    HB3  ASP  58           2HB      ASP  58   4.046  11.724   8.840
  452    H    GLU  59           H        GLU  59   5.781   9.712   8.218
  453    HA   GLU  59           HA       GLU  59   7.991  10.315   9.951
  454    HB2  GLU  59           1HB      GLU  59   6.579   7.751   9.227
  455    HB3  GLU  59           2HB      GLU  59   7.958   7.803  10.317
  456    HG2  GLU  59           1HG      GLU  59   5.382   9.298  10.738
  457    HG3  GLU  59           2HG      GLU  59   5.785   7.750  11.477
  458    H    LEU  60           H        LEU  60   7.543   8.599   6.875
  459    HA   LEU  60           HA       LEU  60  10.459   8.661   6.529
  460    HB2  LEU  60           1HB      LEU  60   8.676   6.265   6.154
  461    HB3  LEU  60           2HB      LEU  60  10.317   6.355   5.547
  462    HG   LEU  60           HG       LEU  60   9.595   6.620   8.466
  463   HD11  LEU  60          1HD1      LEU  60   8.992   4.404   7.669
  464   HD12  LEU  60          2HD1      LEU  60  10.417   4.332   8.706
  465   HD13  LEU  60          3HD1      LEU  60  10.593   4.212   6.956
  466   HD21  LEU  60          3HD2      LEU  60  11.994   6.182   8.795
  467   HD22  LEU  60          1HD2      LEU  60  11.705   7.664   7.885
  468   HD23  LEU  60          2HD2      LEU  60  12.224   6.202   7.047
  469    H    GLY  61           H        GLY  61   9.927  10.476   5.177
  470    HA2  GLY  61           1HA      GLY  61   8.332  10.227   2.838
  471    HA3  GLY  61           2HA      GLY  61   9.492  11.504   3.170
  472    H    ASP  62           H        ASP  62  11.738   9.701   3.505
  473    HA   ASP  62           HA       ASP  62  12.665   9.507   0.861
  474    HB2  ASP  62           1HB      ASP  62  14.284   9.665   2.599
  475    HB3  ASP  62           2HB      ASP  62  13.621   8.262   3.427
  476    H    VAL  63           H        VAL  63  11.157   7.178   2.957
  477    HA   VAL  63           HA       VAL  63  11.516   4.917   1.308
  478    HB   VAL  63           HB       VAL  63   9.291   5.489   3.254
  479   HG11  VAL  63          1HG1      VAL  63  10.207   2.907   1.994
  480   HG12  VAL  63          2HG1      VAL  63   8.672   3.724   1.722
  481   HG13  VAL  63          3HG1      VAL  63   9.030   3.027   3.300
  482   HG21  VAL  63          3HG2      VAL  63  11.804   3.873   3.660
  483   HG22  VAL  63          1HG2      VAL  63  10.573   4.241   4.865
  484   HG23  VAL  63          2HG2      VAL  63  11.589   5.533   4.219
  485    H    ALA  64           H        ALA  64   8.760   7.182   1.648
  486    HA   ALA  64           HA       ALA  64   7.145   6.192  -0.348
  487    HB1  ALA  64           1HB      ALA  64   7.638   9.084   0.337
  488    HB2  ALA  64           2HB      ALA  64   6.481   8.007   1.119
  489    HB3  ALA  64           3HB      ALA  64   6.260   8.463  -0.570
  490    H    GLN  65           H        GLN  65  10.010   8.215  -0.642
  491    HA   GLN  65           HA       GLN  65   9.686   8.746  -3.439
  492    HB2  GLN  65           1HB      GLN  65  12.172   8.874  -1.719
  493    HB3  GLN  65           2HB      GLN  65  12.036   9.514  -3.350
  494    HG2  GLN  65           1HG      GLN  65  10.312  11.073  -2.585
  495    HG3  GLN  65           2HG      GLN  65  10.479  10.439  -0.948
  496   HE21  GLN  65          1HE2      GLN  65  13.392  10.135  -1.250
  497   HE22  GLN  65          2HE2      GLN  65  14.040  11.731  -1.115
  498    H    LYS  66           H        LYS  66  11.312   6.288  -1.552
  499    HA   LYS  66           HA       LYS  66  12.739   5.023  -3.570
  500    HB2  LYS  66           1HB      LYS  66  13.404   4.176  -1.581
  501    HB3  LYS  66           2HB      LYS  66  11.847   4.479  -0.824
  502    HG2  LYS  66           1HG      LYS  66  12.065   2.191  -0.726
  503    HG3  LYS  66           2HG      LYS  66  11.037   2.456  -2.126
  504    HD2  LYS  66           1HD      LYS  66  13.155   2.341  -3.525
  505    HD3  LYS  66           2HD      LYS  66  13.959   1.737  -2.075
  506    HE2  LYS  66           1HE      LYS  66  13.274  -0.124  -3.453
  507    HE3  LYS  66           2HE      LYS  66  12.318  -0.103  -1.971
  508    HZ1  LYS  66           3HZ      LYS  66  11.395   1.027  -4.558
  509    HZ2  LYS  66           1HZ      LYS  66  10.479   0.826  -3.151
  510    HZ3  LYS  66           2HZ      LYS  66  11.010  -0.526  -4.016
  511    H    ASN  67           H        ASN  67   9.332   5.091  -2.921
  512    HA   ASN  67           HA       ASN  67   8.895   2.608  -4.429
  513    HB2  ASN  67           1HB      ASN  67   6.881   4.102  -2.790
  514    HB3  ASN  67           2HB      ASN  67   6.834   2.434  -3.307
  515   HD21  ASN  67          1HD2      ASN  67   6.905   4.059  -0.725
  516   HD22  ASN  67          2HD2      ASN  67   7.980   3.167   0.263
  517    H    GLU  68           H        GLU  68   8.666   5.962  -4.622
  518    HA   GLU  68           HA       GLU  68   7.996   7.314  -6.302
  519    HB2  GLU  68           1HB      GLU  68   8.336   5.364  -7.815
  520    HB3  GLU  68           2HB      GLU  68   6.644   4.933  -7.570
  521    HG2  GLU  68           1HG      GLU  68   7.081   6.149  -9.684
  522    HG3  GLU  68           2HG      GLU  68   5.932   6.970  -8.629
  523    H    VAL  69           H        VAL  69   6.522   6.660  -3.862
  524    HA   VAL  69           HA       VAL  69   3.866   7.559  -4.734
  525    HB   VAL  69           HB       VAL  69   3.340   5.822  -3.327
  526   HG11  VAL  69          1HG1      VAL  69   4.508   5.076  -1.403
  527   HG12  VAL  69          2HG1      VAL  69   5.486   6.546  -1.344
  528   HG13  VAL  69          3HG1      VAL  69   5.709   5.391  -2.651
  529   HG21  VAL  69          3HG2      VAL  69   2.544   6.709  -1.216
  530   HG22  VAL  69          1HG2      VAL  69   2.270   7.868  -2.515
  531   HG23  VAL  69          2HG2      VAL  69   3.601   8.109  -1.384
  532    H    SER  70           H        SER  70   3.580   9.653  -4.739
  533    HA   SER  70           HA       SER  70   5.030  11.278  -2.758
  534    HB2  SER  70           1HB      SER  70   5.867  11.568  -5.081
  535    HB3  SER  70           2HB      SER  70   4.254  12.079  -5.575
  536    HG   SER  70           HG       SER  70   5.144  13.478  -3.416
  537    H    ALA  71           H        ALA  71   2.000  10.427  -4.103
  538    HA   ALA  71           HA       ALA  71   0.691  12.796  -2.988
  539    HB1  ALA  71           1HB      ALA  71  -1.285  12.074  -4.204
  540    HB2  ALA  71           2HB      ALA  71  -0.466  10.591  -4.689
  541    HB3  ALA  71           3HB      ALA  71   0.106  12.149  -5.283
  542    H    MET  72           H        MET  72  -1.178  12.541  -1.610
  543    HA   MET  72           HA       MET  72  -1.241   9.969  -0.193
  544    HB2  MET  72           1HB      MET  72  -1.458  12.713   1.060
  545    HB3  MET  72           2HB      MET  72  -1.716  11.197   1.908
  546    HG2  MET  72           1HG      MET  72   0.435  11.759   2.495
  547    HG3  MET  72           2HG      MET  72   0.679  10.627   1.167
  548    HE1  MET  72           3HE      MET  72   3.174  11.457   0.936
  549    HE2  MET  72           1HE      MET  72   2.923  12.589   2.263
  550    HE3  MET  72           2HE      MET  72   3.633  13.149   0.748
  551    HA   PRO  73           HA       PRO  73  -2.252   8.712   0.651
  552    HB2  PRO  73           1HB      PRO  73  -4.247   6.828   0.390
  553    HB3  PRO  73           2HB      PRO  73  -3.971   7.819   1.818
  554    HG2  PRO  73           1HG      PRO  73  -6.185   7.900  -0.006
  555    HG3  PRO  73           2HG      PRO  73  -5.936   8.871   1.453
  556    HD2  PRO  73           1HD      PRO  73  -5.502   9.575  -1.372
  557    HD3  PRO  73           2HD      PRO  73  -5.698  10.635   0.038
  558    H    THR  74           H        THR  74  -1.521   6.643  -0.236
  559    HA   THR  74           HA       THR  74  -2.130   6.170  -3.065
  560    HB   THR  74           HB       THR  74   0.625   6.673  -1.937
  561    HG1  THR  74           1HG      THR  74   0.027   8.552  -2.743
  562   HG21  THR  74          3HG2      THR  74  -0.129   5.338  -4.539
  563   HG22  THR  74          1HG2      THR  74   0.911   4.716  -3.253
  564   HG23  THR  74          2HG2      THR  74   1.453   6.072  -4.240
  565    H    LEU  75           H        LEU  75  -2.362   4.116  -3.508
  566    HA   LEU  75           HA       LEU  75  -1.357   2.090  -1.627
  567    HB2  LEU  75           1HB      LEU  75  -3.265   1.857  -3.946
  568    HB3  LEU  75           2HB      LEU  75  -2.807   0.547  -2.878
  569    HG   LEU  75           HG       LEU  75  -3.810   2.386  -1.122
  570   HD11  LEU  75          1HD1      LEU  75  -4.577   3.823  -2.973
  571   HD12  LEU  75          2HD1      LEU  75  -5.924   3.176  -2.039
  572   HD13  LEU  75          3HD1      LEU  75  -5.530   2.482  -3.610
  573   HD21  LEU  75          3HD2      LEU  75  -5.794   0.881  -1.132
  574   HD22  LEU  75          1HD2      LEU  75  -4.246   0.037  -1.068
  575   HD23  LEU  75          2HD2      LEU  75  -5.147   0.118  -2.584
  576    H    LEU  76           H        LEU  76   0.308   0.754  -2.260
  577    HA   LEU  76           HA       LEU  76   0.826   0.622  -5.147
  578    HB2  LEU  76           1HB      LEU  76   2.598   1.554  -3.153
  579    HB3  LEU  76           2HB      LEU  76   3.194  -0.015  -3.666
  580    HG   LEU  76           HG       LEU  76   2.573   2.265  -5.543
  581   HD11  LEU  76          1HD1      LEU  76   4.491   2.713  -4.026
  582   HD12  LEU  76          2HD1      LEU  76   4.938   2.632  -5.736
  583   HD13  LEU  76          3HD1      LEU  76   5.278   1.267  -4.660
  584   HD21  LEU  76          3HD2      LEU  76   2.321   0.088  -6.584
  585   HD22  LEU  76          1HD2      LEU  76   3.903  -0.413  -5.988
  586   HD23  LEU  76          2HD2      LEU  76   3.778   0.878  -7.186
  587    H    LEU  77           H        LEU  77   0.263  -1.248  -5.868
  588    HA   LEU  77           HA       LEU  77   0.420  -3.658  -4.208
  589    HB2  LEU  77           1HB      LEU  77  -0.777  -3.091  -6.925
  590    HB3  LEU  77           2HB      LEU  77  -0.655  -4.703  -6.261
  591    HG   LEU  77           HG       LEU  77  -2.300  -4.260  -4.603
  592   HD11  LEU  77          1HD1      LEU  77  -3.304  -2.081  -4.227
  593   HD12  LEU  77          2HD1      LEU  77  -2.244  -1.357  -5.437
  594   HD13  LEU  77          3HD1      LEU  77  -1.565  -1.999  -3.939
  595   HD21  LEU  77          3HD2      LEU  77  -3.148  -2.887  -7.144
  596   HD22  LEU  77          1HD2      LEU  77  -4.203  -3.652  -5.953
  597   HD23  LEU  77          2HD2      LEU  77  -3.086  -4.635  -6.904
  598    H    PHE  78           H        PHE  78   2.025  -5.088  -4.471
  599    HA   PHE  78           HA       PHE  78   3.628  -4.920  -6.935
  600    HB2  PHE  78           1HB      PHE  78   4.530  -5.084  -4.083
  601    HB3  PHE  78           2HB      PHE  78   5.529  -5.739  -5.373
  602    HD1  PHE  78           1HD      PHE  78   6.581  -4.274  -6.995
  603    HD2  PHE  78           2HD      PHE  78   4.242  -2.721  -3.807
  604    HE1  PHE  78           1HE      PHE  78   7.566  -2.052  -7.366
  605    HE2  PHE  78           2HE      PHE  78   5.218  -0.508  -4.174
  606    HZ   PHE  78           HZ       PHE  78   6.881  -0.160  -5.951
  607    H    LYS  79           H        LYS  79   4.488  -6.940  -7.705
  608    HA   LYS  79           HA       LYS  79   3.970  -9.260  -5.959
  609    HB2  LYS  79           1HB      LYS  79   2.320  -9.235  -7.824
  610    HB3  LYS  79           2HB      LYS  79   3.662  -9.293  -8.959
  611    HG2  LYS  79           1HG      LYS  79   4.366 -11.444  -7.976
  612    HG3  LYS  79           2HG      LYS  79   2.946 -11.396  -6.929
  613    HD2  LYS  79           1HD      LYS  79   1.481 -11.464  -8.842
  614    HD3  LYS  79           2HD      LYS  79   2.856 -11.353  -9.942
  615    HE2  LYS  79           1HE      LYS  79   2.315 -13.613  -8.022
  616    HE3  LYS  79           2HE      LYS  79   2.011 -13.648  -9.755
  617    HZ1  LYS  79           3HZ      LYS  79   4.460 -13.182 -10.019
  618    HZ2  LYS  79           1HZ      LYS  79   4.064 -14.713  -9.421
  619    HZ3  LYS  79           2HZ      LYS  79   4.631 -13.519  -8.370
  620    H    ASN  80           H        ASN  80   5.735 -10.317  -5.504
  621    HA   ASN  80           HA       ASN  80   7.900 -10.928  -5.383
  622    HB2  ASN  80           1HB      ASN  80   8.786 -12.124  -7.355
  623    HB3  ASN  80           2HB      ASN  80   7.166 -12.621  -6.904
  624   HD21  ASN  80          1HD2      ASN  80   9.148 -11.105  -9.297
  625   HD22  ASN  80          2HD2      ASN  80   7.957 -11.078 -10.548
  626    H    GLY  81           H        GLY  81   7.939  -8.271  -5.391
  627    HA2  GLY  81           1HA      GLY  81   9.669  -6.711  -5.424
  628    HA3  GLY  81           2HA      GLY  81  10.586  -7.805  -6.456
  629    H    LYS  82           H        LYS  82   7.663  -7.582  -7.897
  630    HA   LYS  82           HA       LYS  82   8.496  -5.258  -9.512
  631    HB2  LYS  82           1HB      LYS  82   6.748  -7.533 -10.470
  632    HB3  LYS  82           2HB      LYS  82   7.519  -6.287 -11.440
  633    HG2  LYS  82           1HG      LYS  82   9.731  -7.276 -10.699
  634    HG3  LYS  82           2HG      LYS  82   8.798  -8.640 -10.078
  635    HD2  LYS  82           1HD      LYS  82   8.882  -7.665 -12.934
  636    HD3  LYS  82           2HD      LYS  82   9.628  -9.134 -12.304
  637    HE2  LYS  82           1HE      LYS  82   7.371  -9.962 -11.700
  638    HE3  LYS  82           2HE      LYS  82   6.677  -8.525 -12.446
  639    HZ1  LYS  82           3HZ      LYS  82   7.625  -9.189 -14.555
  640    HZ2  LYS  82           1HZ      LYS  82   6.642 -10.425 -13.946
  641    HZ3  LYS  82           2HZ      LYS  82   8.325 -10.556 -13.849
  642    H    GLU  83           H        GLU  83   6.618  -4.019 -10.393
  643    HA   GLU  83           HA       GLU  83   4.664  -3.610  -8.358
  644    HB2  GLU  83           1HB      GLU  83   5.642  -1.877  -9.961
  645    HB3  GLU  83           2HB      GLU  83   4.578  -2.549 -11.185
  646    HG2  GLU  83           1HG      GLU  83   2.635  -1.905  -9.951
  647    HG3  GLU  83           2HG      GLU  83   3.620  -1.421  -8.568
  648    H    VAL  84           H        VAL  84   2.263  -3.494  -9.089
  649    HA   VAL  84           HA       VAL  84   1.581  -5.080 -11.398
  650    HB   VAL  84           HB       VAL  84  -0.408  -6.046  -9.994
  651   HG11  VAL  84          1HG1      VAL  84   2.306  -7.335  -9.794
  652   HG12  VAL  84          2HG1      VAL  84   1.314  -7.331 -11.256
  653   HG13  VAL  84          3HG1      VAL  84   0.729  -8.138  -9.800
  654   HG21  VAL  84          3HG2      VAL  84   1.775  -5.813  -7.945
  655   HG22  VAL  84          1HG2      VAL  84   0.278  -6.727  -7.759
  656   HG23  VAL  84          2HG2      VAL  84   0.226  -4.971  -7.917
  657    H    ALA  85           H        ALA  85   0.708  -2.870  -8.837
  658    HA   ALA  85           HA       ALA  85  -0.656  -1.163 -10.618
  659    HB1  ALA  85           1HB      ALA  85  -2.911  -1.306  -9.538
  660    HB2  ALA  85           2HB      ALA  85  -2.364  -2.804  -8.781
  661    HB3  ALA  85           3HB      ALA  85  -2.467  -2.691 -10.533
  662    H    LYS  86           H        LYS  86  -0.798   0.894  -9.801
  663    HA   LYS  86           HA       LYS  86  -0.717   1.185  -6.884
  664    HB2  LYS  86           1HB      LYS  86   0.882   2.986  -6.980
  665    HB3  LYS  86           2HB      LYS  86   1.573   1.571  -7.754
  666    HG2  LYS  86           1HG      LYS  86   1.098   2.523  -9.942
  667    HG3  LYS  86           2HG      LYS  86   0.371   3.936  -9.175
  668    HD2  LYS  86           1HD      LYS  86   2.542   4.383  -8.063
  669    HD3  LYS  86           2HD      LYS  86   3.243   3.040  -8.967
  670    HE2  LYS  86           1HE      LYS  86   3.758   5.129 -10.066
  671    HE3  LYS  86           2HE      LYS  86   2.663   4.178 -11.068
  672    HZ1  LYS  86           3HZ      LYS  86   0.826   5.537 -10.306
  673    HZ2  LYS  86           1HZ      LYS  86   2.030   6.516 -10.979
  674    HZ3  LYS  86           2HZ      LYS  86   1.855   6.426  -9.300
  675    H    VAL  87           H        VAL  87  -1.992   2.796  -6.073
  676    HA   VAL  87           HA       VAL  87  -3.448   4.444  -8.023
  677    HB   VAL  87           HB       VAL  87  -4.821   2.930  -5.797
  678   HG11  VAL  87          1HG1      VAL  87  -5.893   4.675  -8.010
  679   HG12  VAL  87          2HG1      VAL  87  -5.888   5.043  -6.285
  680   HG13  VAL  87          3HG1      VAL  87  -6.881   3.722  -6.904
  681   HG21  VAL  87          3HG2      VAL  87  -4.133   1.383  -7.543
  682   HG22  VAL  87          1HG2      VAL  87  -4.858   2.419  -8.772
  683   HG23  VAL  87          2HG2      VAL  87  -5.881   1.613  -7.583
  684    H    VAL  88           H        VAL  88  -3.437   6.494  -7.459
  685    HA   VAL  88           HA       VAL  88  -2.618   7.233  -4.775
  686    HB   VAL  88           HB       VAL  88  -2.669   9.587  -5.733
  687   HG11  VAL  88          1HG1      VAL  88  -0.576   9.263  -6.979
  688   HG12  VAL  88          2HG1      VAL  88  -0.889   7.529  -7.037
  689   HG13  VAL  88          3HG1      VAL  88  -0.607   8.323  -5.488
  690   HG21  VAL  88          3HG2      VAL  88  -4.203   9.169  -7.591
  691   HG22  VAL  88          1HG2      VAL  88  -3.035   8.068  -8.318
  692   HG23  VAL  88          2HG2      VAL  88  -2.657   9.785  -8.177
  693    H    GLY  89           H        GLY  89  -4.926   6.145  -4.306
  694    HA2  GLY  89           1HA      GLY  89  -6.439   7.950  -2.965
  695    HA3  GLY  89           2HA      GLY  89  -7.128   7.976  -4.584
  696    H    ALA  90           H        ALA  90  -7.950   6.915  -1.801
  697    HA   ALA  90           HA       ALA  90  -8.322   4.131  -2.097
  698    HB1  ALA  90           1HB      ALA  90  -9.795   4.296  -0.228
  699    HB2  ALA  90           2HB      ALA  90 -10.000   6.027  -0.488
  700    HB3  ALA  90           3HB      ALA  90  -8.442   5.401   0.038
  701    H    ASN  91           H        ASN  91  -9.530   3.190  -3.549
  702    HA   ASN  91           HA       ASN  91 -12.082   4.455  -4.281
  703    HB2  ASN  91           1HB      ASN  91 -10.086   3.848  -5.998
  704    HB3  ASN  91           2HB      ASN  91 -10.950   2.312  -5.987
  705   HD21  ASN  91          1HD2      ASN  91 -13.514   3.711  -5.421
  706   HD22  ASN  91          2HD2      ASN  91 -13.998   4.373  -6.944
  707    HA   PRO  92           HA       PRO  92 -13.229   1.482  -1.038
  708    HB2  PRO  92           1HB      PRO  92 -15.713   1.719  -2.684
  709    HB3  PRO  92           2HB      PRO  92 -15.522   1.723  -0.929
  710    HG2  PRO  92           1HG      PRO  92 -15.719   3.989  -2.514
  711    HG3  PRO  92           2HG      PRO  92 -15.064   3.943  -0.872
  712    HD2  PRO  92           1HD      PRO  92 -13.660   4.556  -3.256
  713    HD3  PRO  92           2HD      PRO  92 -12.968   4.321  -1.651
  714    H    ALA  93           H        ALA  93 -15.195   0.568  -3.850
  715    HA   ALA  93           HA       ALA  93 -14.521  -2.191  -3.275
  716    HB1  ALA  93           1HB      ALA  93 -16.308  -2.768  -4.783
  717    HB2  ALA  93           2HB      ALA  93 -16.412  -1.104  -5.353
  718    HB3  ALA  93           3HB      ALA  93 -16.855  -1.497  -3.691
  719    H    ALA  94           H        ALA  94 -13.743   0.196  -5.671
  720    HA   ALA  94           HA       ALA  94 -12.951  -1.584  -7.735
  721    HB1  ALA  94           1HB      ALA  94 -13.462   0.774  -8.159
  722    HB2  ALA  94           2HB      ALA  94 -11.850   0.346  -8.733
  723    HB3  ALA  94           3HB      ALA  94 -12.039   1.246  -7.231
  724    H    ILE  95           H        ILE  95 -11.276  -0.192  -4.968
  725    HA   ILE  95           HA       ILE  95  -8.683  -1.081  -5.782
  726    HB   ILE  95           HB       ILE  95  -9.718  -0.246  -3.074
  727   HG12  ILE  95          1HG1      ILE  95  -9.622   1.573  -4.676
  728   HG13  ILE  95          2HG1      ILE  95  -8.332   1.764  -3.495
  729   HG21  ILE  95          1HG2      ILE  95  -7.897  -1.776  -2.730
  730   HG22  ILE  95          2HG2      ILE  95  -7.336  -0.134  -2.410
  731   HG23  ILE  95          3HG2      ILE  95  -6.916  -0.933  -3.927
  732   HD11  ILE  95          3HD1      ILE  95  -8.056   0.737  -6.308
  733   HD12  ILE  95          1HD1      ILE  95  -6.750   0.803  -5.124
  734   HD13  ILE  95          2HD1      ILE  95  -7.512   2.292  -5.683
  735    H    LYS  96           H        LYS  96 -11.130  -2.302  -3.534
  736    HA   LYS  96           HA       LYS  96  -9.702  -4.598  -2.728
  737    HB2  LYS  96           1HB      LYS  96 -12.708  -4.340  -2.888
  738    HB3  LYS  96           2HB      LYS  96 -11.774  -5.391  -1.817
  739    HG2  LYS  96           1HG      LYS  96 -11.004  -3.542  -0.542
  740    HG3  LYS  96           2HG      LYS  96 -11.660  -2.388  -1.707
  741    HD2  LYS  96           1HD      LYS  96 -13.932  -3.304  -1.204
  742    HD3  LYS  96           2HD      LYS  96 -13.199  -4.255   0.086
  743    HE2  LYS  96           1HE      LYS  96 -12.501  -2.260   1.231
  744    HE3  LYS  96           2HE      LYS  96 -13.042  -1.254  -0.113
  745    HZ1  LYS  96           3HZ      LYS  96 -14.813  -2.946   1.565
  746    HZ2  LYS  96           1HZ      LYS  96 -15.304  -1.918   0.318
  747    HZ3  LYS  96           2HZ      LYS  96 -14.632  -1.271   1.726
  748    H    GLN  97           H        GLN  97 -11.564  -3.838  -5.550
  749    HA   GLN  97           HA       GLN  97 -11.589  -6.538  -6.545
  750    HB2  GLN  97           1HB      GLN  97 -13.279  -4.894  -7.293
  751    HB3  GLN  97           2HB      GLN  97 -12.004  -3.922  -8.020
  752    HG2  GLN  97           1HG      GLN  97 -11.476  -6.170  -9.284
  753    HG3  GLN  97           2HG      GLN  97 -13.156  -6.521  -8.899
  754   HE21  GLN  97          1HE2      GLN  97 -11.898  -3.316  -9.576
  755   HE22  GLN  97          2HE2      GLN  97 -12.723  -3.112 -11.077
  756    H    ALA  98           H        ALA  98  -9.440  -3.782  -6.698
  757    HA   ALA  98           HA       ALA  98  -8.045  -4.577  -9.049
  758    HB1  ALA  98           1HB      ALA  98  -6.404  -2.897  -8.414
  759    HB2  ALA  98           2HB      ALA  98  -7.172  -2.737  -6.834
  760    HB3  ALA  98           3HB      ALA  98  -8.044  -2.262  -8.292
  761    H    ILE  99           H        ILE  99  -7.280  -4.673  -5.635
  762    HA   ILE  99           HA       ILE  99  -4.899  -6.024  -5.679
  763    HB   ILE  99           HB       ILE  99  -7.113  -6.332  -3.653
  764   HG12  ILE  99          1HG1      ILE  99  -4.793  -4.506  -3.306
  765   HG13  ILE  99          2HG1      ILE  99  -6.034  -4.019  -4.466
  766   HG21  ILE  99          1HG2      ILE  99  -5.243  -6.825  -2.120
  767   HG22  ILE  99          2HG2      ILE  99  -4.144  -6.807  -3.499
  768   HG23  ILE  99          3HG2      ILE  99  -5.408  -8.030  -3.398
  769   HD11  ILE  99          3HD1      ILE  99  -6.362  -3.120  -2.204
  770   HD12  ILE  99          1HD1      ILE  99  -6.586  -4.770  -1.621
  771   HD13  ILE  99          2HD1      ILE  99  -7.709  -4.089  -2.805
  772    H    ALA 100           H        ALA 100  -8.186  -7.399  -5.751
  773    HA   ALA 100           HA       ALA 100  -7.320 -10.114  -5.725
  774    HB1  ALA 100           1HB      ALA 100  -9.627 -10.646  -6.311
  775    HB2  ALA 100           2HB      ALA 100  -9.937  -8.946  -6.664
  776    HB3  ALA 100           3HB      ALA 100  -9.564  -9.450  -5.016
  777    H    ALA 101           H        ALA 101  -7.735  -7.724  -8.202
  778    HA   ALA 101           HA       ALA 101  -7.775  -9.534 -10.420
  779    HB1  ALA 101           1HB      ALA 101  -7.630  -7.559 -11.796
  780    HB2  ALA 101           2HB      ALA 101  -7.133  -6.581 -10.411
  781    HB3  ALA 101           3HB      ALA 101  -8.767  -7.254 -10.480
  782    H    ASN 102           H        ASN 102  -5.316  -7.714  -8.703
  783    HA   ASN 102           HA       ASN 102  -3.260  -8.281 -10.661
  784    HB2  ASN 102           1HB      ASN 102  -3.124  -6.935  -7.968
  785    HB3  ASN 102           2HB      ASN 102  -1.772  -7.068  -9.080
  786   HD21  ASN 102          1HD2      ASN 102  -4.668  -5.449  -8.300
  787   HD22  ASN 102          2HD2      ASN 102  -4.669  -4.301  -9.593
  788    H    ALA 103           H        ALA 103  -4.464  -9.684  -7.775
  789    HA   ALA 103           HA       ALA 103  -2.168 -11.139  -6.994
  790    HB1  ALA 103           1HB      ALA 103  -4.076 -10.745  -5.501
  791    HB2  ALA 103           2HB      ALA 103  -3.692 -12.459  -5.636
  792    HB3  ALA 103           3HB      ALA 103  -5.074 -11.795  -6.507
  Start of MODEL   13
    1    H1   MET   1           1H       MET   1  -5.503  -7.056  10.399
    2    H2   MET   1           2H       MET   1  -6.352  -5.927   9.476
    3    H3   MET   1           3H       MET   1  -6.774  -6.186  11.092
    4    HA   MET   1           HA       MET   1  -5.533  -4.124  10.818
    5    HB2  MET   1           1HB      MET   1  -5.362  -5.404  12.929
    6    HB3  MET   1           2HB      MET   1  -3.981  -6.278  12.272
    7    HG2  MET   1           1HG      MET   1  -3.225  -4.515  13.729
    8    HG3  MET   1           2HG      MET   1  -2.762  -4.163  12.062
    9    HE1  MET   1           3HE      MET   1  -2.473  -1.671  11.945
   10    HE2  MET   1           1HE      MET   1  -2.383  -1.800  13.701
   11    HE3  MET   1           2HE      MET   1  -3.366  -0.538  12.960
   12    H    VAL   2           H        VAL   2  -4.230  -3.100   9.495
   13    HA   VAL   2           HA       VAL   2  -2.425  -4.593   7.798
   14    HB   VAL   2           HB       VAL   2  -3.218  -1.684   7.840
   15   HG11  VAL   2          1HG1      VAL   2  -2.135  -1.505   5.665
   16   HG12  VAL   2          2HG1      VAL   2  -1.575  -3.172   5.798
   17   HG13  VAL   2          3HG1      VAL   2  -0.968  -1.947   6.911
   18   HG21  VAL   2          3HG2      VAL   2  -3.966  -3.935   5.992
   19   HG22  VAL   2          1HG2      VAL   2  -4.520  -2.267   5.880
   20   HG23  VAL   2          2HG2      VAL   2  -4.988  -3.260   7.260
   21    H    THR   3           H        THR   3  -0.267  -4.551   7.838
   22    HA   THR   3           HA       THR   3   0.900  -3.873  10.385
   23    HB   THR   3           HB       THR   3   2.349  -5.045   8.013
   24    HG1  THR   3           1HG      THR   3   1.168  -6.787   8.194
   25   HG21  THR   3          3HG2      THR   3   2.664  -5.424  10.995
   26   HG22  THR   3          1HG2      THR   3   3.705  -4.440   9.965
   27   HG23  THR   3          2HG2      THR   3   3.646  -6.190   9.747
   28    H    GLN   4           H        GLN   4   2.598  -2.550  10.784
   29    HA   GLN   4           HA       GLN   4   2.835  -0.279   8.969
   30    HB2  GLN   4           1HB      GLN   4   2.229   0.079  11.316
   31    HB3  GLN   4           2HB      GLN   4   3.720  -0.691  11.830
   32    HG2  GLN   4           1HG      GLN   4   3.824   1.760  11.955
   33    HG3  GLN   4           2HG      GLN   4   5.042   1.075  10.882
   34   HE21  GLN   4          1HE2      GLN   4   1.664   1.431  10.058
   35   HE22  GLN   4          2HE2      GLN   4   1.897   2.625   8.836
   36    H    PHE   5           H        PHE   5   4.670   0.261   7.922
   37    HA   PHE   5           HA       PHE   5   6.993  -1.467   8.068
   38    HB2  PHE   5           1HB      PHE   5   6.319   0.972   6.449
   39    HB3  PHE   5           2HB      PHE   5   7.935   0.287   6.451
   40    HD1  PHE   5           1HD      PHE   5   7.024  -2.650   6.542
   41    HD2  PHE   5           2HD      PHE   5   5.827   0.680   4.180
   42    HE1  PHE   5           1HE      PHE   5   6.401  -4.171   4.717
   43    HE2  PHE   5           2HE      PHE   5   5.194  -0.840   2.355
   44    HZ   PHE   5           HZ       PHE   5   5.482  -3.267   2.621
   45    H    LYS   6           H        LYS   6   9.182  -0.406   8.178
   46    HA   LYS   6           HA       LYS   6   9.177   1.793  10.123
   47    HB2  LYS   6           1HB      LYS   6  11.291  -0.354   9.970
   48    HB3  LYS   6           2HB      LYS   6  11.070   0.844  11.236
   49    HG2  LYS   6           1HG      LYS   6   8.990  -0.232  11.903
   50    HG3  LYS   6           2HG      LYS   6   9.192  -1.416  10.611
   51    HD2  LYS   6           1HD      LYS   6   9.912  -2.379  12.708
   52    HD3  LYS   6           2HD      LYS   6  11.307  -2.145  11.655
   53    HE2  LYS   6           1HE      LYS   6  11.837  -0.063  12.857
   54    HE3  LYS   6           2HE      LYS   6  10.468  -0.348  13.929
   55    HZ1  LYS   6           3HZ      LYS   6  12.856  -2.091  13.645
   56    HZ2  LYS   6           1HZ      LYS   6  11.531  -2.412  14.646
   57    HZ3  LYS   6           2HZ      LYS   6  12.516  -1.072  14.949
   58    H    THR   7           H        THR   7  10.897   0.201   7.495
   59    HA   THR   7           HA       THR   7  11.953   2.806   6.669
   60    HB   THR   7           HB       THR   7  14.173   1.854   6.159
   61    HG1  THR   7           1HG      THR   7  13.234  -0.418   7.626
   62   HG21  THR   7          3HG2      THR   7  13.412   1.553   9.066
   63   HG22  THR   7          1HG2      THR   7  13.876   3.057   8.270
   64   HG23  THR   7          2HG2      THR   7  15.049   1.752   8.441
   65    H    ALA   8           H        ALA   8  13.203   2.391   4.436
   66    HA   ALA   8           HA       ALA   8  11.312   1.333   2.617
   67    HB1  ALA   8           1HB      ALA   8  14.212   1.954   2.109
   68    HB2  ALA   8           2HB      ALA   8  12.893   3.121   2.030
   69    HB3  ALA   8           3HB      ALA   8  12.943   1.771   0.900
   70    H    SER   9           H        SER   9  14.037  -0.011   4.293
   71    HA   SER   9           HA       SER   9  14.451  -2.342   2.824
   72    HB2  SER   9           1HB      SER   9  15.869  -1.603   4.737
   73    HB3  SER   9           2HB      SER   9  14.564  -2.042   5.840
   74    HG   SER   9           HG       SER   9  15.753  -3.866   4.019
   75    H    GLU  10           H        GLU  10  12.255  -1.788   5.588
   76    HA   GLU  10           HA       GLU  10  10.880  -4.167   5.555
   77    HB2  GLU  10           1HB      GLU  10  10.154  -1.364   6.285
   78    HB3  GLU  10           2HB      GLU  10   8.933  -2.622   6.339
   79    HG2  GLU  10           1HG      GLU  10   9.898  -2.312   8.500
   80    HG3  GLU  10           2HG      GLU  10  10.329  -3.899   7.881
   81    H    PHE  11           H        PHE  11  10.345  -1.279   3.552
   82    HA   PHE  11           HA       PHE  11   7.934  -2.122   2.374
   83    HB2  PHE  11           1HB      PHE  11   8.799   0.215   2.262
   84    HB3  PHE  11           2HB      PHE  11  10.058  -0.322   1.158
   85    HD1  PHE  11           1HD      PHE  11   9.334  -1.293  -1.084
   86    HD2  PHE  11           2HD      PHE  11   6.687   0.873   1.451
   87    HE1  PHE  11           1HE      PHE  11   7.848  -0.866  -2.993
   88    HE2  PHE  11           2HE      PHE  11   5.185   1.306  -0.483
   89    HZ   PHE  11           HZ       PHE  11   5.788   0.427  -2.687
   90    H    ASP  12           H        ASP  12  11.217  -2.204   1.065
   91    HA   ASP  12           HA       ASP  12  10.632  -3.650  -1.268
   92    HB2  ASP  12           1HB      ASP  12  12.695  -2.361  -0.951
   93    HB3  ASP  12           2HB      ASP  12  13.224  -3.490   0.292
   94    H    SER  13           H        SER  13  11.487  -4.746   1.974
   95    HA   SER  13           HA       SER  13  11.937  -7.454   1.392
   96    HB2  SER  13           1HB      SER  13  12.483  -6.318   3.555
   97    HB3  SER  13           2HB      SER  13  10.762  -6.301   3.937
   98    HG   SER  13           HG       SER  13  12.440  -8.196   4.481
   99    H    ALA  14           H        ALA  14   8.943  -5.751   2.306
  100    HA   ALA  14           HA       ALA  14   7.282  -8.021   2.215
  101    HB1  ALA  14           1HB      ALA  14   6.512  -5.134   1.794
  102    HB2  ALA  14           2HB      ALA  14   6.633  -5.943   3.355
  103    HB3  ALA  14           3HB      ALA  14   5.413  -6.462   2.190
  104    H    ILE  15           H        ILE  15   8.421  -5.765  -0.171
  105    HA   ILE  15           HA       ILE  15   6.636  -6.349  -2.259
  106    HB   ILE  15           HB       ILE  15   9.510  -5.500  -2.488
  107   HG12  ILE  15          1HG1      ILE  15   8.548  -3.773  -1.255
  108   HG13  ILE  15          2HG1      ILE  15   8.371  -3.247  -2.925
  109   HG21  ILE  15          1HG2      ILE  15   9.127  -4.914  -4.673
  110   HG22  ILE  15          2HG2      ILE  15   7.378  -4.872  -4.461
  111   HG23  ILE  15          3HG2      ILE  15   8.216  -6.419  -4.519
  112   HD11  ILE  15          3HD1      ILE  15   6.050  -3.984  -2.918
  113   HD12  ILE  15          1HD1      ILE  15   6.359  -2.806  -1.642
  114   HD13  ILE  15          2HD1      ILE  15   6.223  -4.519  -1.247
  115    H    ALA  16           H        ALA  16   9.637  -7.842  -1.229
  116    HA   ALA  16           HA       ALA  16  10.019  -9.386  -3.586
  117    HB1  ALA  16           1HB      ALA  16  11.838 -10.441  -2.351
  118    HB2  ALA  16           2HB      ALA  16  11.266  -9.690  -0.861
  119    HB3  ALA  16           3HB      ALA  16  11.875  -8.688  -2.176
  120    H    GLN  17           H        GLN  17   7.641  -9.708  -1.469
  121    HA   GLN  17           HA       GLN  17   7.661 -12.529  -1.026
  122    HB2  GLN  17           1HB      GLN  17   5.641 -10.332  -0.677
  123    HB3  GLN  17           2HB      GLN  17   5.229 -12.011  -0.413
  124    HG2  GLN  17           1HG      GLN  17   6.937 -12.183   1.308
  125    HG3  GLN  17           2HG      GLN  17   7.392 -10.505   1.028
  126   HE21  GLN  17          1HE2      GLN  17   4.695  -9.551   0.706
  127   HE22  GLN  17          2HE2      GLN  17   3.963  -9.583   2.269
  128    H    ASP  18           H        ASP  18   6.581 -14.087  -2.156
  129    HA   ASP  18           HA       ASP  18   5.952 -13.495  -4.905
  130    HB2  ASP  18           1HB      ASP  18   5.672 -15.924  -5.141
  131    HB3  ASP  18           2HB      ASP  18   7.186 -15.534  -4.335
  132    H    LYS  19           H        LYS  19   4.212 -12.216  -3.127
  133    HA   LYS  19           HA       LYS  19   1.681 -13.275  -4.091
  134    HB2  LYS  19           1HB      LYS  19   0.601 -12.928  -1.869
  135    HB3  LYS  19           2HB      LYS  19   1.749 -14.258  -1.892
  136    HG2  LYS  19           1HG      LYS  19   3.341 -13.044  -0.667
  137    HG3  LYS  19           2HG      LYS  19   2.505 -11.515  -0.938
  138    HD2  LYS  19           1HD      LYS  19   2.195 -12.387   1.351
  139    HD3  LYS  19           2HD      LYS  19   0.675 -12.214   0.473
  140    HE2  LYS  19           1HE      LYS  19   0.687 -14.299   1.701
  141    HE3  LYS  19           2HE      LYS  19   0.716 -14.622  -0.028
  142    HZ1  LYS  19           3HZ      LYS  19   3.071 -15.059   0.108
  143    HZ2  LYS  19           1HZ      LYS  19   2.247 -16.039   1.213
  144    HZ3  LYS  19           2HZ      LYS  19   3.088 -14.676   1.753
  145    H    LEU  20           H        LEU  20  -0.102 -11.564  -3.348
  146    HA   LEU  20           HA       LEU  20   0.773  -9.115  -4.529
  147    HB2  LEU  20           1HB      LEU  20  -1.527 -10.237  -4.732
  148    HB3  LEU  20           2HB      LEU  20  -1.866  -9.562  -3.154
  149    HG   LEU  20           HG       LEU  20  -2.779  -8.251  -5.085
  150   HD11  LEU  20          1HD1      LEU  20  -0.775  -6.753  -3.414
  151   HD12  LEU  20          2HD1      LEU  20  -2.387  -7.229  -2.882
  152   HD13  LEU  20          3HD1      LEU  20  -2.199  -6.088  -4.213
  153   HD21  LEU  20          3HD2      LEU  20   0.121  -7.609  -5.576
  154   HD22  LEU  20          1HD2      LEU  20  -1.262  -6.874  -6.383
  155   HD23  LEU  20          2HD2      LEU  20  -0.911  -8.587  -6.621
  156    H    VAL  21           H        VAL  21   1.661  -7.481  -3.536
  157    HA   VAL  21           HA       VAL  21   1.455  -7.282  -0.617
  158    HB   VAL  21           HB       VAL  21   3.232  -5.528  -2.262
  159   HG11  VAL  21          1HG1      VAL  21   3.496  -6.762   0.473
  160   HG12  VAL  21          2HG1      VAL  21   3.051  -5.094   0.112
  161   HG13  VAL  21          3HG1      VAL  21   4.667  -5.679  -0.280
  162   HG21  VAL  21          3HG2      VAL  21   3.722  -8.432  -1.656
  163   HG22  VAL  21          1HG2      VAL  21   5.021  -7.292  -2.006
  164   HG23  VAL  21          2HG2      VAL  21   3.783  -7.611  -3.218
  165    H    VAL  22           H        VAL  22  -0.211  -6.050   0.024
  166    HA   VAL  22           HA       VAL  22  -0.989  -3.712  -1.542
  167    HB   VAL  22           HB       VAL  22  -2.174  -4.764   1.037
  168   HG11  VAL  22          1HG1      VAL  22  -3.275  -2.766  -0.935
  169   HG12  VAL  22          2HG1      VAL  22  -2.580  -2.373   0.637
  170   HG13  VAL  22          3HG1      VAL  22  -4.062  -3.324   0.542
  171   HG21  VAL  22          3HG2      VAL  22  -2.452  -6.396  -0.717
  172   HG22  VAL  22          1HG2      VAL  22  -3.058  -5.155  -1.817
  173   HG23  VAL  22          2HG2      VAL  22  -3.996  -5.609  -0.392
  174    H    VAL  23           H        VAL  23   0.425  -2.077  -1.246
  175    HA   VAL  23           HA       VAL  23   1.249  -1.528   1.510
  176    HB   VAL  23           HB       VAL  23   2.490  -0.494  -1.036
  177   HG11  VAL  23          1HG1      VAL  23   2.879   1.111   0.620
  178   HG12  VAL  23          2HG1      VAL  23   4.326   0.104   0.634
  179   HG13  VAL  23          3HG1      VAL  23   3.094  -0.106   1.875
  180   HG21  VAL  23          3HG2      VAL  23   4.370  -1.970  -0.393
  181   HG22  VAL  23          1HG2      VAL  23   2.896  -2.863  -0.780
  182   HG23  VAL  23          2HG2      VAL  23   3.365  -2.623   0.904
  183    H    ALA  24           H        ALA  24   0.345  -0.033   2.533
  184    HA   ALA  24           HA       ALA  24  -1.330   1.970   1.176
  185    HB1  ALA  24           1HB      ALA  24  -2.170   0.515   3.053
  186    HB2  ALA  24           2HB      ALA  24  -2.370   2.248   3.309
  187    HB3  ALA  24           3HB      ALA  24  -1.077   1.379   4.130
  188    H    PHE  25           H        PHE  25   0.198   3.566   0.538
  189    HA   PHE  25           HA       PHE  25   1.808   4.715   2.699
  190    HB2  PHE  25           1HB      PHE  25   2.123   4.552  -0.198
  191    HB3  PHE  25           2HB      PHE  25   2.487   6.145   0.466
  192    HD1  PHE  25           2HD      PHE  25   2.981   2.674   1.685
  193    HD2  PHE  25           1HD      PHE  25   4.747   6.419   0.746
  194    HE1  PHE  25           2HE      PHE  25   5.146   1.844   2.486
  195    HE2  PHE  25           1HE      PHE  25   6.919   5.602   1.558
  196    HZ   PHE  25           HZ       PHE  25   7.114   3.309   2.429
  197    H    TYR  26           H        TYR  26   0.962   6.249   3.826
  198    HA   TYR  26           HA       TYR  26  -0.429   8.422   2.459
  199    HB2  TYR  26           1HB      TYR  26  -2.149   8.480   4.262
  200    HB3  TYR  26           2HB      TYR  26  -2.248   7.045   3.253
  201    HD1  TYR  26           2HD      TYR  26  -1.669   4.857   4.143
  202    HD2  TYR  26           1HD      TYR  26  -1.514   8.318   6.608
  203    HE1  TYR  26           2HE      TYR  26  -1.609   3.423   6.128
  204    HE2  TYR  26           1HE      TYR  26  -1.444   6.893   8.610
  205    HH   TYR  26           HH       TYR  26  -2.107   4.608   9.266
  206    H    ALA  27           H        ALA  27  -0.616  10.348   3.913
  207    HA   ALA  27           HA       ALA  27   1.667  10.416   5.768
  208    HB1  ALA  27           1HB      ALA  27   1.992  11.765   3.724
  209    HB2  ALA  27           2HB      ALA  27   1.989  12.738   5.193
  210    HB3  ALA  27           3HB      ALA  27   0.567  12.711   4.150
  211    H    THR  28           H        THR  28   1.338  11.143   7.771
  212    HA   THR  28           HA       THR  28  -1.245  11.093   8.850
  213    HB   THR  28           HB       THR  28  -0.031  12.203  10.874
  214    HG1  THR  28           1HG      THR  28   2.323  11.234   9.702
  215   HG21  THR  28          3HG2      THR  28  -0.643   9.832  10.718
  216   HG22  THR  28          1HG2      THR  28   0.933  10.041  11.480
  217   HG23  THR  28          2HG2      THR  28   0.829   9.513   9.802
  218    H    TRP  29           H        TRP  29   0.582  13.778   7.578
  219    HA   TRP  29           HA       TRP  29  -1.053  15.779   8.835
  220    HB2  TRP  29           1HB      TRP  29   0.137  17.384   7.400
  221    HB3  TRP  29           2HB      TRP  29   1.253  16.316   8.239
  222    HD1  TRP  29           HD       TRP  29   2.911  14.936   6.779
  223    HE1  TRP  29           1HE      TRP  29   3.357  14.752   4.252
  224    HE3  TRP  29           3HE      TRP  29  -1.185  17.459   5.035
  225    HZ2  TRP  29           2HZ      TRP  29   2.139  15.567   1.841
  226    HZ3  TRP  29           3HZ      TRP  29  -1.473  17.708   2.609
  227    HH2  TRP  29           HH       TRP  29   0.159  16.784   1.042
  228    H    CYS  30           H        CYS  30  -1.452  13.713   6.208
  229    HA   CYS  30           HA       CYS  30  -2.991  15.517   4.562
  230    HB2  CYS  30           1HB      CYS  30  -1.614  13.702   3.583
  231    HB3  CYS  30           2HB      CYS  30  -2.650  12.514   4.360
  232    HG   CYS  30           HG       CYS  30  -3.664  14.723   1.945
  233    H    GLY  31           H        GLY  31  -5.223  15.474   4.274
  234    HA2  GLY  31           1HA      GLY  31  -6.751  14.843   6.580
  235    HA3  GLY  31           2HA      GLY  31  -7.385  15.398   5.041
  236    HA   PRO  32           HA       PRO  32  -9.066  11.494   4.156
  237    HB2  PRO  32           1HB      PRO  32  -8.470  10.933   1.586
  238    HB3  PRO  32           2HB      PRO  32  -9.535  12.265   2.048
  239    HG2  PRO  32           1HG      PRO  32  -6.642  12.331   1.291
  240    HG3  PRO  32           2HG      PRO  32  -7.951  13.421   0.801
  241    HD2  PRO  32           1HD      PRO  32  -6.170  14.030   2.763
  242    HD3  PRO  32           2HD      PRO  32  -7.839  14.634   2.747
  243    H    CYS  33           H        CYS  33  -6.015  11.388   4.974
  244    HA   CYS  33           HA       CYS  33  -5.054   8.961   3.836
  245    HB2  CYS  33           1HB      CYS  33  -3.466   8.949   5.737
  246    HB3  CYS  33           2HB      CYS  33  -3.520  10.512   4.928
  247    HG   CYS  33           HG       CYS  33  -4.234  11.932   6.962
  248    H    LYS  34           H        LYS  34  -7.196   9.783   6.401
  249    HA   LYS  34           HA       LYS  34  -7.267   7.279   7.713
  250    HB2  LYS  34           1HB      LYS  34  -9.375   8.103   8.715
  251    HB3  LYS  34           2HB      LYS  34  -8.056   9.256   8.852
  252    HG2  LYS  34           1HG      LYS  34  -8.982  10.493   6.927
  253    HG3  LYS  34           2HG      LYS  34 -10.341   9.367   6.891
  254    HD2  LYS  34           1HD      LYS  34 -10.952  10.031   9.166
  255    HD3  LYS  34           2HD      LYS  34  -9.586  11.147   9.212
  256    HE2  LYS  34           1HE      LYS  34 -10.569  12.334   7.264
  257    HE3  LYS  34           2HE      LYS  34 -11.976  11.281   7.380
  258    HZ1  LYS  34           3HZ      LYS  34 -12.362  12.131   9.620
  259    HZ2  LYS  34           1HZ      LYS  34 -12.380  13.378   8.477
  260    HZ3  LYS  34           2HZ      LYS  34 -11.031  13.164   9.473
  261    H    MET  35           H        MET  35  -8.292   8.142   4.622
  262    HA   MET  35           HA       MET  35 -10.559   6.341   4.505
  263    HB2  MET  35           1HB      MET  35  -9.783   8.424   2.946
  264    HB3  MET  35           2HB      MET  35  -9.126   7.083   2.016
  265    HG2  MET  35           1HG      MET  35 -12.001   7.553   2.773
  266    HG3  MET  35           2HG      MET  35 -11.290   7.614   1.165
  267    HE1  MET  35           3HE      MET  35 -13.425   4.496   0.596
  268    HE2  MET  35           1HE      MET  35 -12.673   5.882  -0.194
  269    HE3  MET  35           2HE      MET  35 -13.771   6.129   1.166
  270    H    ILE  36           H        ILE  36  -7.125   6.324   3.841
  271    HA   ILE  36           HA       ILE  36  -7.130   3.779   2.543
  272    HB   ILE  36           HB       ILE  36  -5.147   5.819   3.182
  273   HG12  ILE  36          1HG1      ILE  36  -4.318   5.202   0.982
  274   HG13  ILE  36          2HG1      ILE  36  -5.322   3.758   0.989
  275   HG21  ILE  36          1HG2      ILE  36  -4.327   2.930   3.224
  276   HG22  ILE  36          2HG2      ILE  36  -4.078   4.133   4.488
  277   HG23  ILE  36          3HG2      ILE  36  -3.214   4.270   2.956
  278   HD11  ILE  36          3HD1      ILE  36  -6.284   6.599   0.961
  279   HD12  ILE  36          1HD1      ILE  36  -7.318   5.175   1.095
  280   HD13  ILE  36          2HD1      ILE  36  -6.355   5.438  -0.365
  281    H    ALA  37           H        ALA  37  -6.864   4.902   5.797
  282    HA   ALA  37           HA       ALA  37  -5.689   2.676   6.969
  283    HB1  ALA  37           1HB      ALA  37  -6.928   3.344   9.037
  284    HB2  ALA  37           2HB      ALA  37  -7.739   4.580   8.074
  285    HB3  ALA  37           3HB      ALA  37  -5.992   4.627   8.275
  286    HA   PRO  38           HA       PRO  38  -9.756   0.412   7.558
  287    HB2  PRO  38           1HB      PRO  38 -12.159   1.383   6.928
  288    HB3  PRO  38           2HB      PRO  38 -11.300   1.929   8.376
  289    HG2  PRO  38           1HG      PRO  38 -11.577   3.267   5.718
  290    HG3  PRO  38           2HG      PRO  38 -11.642   3.973   7.343
  291    HD2  PRO  38           1HD      PRO  38  -9.417   3.990   5.692
  292    HD3  PRO  38           2HD      PRO  38  -9.388   4.197   7.451
  293    H    MET  39           H        MET  39  -9.787   2.117   4.402
  294    HA   MET  39           HA       MET  39 -11.396   0.153   3.093
  295    HB2  MET  39           1HB      MET  39 -11.166   2.319   2.049
  296    HB3  MET  39           2HB      MET  39  -9.420   2.218   2.130
  297    HG2  MET  39           1HG      MET  39  -9.815   0.105   0.606
  298    HG3  MET  39           2HG      MET  39 -11.296   0.978   0.212
  299    HE1  MET  39           3HE      MET  39  -8.222   3.148   1.251
  300    HE2  MET  39           1HE      MET  39  -7.188   3.013  -0.168
  301    HE3  MET  39           2HE      MET  39  -7.498   1.590   0.843
  302    H    ILE  40           H        ILE  40  -7.939   0.752   3.266
  303    HA   ILE  40           HA       ILE  40  -7.117  -1.489   1.763
  304    HB   ILE  40           HB       ILE  40  -5.972   0.712   3.192
  305   HG12  ILE  40          1HG1      ILE  40  -4.504  -1.023   1.250
  306   HG13  ILE  40          2HG1      ILE  40  -5.874  -0.045   0.725
  307   HG21  ILE  40          1HG2      ILE  40  -5.136  -0.848   4.814
  308   HG22  ILE  40          2HG2      ILE  40  -3.801  -0.313   3.796
  309   HG23  ILE  40          3HG2      ILE  40  -4.517  -1.905   3.544
  310   HD11  ILE  40          3HD1      ILE  40  -4.786   1.924   1.106
  311   HD12  ILE  40          1HD1      ILE  40  -3.465   0.894   0.565
  312   HD13  ILE  40          2HD1      ILE  40  -3.686   1.220   2.286
  313    H    GLU  41           H        GLU  41  -7.602  -0.965   5.234
  314    HA   GLU  41           HA       GLU  41  -6.643  -3.532   5.989
  315    HB2  GLU  41           1HB      GLU  41  -6.930  -1.551   7.511
  316    HB3  GLU  41           2HB      GLU  41  -8.668  -1.820   7.458
  317    HG2  GLU  41           1HG      GLU  41  -8.469  -3.891   8.576
  318    HG3  GLU  41           2HG      GLU  41  -6.719  -3.922   8.363
  319    H    LYS  42           H        LYS  42  -9.655  -2.350   4.757
  320    HA   LYS  42           HA       LYS  42 -11.209  -4.639   5.431
  321    HB2  LYS  42           1HB      LYS  42 -12.267  -2.478   5.088
  322    HB3  LYS  42           2HB      LYS  42 -11.692  -2.416   3.428
  323    HG2  LYS  42           1HG      LYS  42 -14.061  -3.001   3.567
  324    HG3  LYS  42           2HG      LYS  42 -13.112  -4.301   2.847
  325    HD2  LYS  42           1HD      LYS  42 -14.728  -5.223   4.401
  326    HD3  LYS  42           2HD      LYS  42 -13.097  -5.464   5.023
  327    HE2  LYS  42           1HE      LYS  42 -14.512  -4.773   6.830
  328    HE3  LYS  42           2HE      LYS  42 -13.406  -3.456   6.452
  329    HZ1  LYS  42           3HZ      LYS  42 -16.240  -3.649   5.591
  330    HZ2  LYS  42           1HZ      LYS  42 -15.185  -2.388   5.196
  331    HZ3  LYS  42           2HZ      LYS  42 -15.639  -2.637   6.805
  332    H    PHE  43           H        PHE  43  -9.183  -3.727   2.721
  333    HA   PHE  43           HA       PHE  43  -9.943  -5.540   0.761
  334    HB2  PHE  43           1HB      PHE  43  -7.107  -4.795   1.572
  335    HB3  PHE  43           2HB      PHE  43  -7.541  -5.620   0.071
  336    HD1  PHE  43           2HD      PHE  43 -10.171  -3.625   0.256
  337    HD2  PHE  43           1HD      PHE  43  -5.961  -3.269  -0.075
  338    HE1  PHE  43           2HE      PHE  43 -10.451  -1.445  -0.849
  339    HE2  PHE  43           1HE      PHE  43  -6.222  -1.090  -1.174
  340    HZ   PHE  43           HZ       PHE  43  -8.470  -0.175  -1.560
  341    H    SER  44           H        SER  44  -7.399  -6.142   3.240
  342    HA   SER  44           HA       SER  44  -7.395  -8.922   2.502
  343    HB2  SER  44           1HB      SER  44  -5.622  -9.117   4.215
  344    HB3  SER  44           2HB      SER  44  -5.288  -7.890   2.998
  345    HG   SER  44           HG       SER  44  -5.336  -6.401   4.478
  346    H    GLU  45           H        GLU  45  -9.048  -6.994   4.798
  347    HA   GLU  45           HA       GLU  45  -9.762  -8.907   6.707
  348    HB2  GLU  45           1HB      GLU  45 -10.412  -6.348   6.380
  349    HB3  GLU  45           2HB      GLU  45 -11.831  -7.040   5.614
  350    HG2  GLU  45           1HG      GLU  45 -10.964  -7.800   8.384
  351    HG3  GLU  45           2HG      GLU  45 -12.012  -6.425   8.063
  352    H    GLN  46           H        GLN  46 -10.857  -8.330   3.416
  353    HA   GLN  46           HA       GLN  46 -12.770 -10.487   3.455
  354    HB2  GLN  46           1HB      GLN  46 -11.647  -8.923   1.123
  355    HB3  GLN  46           2HB      GLN  46 -13.039  -9.992   1.070
  356    HG2  GLN  46           1HG      GLN  46 -14.292  -8.511   2.488
  357    HG3  GLN  46           2HG      GLN  46 -12.880  -7.480   2.717
  358   HE21  GLN  46          1HE2      GLN  46 -12.032  -7.721  -0.060
  359   HE22  GLN  46          2HE2      GLN  46 -13.122  -6.763  -0.994
  360    H    TYR  47           H        TYR  47  -9.611  -9.799   2.020
  361    HA   TYR  47           HA       TYR  47  -9.210 -12.675   1.644
  362    HB2  TYR  47           1HB      TYR  47  -7.865 -11.945  -0.445
  363    HB3  TYR  47           2HB      TYR  47  -9.617 -12.039  -0.523
  364    HD1  TYR  47           2HD      TYR  47  -6.798  -9.635  -0.138
  365    HD2  TYR  47           1HD      TYR  47 -10.907 -10.204  -1.096
  366    HE1  TYR  47           2HE      TYR  47  -6.933  -7.307  -0.949
  367    HE2  TYR  47           1HE      TYR  47 -11.052  -7.884  -1.886
  368    HH   TYR  47           HH       TYR  47  -8.485  -6.027  -2.617
  369    HA   PRO  48           HA       PRO  48  -5.606 -11.218   4.043
  370    HB2  PRO  48           1HB      PRO  48  -5.247 -13.513   5.393
  371    HB3  PRO  48           2HB      PRO  48  -6.452 -12.320   5.880
  372    HG2  PRO  48           1HG      PRO  48  -6.825 -14.844   4.307
  373    HG3  PRO  48           2HG      PRO  48  -7.802 -14.205   5.643
  374    HD2  PRO  48           1HD      PRO  48  -8.517 -13.923   3.044
  375    HD3  PRO  48           2HD      PRO  48  -8.920 -12.717   4.282
  376    H    GLN  49           H        GLN  49  -6.141 -13.258   1.541
  377    HA   GLN  49           HA       GLN  49  -3.818 -14.815   1.303
  378    HB2  GLN  49           1HB      GLN  49  -5.706 -15.291  -0.076
  379    HB3  GLN  49           2HB      GLN  49  -5.758 -13.648  -0.689
  380    HG2  GLN  49           1HG      GLN  49  -3.357 -14.291  -1.583
  381    HG3  GLN  49           2HG      GLN  49  -4.029 -15.918  -1.480
  382   HE21  GLN  49          1HE2      GLN  49  -4.307 -12.785  -2.981
  383   HE22  GLN  49          2HE2      GLN  49  -5.341 -13.284  -4.280
  384    H    ALA  50           H        ALA  50  -4.432 -11.462   0.800
  385    HA   ALA  50           HA       ALA  50  -1.815 -11.097  -0.487
  386    HB1  ALA  50           1HB      ALA  50  -4.095  -9.154  -0.138
  387    HB2  ALA  50           2HB      ALA  50  -3.716 -10.049  -1.614
  388    HB3  ALA  50           3HB      ALA  50  -2.588  -8.835  -0.995
  389    H    ASP  51           H        ASP  51  -0.393  -9.405   0.397
  390    HA   ASP  51           HA       ASP  51  -0.603  -9.505   3.297
  391    HB2  ASP  51           1HB      ASP  51   1.625  -9.603   1.509
  392    HB3  ASP  51           2HB      ASP  51   1.821  -8.222   2.584
  393    H    PHE  52           H        PHE  52  -0.509  -7.779   4.615
  394    HA   PHE  52           HA       PHE  52  -1.470  -5.302   3.366
  395    HB2  PHE  52           1HB      PHE  52  -2.443  -5.108   5.841
  396    HB3  PHE  52           2HB      PHE  52  -3.293  -5.995   4.583
  397    HD1  PHE  52           1HD      PHE  52  -1.241  -6.298   7.614
  398    HD2  PHE  52           2HD      PHE  52  -3.472  -8.385   4.653
  399    HE1  PHE  52           1HE      PHE  52  -1.169  -8.328   8.995
  400    HE2  PHE  52           2HE      PHE  52  -3.404 -10.421   6.030
  401    HZ   PHE  52           HZ       PHE  52  -2.249 -10.396   8.206
  402    H    TYR  53           H        TYR  53  -0.010  -3.712   3.450
  403    HA   TYR  53           HA       TYR  53   1.347  -3.246   5.997
  404    HB2  TYR  53           1HB      TYR  53   2.764  -3.278   3.322
  405    HB3  TYR  53           2HB      TYR  53   3.466  -2.734   4.837
  406    HD1  TYR  53           1HD      TYR  53   3.921  -4.394   6.643
  407    HD2  TYR  53           2HD      TYR  53   2.682  -5.577   2.749
  408    HE1  TYR  53           1HE      TYR  53   4.760  -6.663   7.071
  409    HE2  TYR  53           2HE      TYR  53   3.513  -7.854   3.169
  410    HH   TYR  53           HH       TYR  53   4.350  -8.973   6.233
  411    H    LYS  54           H        LYS  54   2.049  -1.124   6.332
  412    HA   LYS  54           HA       LYS  54   1.174   0.902   4.448
  413    HB2  LYS  54           1HB      LYS  54  -0.362   1.945   5.976
  414    HB3  LYS  54           2HB      LYS  54  -0.807   0.251   5.784
  415    HG2  LYS  54           1HG      LYS  54   0.197  -0.287   7.919
  416    HG3  LYS  54           2HG      LYS  54   0.703   1.393   8.121
  417    HD2  LYS  54           1HD      LYS  54  -1.644   2.098   8.066
  418    HD3  LYS  54           2HD      LYS  54  -2.142   0.417   7.879
  419    HE2  LYS  54           1HE      LYS  54  -1.240  -0.135  10.046
  420    HE3  LYS  54           2HE      LYS  54  -0.582   1.490  10.220
  421    HZ1  LYS  54           3HZ      LYS  54  -3.461   0.793  10.057
  422    HZ2  LYS  54           1HZ      LYS  54  -2.842   2.359  10.193
  423    HZ3  LYS  54           2HZ      LYS  54  -2.632   1.255  11.455
  424    H    LEU  55           H        LEU  55   1.870   3.086   5.102
  425    HA   LEU  55           HA       LEU  55   3.682   3.340   7.322
  426    HB2  LEU  55           1HB      LEU  55   5.160   2.255   5.768
  427    HB3  LEU  55           2HB      LEU  55   4.677   3.328   4.474
  428    HG   LEU  55           HG       LEU  55   5.971   4.552   6.865
  429   HD11  LEU  55          1HD1      LEU  55   8.194   4.117   5.878
  430   HD12  LEU  55          2HD1      LEU  55   7.445   3.003   4.735
  431   HD13  LEU  55          3HD1      LEU  55   7.415   2.648   6.462
  432   HD21  LEU  55          3HD2      LEU  55   5.049   5.796   4.883
  433   HD22  LEU  55          1HD2      LEU  55   6.322   5.053   3.919
  434   HD23  LEU  55          2HD2      LEU  55   6.743   6.123   5.257
  435    H    ASP  56           H        ASP  56   4.235   5.503   7.756
  436    HA   ASP  56           HA       ASP  56   2.490   7.467   6.483
  437    HB2  ASP  56           1HB      ASP  56   2.408   7.438   8.893
  438    HB3  ASP  56           2HB      ASP  56   4.159   7.571   9.002
  439    H    VAL  57           H        VAL  57   3.228   8.622   4.875
  440    HA   VAL  57           HA       VAL  57   5.902   8.673   3.981
  441    HB   VAL  57           HB       VAL  57   3.723  10.671   3.335
  442   HG11  VAL  57          1HG1      VAL  57   6.148   9.804   1.773
  443   HG12  VAL  57          2HG1      VAL  57   5.917  11.361   2.565
  444   HG13  VAL  57          3HG1      VAL  57   4.898  10.907   1.198
  445   HG21  VAL  57          3HG2      VAL  57   3.208   9.187   1.418
  446   HG22  VAL  57          1HG2      VAL  57   2.840   8.467   2.987
  447   HG23  VAL  57          2HG2      VAL  57   4.291   7.979   2.111
  448    H    ASP  58           H        ASP  58   4.169  10.633   6.273
  449    HA   ASP  58           HA       ASP  58   5.779  12.963   6.130
  450    HB2  ASP  58           1HB      ASP  58   3.545  12.925   7.186
  451    HB3  ASP  58           2HB      ASP  58   4.182  11.911   8.475
  452    H    GLU  59           H        GLU  59   5.992   9.981   8.001
  453    HA   GLU  59           HA       GLU  59   8.371  10.893   9.377
  454    HB2  GLU  59           1HB      GLU  59   6.964   8.224   9.356
  455    HB3  GLU  59           2HB      GLU  59   8.437   8.534  10.262
  456    HG2  GLU  59           1HG      GLU  59   7.195  10.383  11.430
  457    HG3  GLU  59           2HG      GLU  59   5.730   9.764  10.666
  458    H    LEU  60           H        LEU  60   7.598   8.641   6.743
  459    HA   LEU  60           HA       LEU  60  10.497   8.341   6.300
  460    HB2  LEU  60           1HB      LEU  60   8.317   6.312   6.267
  461    HB3  LEU  60           2HB      LEU  60   9.691   6.089   5.212
  462    HG   LEU  60           HG       LEU  60  10.090   4.804   7.162
  463   HD11  LEU  60          1HD1      LEU  60  11.693   7.333   7.464
  464   HD12  LEU  60          2HD1      LEU  60  12.016   6.061   6.288
  465   HD13  LEU  60          3HD1      LEU  60  12.141   5.719   8.013
  466   HD21  LEU  60          3HD2      LEU  60  10.068   5.721   9.422
  467   HD22  LEU  60          1HD2      LEU  60   8.487   5.864   8.654
  468   HD23  LEU  60          2HD2      LEU  60   9.532   7.277   8.791
  469    H    GLY  61           H        GLY  61  10.124  10.259   4.919
  470    HA2  GLY  61           1HA      GLY  61   8.659   9.971   2.475
  471    HA3  GLY  61           2HA      GLY  61   9.801  11.250   2.860
  472    H    ASP  62           H        ASP  62  11.875   9.198   3.505
  473    HA   ASP  62           HA       ASP  62  13.101   8.989   0.964
  474    HB2  ASP  62           1HB      ASP  62  14.401   9.087   3.029
  475    HB3  ASP  62           2HB      ASP  62  13.705   7.563   3.557
  476    H    VAL  63           H        VAL  63  11.021   6.917   2.760
  477    HA   VAL  63           HA       VAL  63  11.417   4.622   1.082
  478    HB   VAL  63           HB       VAL  63   9.016   5.183   2.813
  479   HG11  VAL  63          1HG1      VAL  63  10.254   2.660   1.722
  480   HG12  VAL  63          2HG1      VAL  63   8.692   3.352   1.289
  481   HG13  VAL  63          3HG1      VAL  63   8.949   2.691   2.905
  482   HG21  VAL  63          3HG2      VAL  63  11.136   5.408   4.089
  483   HG22  VAL  63          1HG2      VAL  63  11.554   3.765   3.613
  484   HG23  VAL  63          2HG2      VAL  63  10.139   4.054   4.622
  485    H    ALA  64           H        ALA  64   8.785   7.031   1.429
  486    HA   ALA  64           HA       ALA  64   7.293   6.319  -0.794
  487    HB1  ALA  64           1HB      ALA  64   6.406   8.578  -0.721
  488    HB2  ALA  64           2HB      ALA  64   7.758   9.101   0.285
  489    HB3  ALA  64           3HB      ALA  64   6.593   7.934   0.910
  490    H    GLN  65           H        GLN  65  10.395   7.886  -0.748
  491    HA   GLN  65           HA       GLN  65  10.180   8.717  -3.519
  492    HB2  GLN  65           1HB      GLN  65  12.115   9.876  -3.122
  493    HB3  GLN  65           2HB      GLN  65  11.632   9.598  -1.457
  494    HG2  GLN  65           1HG      GLN  65  13.101   7.713  -1.272
  495    HG3  GLN  65           2HG      GLN  65  13.578   7.896  -2.964
  496   HE21  GLN  65          1HE2      GLN  65  15.737   8.200  -2.437
  497   HE22  GLN  65          2HE2      GLN  65  16.312   9.655  -1.698
  498    H    LYS  66           H        LYS  66  11.431   6.122  -1.648
  499    HA   LYS  66           HA       LYS  66  12.928   4.855  -3.672
  500    HB2  LYS  66           1HB      LYS  66  13.626   3.734  -1.871
  501    HB3  LYS  66           2HB      LYS  66  12.314   4.403  -0.916
  502    HG2  LYS  66           1HG      LYS  66  11.391   2.408  -0.761
  503    HG3  LYS  66           2HG      LYS  66  11.254   2.320  -2.514
  504    HD2  LYS  66           1HD      LYS  66  13.685   1.529  -0.906
  505    HD3  LYS  66           2HD      LYS  66  12.502   0.409  -1.577
  506    HE2  LYS  66           1HE      LYS  66  14.163   2.316  -3.216
  507    HE3  LYS  66           2HE      LYS  66  14.590   0.636  -2.919
  508    HZ1  LYS  66           3HZ      LYS  66  12.537  -0.031  -4.014
  509    HZ2  LYS  66           1HZ      LYS  66  13.504   0.894  -5.047
  510    HZ3  LYS  66           2HZ      LYS  66  12.147   1.587  -4.315
  511    H    ASN  67           H        ASN  67   9.541   4.891  -2.944
  512    HA   ASN  67           HA       ASN  67   9.069   2.532  -4.653
  513    HB2  ASN  67           1HB      ASN  67   6.723   2.796  -3.508
  514    HB3  ASN  67           2HB      ASN  67   8.041   2.063  -2.619
  515   HD21  ASN  67          1HD2      ASN  67   7.582   2.663  -0.599
  516   HD22  ASN  67          2HD2      ASN  67   7.466   4.309  -0.111
  517    H    GLU  68           H        GLU  68   8.862   5.891  -4.601
  518    HA   GLU  68           HA       GLU  68   8.310   7.268  -6.321
  519    HB2  GLU  68           1HB      GLU  68   8.512   5.281  -7.808
  520    HB3  GLU  68           2HB      GLU  68   6.799   4.966  -7.553
  521    HG2  GLU  68           1HG      GLU  68   6.399   7.291  -8.497
  522    HG3  GLU  68           2HG      GLU  68   8.092   7.280  -8.989
  523    H    VAL  69           H        VAL  69   6.521   6.296  -3.962
  524    HA   VAL  69           HA       VAL  69   4.047   7.505  -4.946
  525    HB   VAL  69           HB       VAL  69   3.307   5.777  -3.645
  526   HG11  VAL  69          1HG1      VAL  69   5.478   5.013  -2.803
  527   HG12  VAL  69          2HG1      VAL  69   4.240   5.021  -1.545
  528   HG13  VAL  69          3HG1      VAL  69   5.456   6.304  -1.591
  529   HG21  VAL  69          3HG2      VAL  69   2.291   7.829  -2.829
  530   HG22  VAL  69          1HG2      VAL  69   3.571   7.992  -1.625
  531   HG23  VAL  69          2HG2      VAL  69   2.444   6.638  -1.538
  532    H    SER  70           H        SER  70   3.995   9.605  -5.021
  533    HA   SER  70           HA       SER  70   5.391  11.144  -2.941
  534    HB2  SER  70           1HB      SER  70   6.133  11.500  -5.299
  535    HB3  SER  70           2HB      SER  70   4.510  12.062  -5.692
  536    HG   SER  70           HG       SER  70   6.304  13.232  -3.823
  537    H    ALA  71           H        ALA  71   2.354  10.591  -4.542
  538    HA   ALA  71           HA       ALA  71   1.025  12.753  -3.139
  539    HB1  ALA  71           1HB      ALA  71   0.356  12.234  -5.431
  540    HB2  ALA  71           2HB      ALA  71  -0.984  11.988  -4.311
  541    HB3  ALA  71           3HB      ALA  71  -0.093  10.602  -4.938
  542    H    MET  72           H        MET  72  -0.934  12.271  -1.833
  543    HA   MET  72           HA       MET  72  -1.098   9.612  -0.711
  544    HB2  MET  72           1HB      MET  72  -0.917  10.405   1.635
  545    HB3  MET  72           2HB      MET  72   0.591  10.526   0.745
  546    HG2  MET  72           1HG      MET  72  -1.243  12.874   1.018
  547    HG3  MET  72           2HG      MET  72  -0.097  12.454   2.286
  548    HE1  MET  72           3HE      MET  72   2.525  12.359   1.928
  549    HE2  MET  72           1HE      MET  72   3.334  12.808   0.428
  550    HE3  MET  72           2HE      MET  72   2.375  11.332   0.503
  551    HA   PRO  73           HA       PRO  73  -2.077   8.668   0.852
  552    HB2  PRO  73           1HB      PRO  73  -4.216   7.057   0.998
  553    HB3  PRO  73           2HB      PRO  73  -3.853   8.256   2.240
  554    HG2  PRO  73           1HG      PRO  73  -5.873   8.345   0.051
  555    HG3  PRO  73           2HG      PRO  73  -5.990   8.962   1.716
  556    HD2  PRO  73           1HD      PRO  73  -5.435  10.500  -0.539
  557    HD3  PRO  73           2HD      PRO  73  -5.061  10.965   1.132
  558    H    THR  74           H        THR  74  -1.440   6.776  -0.137
  559    HA   THR  74           HA       THR  74  -2.349   6.319  -2.898
  560    HB   THR  74           HB       THR  74   0.481   6.768  -1.949
  561    HG1  THR  74           1HG      THR  74   0.119   8.624  -2.849
  562   HG21  THR  74          3HG2      THR  74   0.727   4.850  -3.300
  563   HG22  THR  74          1HG2      THR  74   1.133   6.214  -4.338
  564   HG23  THR  74          2HG2      THR  74  -0.446   5.429  -4.490
  565    H    LEU  75           H        LEU  75  -2.300   4.271  -3.585
  566    HA   LEU  75           HA       LEU  75  -1.447   2.215  -1.654
  567    HB2  LEU  75           1HB      LEU  75  -3.389   1.983  -3.939
  568    HB3  LEU  75           2HB      LEU  75  -3.030   0.747  -2.749
  569    HG   LEU  75           HG       LEU  75  -3.902   2.735  -1.136
  570   HD11  LEU  75          1HD1      LEU  75  -5.882   3.752  -2.124
  571   HD12  LEU  75          2HD1      LEU  75  -5.558   2.961  -3.665
  572   HD13  LEU  75          3HD1      LEU  75  -4.454   4.197  -3.058
  573   HD21  LEU  75          3HD2      LEU  75  -6.112   1.500  -1.286
  574   HD22  LEU  75          1HD2      LEU  75  -4.669   0.545  -0.932
  575   HD23  LEU  75          2HD2      LEU  75  -5.355   0.537  -2.556
  576    H    LEU  76           H        LEU  76   0.316   1.071  -2.254
  577    HA   LEU  76           HA       LEU  76   0.854   0.846  -5.141
  578    HB2  LEU  76           1HB      LEU  76   2.528   1.739  -3.018
  579    HB3  LEU  76           2HB      LEU  76   3.171   0.224  -3.611
  580    HG   LEU  76           HG       LEU  76   2.588   2.632  -5.339
  581   HD11  LEU  76          1HD1      LEU  76   4.444   3.009  -3.760
  582   HD12  LEU  76          2HD1      LEU  76   4.995   2.954  -5.443
  583   HD13  LEU  76          3HD1      LEU  76   5.240   1.560  -4.375
  584   HD21  LEU  76          3HD2      LEU  76   2.417   0.447  -6.484
  585   HD22  LEU  76          1HD2      LEU  76   4.064   0.080  -5.979
  586   HD23  LEU  76          2HD2      LEU  76   3.758   1.427  -7.077
  587    H    LEU  77           H        LEU  77   0.353  -1.069  -5.881
  588    HA   LEU  77           HA       LEU  77   0.407  -3.415  -4.118
  589    HB2  LEU  77           1HB      LEU  77  -0.790  -2.886  -6.838
  590    HB3  LEU  77           2HB      LEU  77  -0.674  -4.499  -6.178
  591    HG   LEU  77           HG       LEU  77  -2.378  -4.137  -4.625
  592   HD11  LEU  77          1HD1      LEU  77  -1.504  -2.073  -3.613
  593   HD12  LEU  77          2HD1      LEU  77  -3.227  -1.944  -3.964
  594   HD13  LEU  77          3HD1      LEU  77  -2.052  -1.157  -5.016
  595   HD21  LEU  77          3HD2      LEU  77  -3.170  -4.125  -6.938
  596   HD22  LEU  77          1HD2      LEU  77  -3.047  -2.365  -6.968
  597   HD23  LEU  77          2HD2      LEU  77  -4.199  -3.150  -5.886
  598    H    PHE  78           H        PHE  78   1.895  -5.023  -4.402
  599    HA   PHE  78           HA       PHE  78   3.584  -4.873  -6.808
  600    HB2  PHE  78           1HB      PHE  78   4.448  -5.166  -3.945
  601    HB3  PHE  78           2HB      PHE  78   5.458  -5.714  -5.276
  602    HD1  PHE  78           1HD      PHE  78   3.880  -2.760  -3.744
  603    HD2  PHE  78           2HD      PHE  78   6.704  -4.200  -6.573
  604    HE1  PHE  78           1HE      PHE  78   4.806  -0.501  -3.978
  605    HE2  PHE  78           2HE      PHE  78   7.631  -1.939  -6.811
  606    HZ   PHE  78           HZ       PHE  78   6.681  -0.082  -5.506
  607    H    LYS  79           H        LYS  79   4.417  -6.841  -7.604
  608    HA   LYS  79           HA       LYS  79   3.699  -9.276  -6.093
  609    HB2  LYS  79           1HB      LYS  79   2.194  -8.831  -8.114
  610    HB3  LYS  79           2HB      LYS  79   3.620  -9.100  -9.102
  611    HG2  LYS  79           1HG      LYS  79   2.416 -11.125  -9.081
  612    HG3  LYS  79           2HG      LYS  79   3.818 -11.361  -8.036
  613    HD2  LYS  79           1HD      LYS  79   2.379 -10.892  -6.076
  614    HD3  LYS  79           2HD      LYS  79   0.991 -10.775  -7.159
  615    HE2  LYS  79           1HE      LYS  79   2.738 -13.206  -6.787
  616    HE3  LYS  79           2HE      LYS  79   1.137 -12.976  -6.089
  617    HZ1  LYS  79           3HZ      LYS  79   1.086 -14.342  -8.089
  618    HZ2  LYS  79           1HZ      LYS  79   1.734 -13.072  -8.997
  619    HZ3  LYS  79           2HZ      LYS  79   0.195 -12.914  -8.300
  620    H    ASN  80           H        ASN  80   5.480 -10.303  -5.571
  621    HA   ASN  80           HA       ASN  80   7.626 -10.971  -5.422
  622    HB2  ASN  80           1HB      ASN  80   8.523 -12.110  -7.489
  623    HB3  ASN  80           2HB      ASN  80   6.988 -12.698  -6.872
  624   HD21  ASN  80          1HD2      ASN  80   8.602 -11.007  -9.440
  625   HD22  ASN  80          2HD2      ASN  80   7.297 -11.075 -10.572
  626    H    GLY  81           H        GLY  81   7.926  -8.407  -5.284
  627    HA2  GLY  81           1HA      GLY  81   9.757  -6.967  -5.330
  628    HA3  GLY  81           2HA      GLY  81  10.561  -8.097  -6.415
  629    H    LYS  82           H        LYS  82   7.558  -7.465  -7.631
  630    HA   LYS  82           HA       LYS  82   8.522  -5.198  -9.244
  631    HB2  LYS  82           1HB      LYS  82   6.769  -7.454 -10.242
  632    HB3  LYS  82           2HB      LYS  82   7.458  -6.148 -11.193
  633    HG2  LYS  82           1HG      LYS  82   9.709  -7.044 -10.756
  634    HG3  LYS  82           2HG      LYS  82   8.979  -8.378  -9.855
  635    HD2  LYS  82           1HD      LYS  82   9.557  -9.012 -12.164
  636    HD3  LYS  82           2HD      LYS  82   7.826  -9.131 -11.851
  637    HE2  LYS  82           1HE      LYS  82   7.457  -7.006 -12.963
  638    HE3  LYS  82           2HE      LYS  82   9.190  -6.813 -13.213
  639    HZ1  LYS  82           3HZ      LYS  82   7.527  -8.987 -14.357
  640    HZ2  LYS  82           1HZ      LYS  82   9.179  -8.750 -14.630
  641    HZ3  LYS  82           2HZ      LYS  82   8.058  -7.622 -15.197
  642    H    GLU  83           H        GLU  83   6.702  -3.882 -10.101
  643    HA   GLU  83           HA       GLU  83   4.669  -3.493  -8.144
  644    HB2  GLU  83           1HB      GLU  83   5.723  -1.734  -9.656
  645    HB3  GLU  83           2HB      GLU  83   4.748  -2.393 -10.960
  646    HG2  GLU  83           1HG      GLU  83   2.718  -1.767  -9.851
  647    HG3  GLU  83           2HG      GLU  83   3.614  -1.293  -8.401
  648    H    VAL  84           H        VAL  84   2.299  -3.339  -8.977
  649    HA   VAL  84           HA       VAL  84   1.709  -4.882 -11.342
  650    HB   VAL  84           HB       VAL  84  -0.353  -5.846 -10.049
  651   HG11  VAL  84          1HG1      VAL  84   1.345  -7.166 -11.242
  652   HG12  VAL  84          2HG1      VAL  84   0.822  -7.943  -9.747
  653   HG13  VAL  84          3HG1      VAL  84   2.375  -7.105  -9.808
  654   HG21  VAL  84          3HG2      VAL  84   0.218  -6.549  -7.786
  655   HG22  VAL  84          1HG2      VAL  84   0.190  -4.792  -7.929
  656   HG23  VAL  84          2HG2      VAL  84   1.731  -5.648  -7.892
  657    H    ALA  85           H        ALA  85   0.684  -2.744  -8.765
  658    HA   ALA  85           HA       ALA  85  -0.643  -1.047 -10.610
  659    HB1  ALA  85           1HB      ALA  85  -2.428  -2.635 -10.453
  660    HB2  ALA  85           2HB      ALA  85  -2.898  -1.187  -9.561
  661    HB3  ALA  85           3HB      ALA  85  -2.344  -2.621  -8.695
  662    H    LYS  86           H        LYS  86  -1.357   0.945  -9.693
  663    HA   LYS  86           HA       LYS  86  -0.985   1.400  -6.876
  664    HB2  LYS  86           1HB      LYS  86   0.587   3.431  -7.552
  665    HB3  LYS  86           2HB      LYS  86   1.226   1.847  -7.151
  666    HG2  LYS  86           1HG      LYS  86   2.391   2.361  -9.055
  667    HG3  LYS  86           2HG      LYS  86   1.053   1.413  -9.699
  668    HD2  LYS  86           1HD      LYS  86  -0.126   3.497 -10.259
  669    HD3  LYS  86           2HD      LYS  86   1.249   4.423  -9.652
  670    HE2  LYS  86           1HE      LYS  86   1.165   2.567 -12.020
  671    HE3  LYS  86           2HE      LYS  86   1.488   4.300 -12.012
  672    HZ1  LYS  86           3HZ      LYS  86   3.231   2.128 -10.984
  673    HZ2  LYS  86           1HZ      LYS  86   3.507   3.773 -10.667
  674    HZ3  LYS  86           2HZ      LYS  86   3.550   3.203 -12.256
  675    H    VAL  87           H        VAL  87  -2.269   2.959  -6.138
  676    HA   VAL  87           HA       VAL  87  -3.516   4.783  -8.082
  677    HB   VAL  87           HB       VAL  87  -5.056   3.229  -5.991
  678   HG11  VAL  87          1HG1      VAL  87  -5.984   5.436  -6.372
  679   HG12  VAL  87          2HG1      VAL  87  -7.037   4.206  -7.069
  680   HG13  VAL  87          3HG1      VAL  87  -5.986   5.158  -8.114
  681   HG21  VAL  87          3HG2      VAL  87  -6.132   2.101  -7.897
  682   HG22  VAL  87          1HG2      VAL  87  -4.402   1.766  -7.815
  683   HG23  VAL  87          2HG2      VAL  87  -5.021   2.923  -8.993
  684    H    VAL  88           H        VAL  88  -3.759   6.824  -7.347
  685    HA   VAL  88           HA       VAL  88  -2.771   7.372  -4.651
  686    HB   VAL  88           HB       VAL  88  -2.614   9.741  -5.450
  687   HG11  VAL  88          1HG1      VAL  88  -0.676   9.354  -6.902
  688   HG12  VAL  88          2HG1      VAL  88  -1.170   7.674  -7.107
  689   HG13  VAL  88          3HG1      VAL  88  -0.681   8.262  -5.518
  690   HG21  VAL  88          3HG2      VAL  88  -3.328   8.530  -8.123
  691   HG22  VAL  88          1HG2      VAL  88  -2.801  10.190  -7.844
  692   HG23  VAL  88          2HG2      VAL  88  -4.341   9.632  -7.191
  693    H    GLY  89           H        GLY  89  -5.258   6.331  -4.482
  694    HA2  GLY  89           1HA      GLY  89  -6.761   8.236  -3.128
  695    HA3  GLY  89           2HA      GLY  89  -7.392   8.155  -4.768
  696    H    ALA  90           H        ALA  90  -8.087   7.166  -1.853
  697    HA   ALA  90           HA       ALA  90  -8.494   4.396  -2.015
  698    HB1  ALA  90           1HB      ALA  90  -8.568   5.921   0.009
  699    HB2  ALA  90           2HB      ALA  90  -9.763   4.619  -0.063
  700    HB3  ALA  90           3HB      ALA  90 -10.228   6.277  -0.465
  701    H    ASN  91           H        ASN  91  -9.660   3.454  -3.558
  702    HA   ASN  91           HA       ASN  91 -12.335   4.549  -4.090
  703    HB2  ASN  91           1HB      ASN  91 -10.289   3.821  -5.892
  704    HB3  ASN  91           2HB      ASN  91 -11.514   2.562  -6.003
  705   HD21  ASN  91          1HD2      ASN  91 -13.642   4.471  -5.221
  706   HD22  ASN  91          2HD2      ASN  91 -13.953   5.403  -6.646
  707    HA   PRO  92           HA       PRO  92 -13.133   1.403  -0.912
  708    HB2  PRO  92           1HB      PRO  92 -15.699   1.622  -2.440
  709    HB3  PRO  92           2HB      PRO  92 -15.439   1.503  -0.698
  710    HG2  PRO  92           1HG      PRO  92 -15.804   3.872  -2.064
  711    HG3  PRO  92           2HG      PRO  92 -15.009   3.727  -0.490
  712    HD2  PRO  92           1HD      PRO  92 -13.833   4.538  -2.954
  713    HD3  PRO  92           2HD      PRO  92 -13.011   4.278  -1.417
  714    H    ALA  93           H        ALA  93 -15.231   0.476  -3.619
  715    HA   ALA  93           HA       ALA  93 -14.428  -2.266  -3.122
  716    HB1  ALA  93           1HB      ALA  93 -16.506  -1.180  -5.017
  717    HB2  ALA  93           2HB      ALA  93 -16.796  -1.691  -3.355
  718    HB3  ALA  93           3HB      ALA  93 -16.288  -2.869  -4.563
  719    H    ALA  94           H        ALA  94 -13.919   0.151  -5.570
  720    HA   ALA  94           HA       ALA  94 -13.217  -1.607  -7.686
  721    HB1  ALA  94           1HB      ALA  94 -12.310   0.352  -8.786
  722    HB2  ALA  94           2HB      ALA  94 -12.335   1.252  -7.268
  723    HB3  ALA  94           3HB      ALA  94 -13.850   0.757  -8.027
  724    H    ILE  95           H        ILE  95 -11.399  -0.192  -5.033
  725    HA   ILE  95           HA       ILE  95  -8.914  -1.141  -6.157
  726    HB   ILE  95           HB       ILE  95  -9.378  -0.011  -3.398
  727   HG12  ILE  95          1HG1      ILE  95  -9.961   1.627  -5.112
  728   HG13  ILE  95          2HG1      ILE  95  -8.450   2.078  -4.332
  729   HG21  ILE  95          1HG2      ILE  95  -7.354  -1.327  -3.545
  730   HG22  ILE  95          2HG2      ILE  95  -6.951   0.388  -3.459
  731   HG23  ILE  95          3HG2      ILE  95  -6.865  -0.461  -5.002
  732   HD11  ILE  95          3HD1      ILE  95  -7.214   1.174  -6.244
  733   HD12  ILE  95          1HD1      ILE  95  -8.331   2.456  -6.713
  734   HD13  ILE  95          2HD1      ILE  95  -8.742   0.770  -7.025
  735    H    LYS  96           H        LYS  96 -11.208  -2.176  -3.645
  736    HA   LYS  96           HA       LYS  96  -9.759  -4.371  -2.684
  737    HB2  LYS  96           1HB      LYS  96 -12.718  -4.570  -3.263
  738    HB3  LYS  96           2HB      LYS  96 -11.789  -5.384  -2.002
  739    HG2  LYS  96           1HG      LYS  96 -11.548  -3.282  -0.822
  740    HG3  LYS  96           2HG      LYS  96 -12.445  -2.450  -2.089
  741    HD2  LYS  96           1HD      LYS  96 -14.387  -3.893  -1.630
  742    HD3  LYS  96           2HD      LYS  96 -13.487  -4.669  -0.328
  743    HE2  LYS  96           1HE      LYS  96 -13.355  -2.571   0.874
  744    HE3  LYS  96           2HE      LYS  96 -14.151  -1.731  -0.456
  745    HZ1  LYS  96           3HZ      LYS  96 -16.116  -3.127  -0.072
  746    HZ2  LYS  96           1HZ      LYS  96 -15.727  -2.193   1.283
  747    HZ3  LYS  96           2HZ      LYS  96 -15.354  -3.840   1.256
  748    H    GLN  97           H        GLN  97 -11.918  -4.055  -5.449
  749    HA   GLN  97           HA       GLN  97 -11.626  -6.623  -6.512
  750    HB2  GLN  97           1HB      GLN  97 -13.385  -5.039  -7.182
  751    HB3  GLN  97           2HB      GLN  97 -12.186  -3.992  -7.921
  752    HG2  GLN  97           1HG      GLN  97 -12.522  -6.823  -8.844
  753    HG3  GLN  97           2HG      GLN  97 -13.613  -5.558  -9.398
  754   HE21  GLN  97          1HE2      GLN  97 -11.708  -7.159 -10.913
  755   HE22  GLN  97          2HE2      GLN  97 -10.640  -6.033 -11.673
  756    H    ALA  98           H        ALA  98  -9.597  -3.780  -6.718
  757    HA   ALA  98           HA       ALA  98  -7.976  -4.616  -8.867
  758    HB1  ALA  98           1HB      ALA  98  -7.282  -2.790  -6.581
  759    HB2  ALA  98           2HB      ALA  98  -8.026  -2.307  -8.105
  760    HB3  ALA  98           3HB      ALA  98  -6.387  -2.952  -8.091
  761    H    ILE  99           H        ILE  99  -7.538  -4.836  -5.364
  762    HA   ILE  99           HA       ILE  99  -5.065  -6.089  -5.322
  763    HB   ILE  99           HB       ILE  99  -7.213  -6.854  -3.346
  764   HG12  ILE  99          1HG1      ILE  99  -7.510  -4.516  -3.401
  765   HG13  ILE  99          2HG1      ILE  99  -6.410  -4.801  -2.056
  766   HG21  ILE  99          1HG2      ILE  99  -5.251  -6.778  -1.815
  767   HG22  ILE  99          2HG2      ILE  99  -4.238  -6.468  -3.226
  768   HG23  ILE  99          3HG2      ILE  99  -5.131  -7.983  -3.097
  769   HD11  ILE  99          3HD1      ILE  99  -5.658  -2.912  -3.285
  770   HD12  ILE  99          1HD1      ILE  99  -5.729  -3.819  -4.801
  771   HD13  ILE  99          2HD1      ILE  99  -4.534  -4.244  -3.566
  772    H    ALA 100           H        ALA 100  -8.300  -7.487  -5.605
  773    HA   ALA 100           HA       ALA 100  -7.452 -10.205  -5.544
  774    HB1  ALA 100           1HB      ALA 100  -9.709 -10.730  -6.275
  775    HB2  ALA 100           2HB      ALA 100  -9.989  -9.036  -6.679
  776    HB3  ALA 100           3HB      ALA 100  -9.742  -9.514  -4.999
  777    H    ALA 101           H        ALA 101  -7.621  -7.798  -8.023
  778    HA   ALA 101           HA       ALA 101  -7.514  -9.643 -10.229
  779    HB1  ALA 101           1HB      ALA 101  -8.580  -7.418 -10.404
  780    HB2  ALA 101           2HB      ALA 101  -7.326  -7.675 -11.618
  781    HB3  ALA 101           3HB      ALA 101  -6.992  -6.668 -10.203
  782    H    ASN 102           H        ASN 102  -5.237  -7.555  -8.518
  783    HA   ASN 102           HA       ASN 102  -3.114  -8.054 -10.394
  784    HB2  ASN 102           1HB      ASN 102  -3.064  -6.634  -7.736
  785    HB3  ASN 102           2HB      ASN 102  -1.743  -6.654  -8.891
  786   HD21  ASN 102          1HD2      ASN 102  -4.666  -5.228  -7.967
  787   HD22  ASN 102          2HD2      ASN 102  -4.852  -4.132  -9.287
  788    H    ALA 103           H        ALA 103  -4.245  -9.609  -7.581
  789    HA   ALA 103           HA       ALA 103  -1.782 -10.674  -6.652
  790    HB1  ALA 103           1HB      ALA 103  -3.163 -12.217  -5.351
  791    HB2  ALA 103           2HB      ALA 103  -4.585 -11.714  -6.265
  792    HB3  ALA 103           3HB      ALA 103  -3.754 -10.560  -5.224
  Start of MODEL   14
    1    H1   MET   1           1H       MET   1  -5.851  -6.863   9.486
    2    H2   MET   1           2H       MET   1  -6.293  -6.932  11.117
    3    H3   MET   1           3H       MET   1  -4.886  -7.708  10.588
    4    HA   MET   1           HA       MET   1  -5.366  -4.792  10.578
    5    HB2  MET   1           1HB      MET   1  -5.039  -5.627  12.833
    6    HB3  MET   1           2HB      MET   1  -3.604  -6.510  12.330
    7    HG2  MET   1           1HG      MET   1  -2.421  -4.474  11.900
    8    HG3  MET   1           2HG      MET   1  -3.875  -3.519  12.182
    9    HE1  MET   1           3HE      MET   1  -5.153  -4.945  14.693
   10    HE2  MET   1           1HE      MET   1  -5.015  -3.197  14.511
   11    HE3  MET   1           2HE      MET   1  -4.471  -3.973  15.998
   12    H    VAL   2           H        VAL   2  -4.073  -3.642   9.347
   13    HA   VAL   2           HA       VAL   2  -2.179  -4.959   7.625
   14    HB   VAL   2           HB       VAL   2  -3.021  -2.069   7.860
   15   HG11  VAL   2          1HG1      VAL   2  -1.421  -3.417   5.693
   16   HG12  VAL   2          2HG1      VAL   2  -0.806  -2.243   6.854
   17   HG13  VAL   2          3HG1      VAL   2  -2.011  -1.756   5.661
   18   HG21  VAL   2          3HG2      VAL   2  -4.822  -3.558   7.207
   19   HG22  VAL   2          1HG2      VAL   2  -3.826  -4.211   5.909
   20   HG23  VAL   2          2HG2      VAL   2  -4.340  -2.526   5.861
   21    H    THR   3           H        THR   3   0.018  -4.759   7.626
   22    HA   THR   3           HA       THR   3   1.150  -4.182  10.230
   23    HB   THR   3           HB       THR   3   2.511  -5.278   7.761
   24    HG1  THR   3           1HG      THR   3   0.907  -6.456   9.754
   25   HG21  THR   3          3HG2      THR   3   4.129  -6.210   9.337
   26   HG22  THR   3          1HG2      THR   3   3.258  -5.477  10.683
   27   HG23  THR   3          2HG2      THR   3   4.059  -4.454   9.492
   28    H    GLN   4           H        GLN   4   2.802  -2.798  10.696
   29    HA   GLN   4           HA       GLN   4   2.901  -0.417   9.000
   30    HB2  GLN   4           1HB      GLN   4   2.248  -0.259  11.372
   31    HB3  GLN   4           2HB      GLN   4   3.813  -0.899  11.840
   32    HG2  GLN   4           1HG      GLN   4   3.710   1.523  12.108
   33    HG3  GLN   4           2HG      GLN   4   4.932   1.038  10.936
   34   HE21  GLN   4          1HE2      GLN   4   1.502   1.102  10.273
   35   HE22  GLN   4          2HE2      GLN   4   1.567   2.385   9.124
   36    H    PHE   5           H        PHE   5   4.680   0.170   7.892
   37    HA   PHE   5           HA       PHE   5   7.234  -1.222   8.307
   38    HB2  PHE   5           1HB      PHE   5   6.303   0.795   6.255
   39    HB3  PHE   5           2HB      PHE   5   7.969   0.262   6.376
   40    HD1  PHE   5           2HD      PHE   5   7.218  -2.691   7.000
   41    HD2  PHE   5           1HD      PHE   5   5.983   0.106   4.041
   42    HE1  PHE   5           2HE      PHE   5   6.751  -4.541   5.450
   43    HE2  PHE   5           1HE      PHE   5   5.516  -1.739   2.485
   44    HZ   PHE   5           HZ       PHE   5   5.902  -4.064   3.190
   45    H    LYS   6           H        LYS   6   9.203   0.002   8.653
   46    HA   LYS   6           HA       LYS   6   8.826   2.832   9.341
   47    HB2  LYS   6           1HB      LYS   6  10.296   2.656  11.251
   48    HB3  LYS   6           2HB      LYS   6   8.964   1.530  11.433
   49    HG2  LYS   6           1HG      LYS   6  10.635  -0.177  10.389
   50    HG3  LYS   6           2HG      LYS   6  11.847   0.987  10.927
   51    HD2  LYS   6           1HD      LYS   6  11.591  -0.593  12.676
   52    HD3  LYS   6           2HD      LYS   6  10.777   0.880  13.202
   53    HE2  LYS   6           1HE      LYS   6   9.398  -1.019  13.744
   54    HE3  LYS   6           2HE      LYS   6   8.626  -0.093  12.460
   55    HZ1  LYS   6           3HZ      LYS   6  10.180  -2.598  12.118
   56    HZ2  LYS   6           1HZ      LYS   6   9.503  -1.705  10.849
   57    HZ3  LYS   6           2HZ      LYS   6   8.504  -2.442  11.997
   58    H    THR   7           H        THR   7  10.346   0.577   7.445
   59    HA   THR   7           HA       THR   7  12.424   2.513   6.707
   60    HB   THR   7           HB       THR   7  14.029   0.557   6.396
   61    HG1  THR   7           1HG      THR   7  12.006  -0.665   7.985
   62   HG21  THR   7          3HG2      THR   7  14.749   0.574   8.751
   63   HG22  THR   7          1HG2      THR   7  13.217   1.323   9.199
   64   HG23  THR   7          2HG2      THR   7  14.353   2.189   8.166
   65    H    ALA   8           H        ALA   8  13.299   2.185   4.564
   66    HA   ALA   8           HA       ALA   8  11.287   1.440   2.695
   67    HB1  ALA   8           1HB      ALA   8  12.835   3.266   2.247
   68    HB2  ALA   8           2HB      ALA   8  12.896   2.042   0.984
   69    HB3  ALA   8           3HB      ALA   8  14.172   2.120   2.194
   70    H    SER   9           H        SER   9  14.127  -0.135   3.988
   71    HA   SER   9           HA       SER   9  14.288  -2.254   2.149
   72    HB2  SER   9           1HB      SER   9  14.969  -2.247   5.100
   73    HB3  SER   9           2HB      SER   9  15.498  -3.455   3.928
   74    HG   SER   9           HG       SER   9  16.632  -1.826   2.831
   75    H    GLU  10           H        GLU  10  12.394  -1.834   5.116
   76    HA   GLU  10           HA       GLU  10  11.020  -4.217   5.168
   77    HB2  GLU  10           1HB      GLU  10  10.423  -1.420   5.978
   78    HB3  GLU  10           2HB      GLU  10   9.112  -2.588   6.010
   79    HG2  GLU  10           1HG      GLU  10  10.369  -4.000   7.480
   80    HG3  GLU  10           2HG      GLU  10  11.750  -2.918   7.403
   81    H    PHE  11           H        PHE  11  10.282  -1.274   3.263
   82    HA   PHE  11           HA       PHE  11   7.949  -2.214   2.048
   83    HB2  PHE  11           1HB      PHE  11   8.889   0.124   1.878
   84    HB3  PHE  11           2HB      PHE  11  10.032  -0.487   0.690
   85    HD1  PHE  11           1HD      PHE  11   9.083  -1.508  -1.449
   86    HD2  PHE  11           2HD      PHE  11   6.750   0.844   1.228
   87    HE1  PHE  11           1HE      PHE  11   7.463  -1.064  -3.247
   88    HE2  PHE  11           2HE      PHE  11   5.120   1.303  -0.590
   89    HZ   PHE  11           HZ       PHE  11   5.488   0.330  -2.815
   90    H    ASP  12           H        ASP  12  11.269  -2.399   0.794
   91    HA   ASP  12           HA       ASP  12  10.772  -3.950  -1.482
   92    HB2  ASP  12           1HB      ASP  12  13.223  -3.748   0.274
   93    HB3  ASP  12           2HB      ASP  12  13.189  -4.733  -1.182
   94    H    SER  13           H        SER  13  11.542  -5.006   1.818
   95    HA   SER  13           HA       SER  13  11.861  -7.726   1.309
   96    HB2  SER  13           1HB      SER  13  12.447  -6.646   3.452
   97    HB3  SER  13           2HB      SER  13  10.734  -6.425   3.804
   98    HG   SER  13           HG       SER  13  10.901  -8.935   3.305
   99    H    ALA  14           H        ALA  14   8.927  -5.866   1.938
  100    HA   ALA  14           HA       ALA  14   7.219  -8.130   1.922
  101    HB1  ALA  14           1HB      ALA  14   5.393  -6.509   1.842
  102    HB2  ALA  14           2HB      ALA  14   6.555  -5.219   1.522
  103    HB3  ALA  14           3HB      ALA  14   6.585  -6.071   3.067
  104    H    ILE  15           H        ILE  15   8.396  -5.863  -0.446
  105    HA   ILE  15           HA       ILE  15   6.631  -6.484  -2.555
  106    HB   ILE  15           HB       ILE  15   9.477  -5.536  -2.758
  107   HG12  ILE  15          1HG1      ILE  15   8.418  -3.879  -1.490
  108   HG13  ILE  15          2HG1      ILE  15   8.310  -3.313  -3.152
  109   HG21  ILE  15          1HG2      ILE  15   9.132  -5.017  -4.942
  110   HG22  ILE  15          2HG2      ILE  15   7.387  -4.870  -4.745
  111   HG23  ILE  15          3HG2      ILE  15   8.132  -6.465  -4.802
  112   HD11  ILE  15          3HD1      ILE  15   6.234  -2.943  -1.945
  113   HD12  ILE  15          1HD1      ILE  15   6.107  -4.672  -1.624
  114   HD13  ILE  15          2HD1      ILE  15   6.009  -4.073  -3.279
  115    H    ALA  16           H        ALA  16   9.681  -7.873  -1.509
  116    HA   ALA  16           HA       ALA  16  10.073  -9.380  -3.931
  117    HB1  ALA  16           1HB      ALA  16  12.053 -10.273  -2.781
  118    HB2  ALA  16           2HB      ALA  16  11.536  -9.477  -1.293
  119    HB3  ALA  16           3HB      ALA  16  11.978  -8.512  -2.701
  120    H    GLN  17           H        GLN  17   7.797  -9.852  -1.827
  121    HA   GLN  17           HA       GLN  17   8.072 -12.685  -1.404
  122    HB2  GLN  17           1HB      GLN  17   5.849 -10.700  -0.943
  123    HB3  GLN  17           2HB      GLN  17   5.744 -12.400  -0.537
  124    HG2  GLN  17           1HG      GLN  17   7.604 -12.188   0.985
  125    HG3  GLN  17           2HG      GLN  17   7.776 -10.492   0.549
  126   HE21  GLN  17          1HE2      GLN  17   4.957  -9.940   0.483
  127   HE22  GLN  17          2HE2      GLN  17   4.386  -9.971   2.120
  128    H    ASP  18           H        ASP  18   7.024 -14.255  -2.578
  129    HA   ASP  18           HA       ASP  18   6.284 -13.516  -5.268
  130    HB2  ASP  18           1HB      ASP  18   7.613 -15.591  -4.615
  131    HB3  ASP  18           2HB      ASP  18   6.103 -16.268  -4.021
  132    H    LYS  19           H        LYS  19   4.550 -12.306  -3.556
  133    HA   LYS  19           HA       LYS  19   2.045 -13.405  -4.500
  134    HB2  LYS  19           1HB      LYS  19   0.979 -13.325  -2.266
  135    HB3  LYS  19           2HB      LYS  19   2.206 -14.575  -2.403
  136    HG2  LYS  19           1HG      LYS  19   3.792 -12.941  -1.302
  137    HG3  LYS  19           2HG      LYS  19   2.373 -11.956  -0.945
  138    HD2  LYS  19           1HD      LYS  19   2.704 -14.839  -0.110
  139    HD3  LYS  19           2HD      LYS  19   3.075 -13.459   0.920
  140    HE2  LYS  19           1HE      LYS  19   0.928 -14.125   1.571
  141    HE3  LYS  19           2HE      LYS  19   0.665 -12.728   0.534
  142    HZ1  LYS  19           3HZ      LYS  19  -0.891 -14.519   0.066
  143    HZ2  LYS  19           1HZ      LYS  19   0.387 -15.565  -0.301
  144    HZ3  LYS  19           2HZ      LYS  19   0.091 -14.218  -1.273
  145    H    LEU  20           H        LEU  20   0.201 -11.849  -3.477
  146    HA   LEU  20           HA       LEU  20   0.862  -9.316  -4.644
  147    HB2  LEU  20           1HB      LEU  20  -1.365 -10.601  -4.776
  148    HB3  LEU  20           2HB      LEU  20  -1.696  -9.949  -3.178
  149    HG   LEU  20           HG       LEU  20  -2.766  -8.687  -5.041
  150   HD11  LEU  20          1HD1      LEU  20  -2.153  -6.460  -4.284
  151   HD12  LEU  20          2HD1      LEU  20  -0.716  -7.113  -3.497
  152   HD13  LEU  20          3HD1      LEU  20  -2.320  -7.569  -2.923
  153   HD21  LEU  20          3HD2      LEU  20  -0.954  -9.012  -6.669
  154   HD22  LEU  20          1HD2      LEU  20   0.047  -7.892  -5.747
  155   HD23  LEU  20          2HD2      LEU  20  -1.437  -7.320  -6.508
  156    H    VAL  21           H        VAL  21   1.644  -7.621  -3.662
  157    HA   VAL  21           HA       VAL  21   1.440  -7.414  -0.735
  158    HB   VAL  21           HB       VAL  21   3.149  -5.556  -2.302
  159   HG11  VAL  21          1HG1      VAL  21   2.998  -5.332   0.098
  160   HG12  VAL  21          2HG1      VAL  21   4.628  -5.818  -0.367
  161   HG13  VAL  21          3HG1      VAL  21   3.513  -7.005   0.312
  162   HG21  VAL  21          3HG2      VAL  21   3.827  -7.465  -3.459
  163   HG22  VAL  21          1HG2      VAL  21   3.714  -8.488  -2.022
  164   HG23  VAL  21          2HG2      VAL  21   5.010  -7.305  -2.158
  165    H    VAL  22           H        VAL  22  -0.189  -6.141  -0.065
  166    HA   VAL  22           HA       VAL  22  -0.987  -3.841  -1.699
  167    HB   VAL  22           HB       VAL  22  -2.244  -4.828   0.870
  168   HG11  VAL  22          1HG1      VAL  22  -3.277  -2.963  -1.266
  169   HG12  VAL  22          2HG1      VAL  22  -2.733  -2.499   0.347
  170   HG13  VAL  22          3HG1      VAL  22  -4.173  -3.501   0.155
  171   HG21  VAL  22          3HG2      VAL  22  -3.964  -5.856  -0.533
  172   HG22  VAL  22          1HG2      VAL  22  -2.377  -6.569  -0.817
  173   HG23  VAL  22          2HG2      VAL  22  -3.047  -5.418  -1.975
  174    H    VAL  23           H        VAL  23   0.413  -2.191  -1.357
  175    HA   VAL  23           HA       VAL  23   1.217  -1.682   1.411
  176    HB   VAL  23           HB       VAL  23   2.434  -0.521  -1.093
  177   HG11  VAL  23          1HG1      VAL  23   3.166  -0.405   1.822
  178   HG12  VAL  23          2HG1      VAL  23   2.802   0.938   0.738
  179   HG13  VAL  23          3HG1      VAL  23   4.285   0.011   0.528
  180   HG21  VAL  23          3HG2      VAL  23   3.346  -2.781   0.676
  181   HG22  VAL  23          1HG2      VAL  23   4.308  -2.050  -0.611
  182   HG23  VAL  23          2HG2      VAL  23   2.818  -2.912  -1.003
  183    H    ALA  24           H        ALA  24   0.508  -0.089   2.478
  184    HA   ALA  24           HA       ALA  24  -1.279   1.880   1.194
  185    HB1  ALA  24           1HB      ALA  24  -2.159   0.383   2.986
  186    HB2  ALA  24           2HB      ALA  24  -2.276   2.097   3.386
  187    HB3  ALA  24           3HB      ALA  24  -1.013   1.106   4.111
  188    H    PHE  25           H        PHE  25   0.205   3.538   0.627
  189    HA   PHE  25           HA       PHE  25   1.788   4.614   2.852
  190    HB2  PHE  25           1HB      PHE  25   2.211   4.493  -0.044
  191    HB3  PHE  25           2HB      PHE  25   2.637   6.038   0.696
  192    HD1  PHE  25           1HD      PHE  25   2.881   2.500   1.805
  193    HD2  PHE  25           2HD      PHE  25   4.904   6.160   1.068
  194    HE1  PHE  25           1HE      PHE  25   4.958   1.508   2.656
  195    HE2  PHE  25           2HE      PHE  25   6.992   5.177   1.915
  196    HZ   PHE  25           HZ       PHE  25   7.017   2.847   2.711
  197    H    TYR  26           H        TYR  26   1.042   6.230   3.915
  198    HA   TYR  26           HA       TYR  26  -0.520   8.288   2.531
  199    HB2  TYR  26           1HB      TYR  26  -2.003   8.371   4.599
  200    HB3  TYR  26           2HB      TYR  26  -2.228   6.981   3.543
  201    HD1  TYR  26           2HD      TYR  26  -0.729   8.081   6.752
  202    HD2  TYR  26           1HD      TYR  26  -1.874   4.782   4.328
  203    HE1  TYR  26           2HE      TYR  26  -0.373   6.563   8.654
  204    HE2  TYR  26           1HE      TYR  26  -1.532   3.259   6.211
  205    HH   TYR  26           HH       TYR  26  -0.997   4.396   9.430
  206    H    ALA  27           H        ALA  27  -0.832  10.205   4.104
  207    HA   ALA  27           HA       ALA  27   1.571  10.522   5.773
  208    HB1  ALA  27           1HB      ALA  27   1.714  12.839   5.102
  209    HB2  ALA  27           2HB      ALA  27   0.259  12.675   4.115
  210    HB3  ALA  27           3HB      ALA  27   1.732  11.812   3.666
  211    H    THR  28           H        THR  28   1.189  11.201   7.810
  212    HA   THR  28           HA       THR  28  -1.433  11.072   8.816
  213    HB   THR  28           HB       THR  28  -0.311  12.043  10.923
  214    HG1  THR  28           1HG      THR  28   2.040  11.823  10.751
  215   HG21  THR  28          3HG2      THR  28   0.790   9.522   9.673
  216   HG22  THR  28          1HG2      THR  28  -0.725   9.647  10.567
  217   HG23  THR  28          2HG2      THR  28   0.811   9.920  11.390
  218    H    TRP  29           H        TRP  29   0.320  13.704   7.476
  219    HA   TRP  29           HA       TRP  29  -1.379  15.690   8.752
  220    HB2  TRP  29           1HB      TRP  29   0.039  17.340   7.581
  221    HB3  TRP  29           2HB      TRP  29   0.977  16.233   8.573
  222    HD1  TRP  29           HD       TRP  29   2.829  14.815   7.374
  223    HE1  TRP  29           1HE      TRP  29   3.716  14.722   4.957
  224    HE3  TRP  29           3HE      TRP  29  -0.811  17.562   5.064
  225    HZ2  TRP  29           2HZ      TRP  29   2.964  15.686   2.409
  226    HZ3  TRP  29           3HZ      TRP  29  -0.662  17.923   2.645
  227    HH2  TRP  29           HH       TRP  29   1.192  17.012   1.339
  228    H    CYS  30           H        CYS  30  -1.440  13.768   5.991
  229    HA   CYS  30           HA       CYS  30  -2.605  15.659   4.176
  230    HB2  CYS  30           1HB      CYS  30  -2.266  12.667   4.109
  231    HB3  CYS  30           2HB      CYS  30  -3.162  13.525   2.863
  232    HG   CYS  30           HG       CYS  30  -1.035  14.993   1.931
  233    H    GLY  31           H        GLY  31  -4.772  15.377   3.232
  234    HA2  GLY  31           1HA      GLY  31  -6.733  15.526   5.251
  235    HA3  GLY  31           2HA      GLY  31  -7.039  15.496   3.525
  236    HA   PRO  32           HA       PRO  32  -8.866  11.569   4.035
  237    HB2  PRO  32           1HB      PRO  32  -8.640  10.484   1.595
  238    HB3  PRO  32           2HB      PRO  32  -9.619  11.925   1.890
  239    HG2  PRO  32           1HG      PRO  32  -6.866  11.707   0.745
  240    HG3  PRO  32           2HG      PRO  32  -8.214  12.736   0.228
  241    HD2  PRO  32           1HD      PRO  32  -6.127  13.601   1.791
  242    HD3  PRO  32           2HD      PRO  32  -7.739  14.340   1.787
  243    H    CYS  33           H        CYS  33  -6.012  11.558   4.854
  244    HA   CYS  33           HA       CYS  33  -4.772   9.182   3.926
  245    HB2  CYS  33           1HB      CYS  33  -3.481   9.351   6.095
  246    HB3  CYS  33           2HB      CYS  33  -3.427  10.789   5.082
  247    HG   CYS  33           HG       CYS  33  -4.459  12.450   6.775
  248    H    LYS  34           H        LYS  34  -7.046   9.912   6.472
  249    HA   LYS  34           HA       LYS  34  -7.065   7.356   7.670
  250    HB2  LYS  34           1HB      LYS  34  -7.883   9.378   8.809
  251    HB3  LYS  34           2HB      LYS  34  -9.210   9.479   7.668
  252    HG2  LYS  34           1HG      LYS  34 -10.087   7.357   8.481
  253    HG3  LYS  34           2HG      LYS  34  -8.743   7.233   9.613
  254    HD2  LYS  34           1HD      LYS  34 -10.585   8.033  10.861
  255    HD3  LYS  34           2HD      LYS  34  -9.530   9.419  10.603
  256    HE2  LYS  34           1HE      LYS  34 -11.849   8.847   8.783
  257    HE3  LYS  34           2HE      LYS  34 -12.062   9.733  10.287
  258    HZ1  LYS  34           3HZ      LYS  34 -10.342  11.308   9.461
  259    HZ2  LYS  34           1HZ      LYS  34 -11.766  11.296   8.548
  260    HZ3  LYS  34           2HZ      LYS  34 -10.389  10.516   7.970
  261    H    MET  35           H        MET  35  -8.196   8.390   4.632
  262    HA   MET  35           HA       MET  35 -10.497   6.671   4.479
  263    HB2  MET  35           1HB      MET  35  -9.604   8.688   2.904
  264    HB3  MET  35           2HB      MET  35  -8.998   7.306   1.997
  265    HG2  MET  35           1HG      MET  35 -11.858   7.921   2.710
  266    HG3  MET  35           2HG      MET  35 -11.125   7.926   1.109
  267    HE1  MET  35           3HE      MET  35 -13.764   6.415   1.207
  268    HE2  MET  35           1HE      MET  35 -13.318   4.879   0.459
  269    HE3  MET  35           2HE      MET  35 -12.645   6.387  -0.158
  270    H    ILE  36           H        ILE  36  -7.076   6.464   3.819
  271    HA   ILE  36           HA       ILE  36  -7.185   3.859   2.661
  272    HB   ILE  36           HB       ILE  36  -5.087   5.797   3.331
  273   HG12  ILE  36          1HG1      ILE  36  -4.255   5.159   1.154
  274   HG13  ILE  36          2HG1      ILE  36  -5.315   3.755   1.126
  275   HG21  ILE  36          1HG2      ILE  36  -4.490   2.853   3.394
  276   HG22  ILE  36          2HG2      ILE  36  -4.170   4.043   4.657
  277   HG23  ILE  36          3HG2      ILE  36  -3.271   4.099   3.139
  278   HD11  ILE  36          3HD1      ILE  36  -6.166   6.632   1.083
  279   HD12  ILE  36          1HD1      ILE  36  -7.256   5.248   1.158
  280   HD13  ILE  36          2HD1      ILE  36  -6.226   5.488  -0.258
  281    H    ALA  37           H        ALA  37  -6.979   5.188   5.837
  282    HA   ALA  37           HA       ALA  37  -5.988   3.059   7.269
  283    HB1  ALA  37           1HB      ALA  37  -8.010   5.150   7.969
  284    HB2  ALA  37           2HB      ALA  37  -6.357   4.947   8.541
  285    HB3  ALA  37           3HB      ALA  37  -7.624   3.859   9.106
  286    HA   PRO  38           HA       PRO  38  -9.951   0.671   7.658
  287    HB2  PRO  38           1HB      PRO  38 -12.361   1.844   6.744
  288    HB3  PRO  38           2HB      PRO  38 -11.813   1.690   8.414
  289    HG2  PRO  38           1HG      PRO  38 -12.114   4.080   7.021
  290    HG3  PRO  38           2HG      PRO  38 -11.180   3.862   8.512
  291    HD2  PRO  38           1HD      PRO  38 -10.240   3.937   5.675
  292    HD3  PRO  38           2HD      PRO  38  -9.485   4.604   7.133
  293    H    MET  39           H        MET  39  -9.812   2.379   4.561
  294    HA   MET  39           HA       MET  39 -11.460   0.468   3.192
  295    HB2  MET  39           1HB      MET  39 -11.286   2.653   2.211
  296    HB3  MET  39           2HB      MET  39  -9.539   2.605   2.286
  297    HG2  MET  39           1HG      MET  39  -9.983   0.468   0.734
  298    HG3  MET  39           2HG      MET  39 -11.383   1.454   0.324
  299    HE1  MET  39           3HE      MET  39  -7.292   1.525   0.353
  300    HE2  MET  39           1HE      MET  39  -7.979   2.599   1.571
  301    HE3  MET  39           2HE      MET  39  -7.183   3.276   0.147
  302    H    ILE  40           H        ILE  40  -8.002   1.002   3.559
  303    HA   ILE  40           HA       ILE  40  -7.246  -1.245   1.971
  304    HB   ILE  40           HB       ILE  40  -5.988   0.954   3.271
  305   HG12  ILE  40          1HG1      ILE  40  -4.608  -1.006   1.472
  306   HG13  ILE  40          2HG1      ILE  40  -5.917   0.005   0.864
  307   HG21  ILE  40          1HG2      ILE  40  -5.276  -0.625   5.001
  308   HG22  ILE  40          2HG2      ILE  40  -3.908  -0.063   4.042
  309   HG23  ILE  40          3HG2      ILE  40  -4.579  -1.669   3.763
  310   HD11  ILE  40          3HD1      ILE  40  -3.449   0.769   0.647
  311   HD12  ILE  40          1HD1      ILE  40  -3.658   1.262   2.325
  312   HD13  ILE  40          2HD1      ILE  40  -4.705   1.929   1.075
  313    H    GLU  41           H        GLU  41  -7.662  -0.597   5.404
  314    HA   GLU  41           HA       GLU  41  -6.849  -3.110   6.371
  315    HB2  GLU  41           1HB      GLU  41  -7.616  -0.821   7.508
  316    HB3  GLU  41           2HB      GLU  41  -9.137  -1.682   7.656
  317    HG2  GLU  41           1HG      GLU  41  -8.159  -2.174   9.658
  318    HG3  GLU  41           2HG      GLU  41  -7.608  -3.543   8.695
  319    H    LYS  42           H        LYS  42  -9.746  -1.994   4.831
  320    HA   LYS  42           HA       LYS  42 -11.405  -4.215   5.475
  321    HB2  LYS  42           1HB      LYS  42 -12.363  -2.044   4.951
  322    HB3  LYS  42           2HB      LYS  42 -11.654  -2.077   3.345
  323    HG2  LYS  42           1HG      LYS  42 -14.001  -2.579   3.216
  324    HG3  LYS  42           2HG      LYS  42 -13.074  -4.021   2.798
  325    HD2  LYS  42           1HD      LYS  42 -13.432  -4.924   5.023
  326    HD3  LYS  42           2HD      LYS  42 -14.290  -3.458   5.501
  327    HE2  LYS  42           1HE      LYS  42 -15.151  -5.343   3.310
  328    HE3  LYS  42           2HE      LYS  42 -15.811  -5.316   4.944
  329    HZ1  LYS  42           3HZ      LYS  42 -15.924  -3.068   3.011
  330    HZ2  LYS  42           1HZ      LYS  42 -16.580  -3.066   4.568
  331    HZ3  LYS  42           2HZ      LYS  42 -17.206  -4.099   3.386
  332    H    PHE  43           H        PHE  43  -9.252  -3.428   2.784
  333    HA   PHE  43           HA       PHE  43 -10.078  -5.402   0.980
  334    HB2  PHE  43           1HB      PHE  43  -7.237  -4.426   1.419
  335    HB3  PHE  43           2HB      PHE  43  -7.823  -5.285  -0.019
  336    HD1  PHE  43           2HD      PHE  43 -10.507  -3.823  -0.147
  337    HD2  PHE  43           1HD      PHE  43  -6.506  -2.467   0.317
  338    HE1  PHE  43           2HE      PHE  43 -11.111  -1.694  -1.213
  339    HE2  PHE  43           1HE      PHE  43  -7.104  -0.333  -0.745
  340    HZ   PHE  43           HZ       PHE  43  -9.408   0.053  -1.511
  341    H    SER  44           H        SER  44  -7.441  -5.639   3.434
  342    HA   SER  44           HA       SER  44  -7.142  -8.462   2.888
  343    HB2  SER  44           1HB      SER  44  -5.529  -8.371   4.772
  344    HB3  SER  44           2HB      SER  44  -5.185  -7.216   3.489
  345    HG   SER  44           HG       SER  44  -5.230  -5.761   4.993
  346    H    GLU  45           H        GLU  45  -9.139  -6.557   4.941
  347    HA   GLU  45           HA       GLU  45  -9.794  -8.476   6.896
  348    HB2  GLU  45           1HB      GLU  45 -10.549  -6.116   6.963
  349    HB3  GLU  45           2HB      GLU  45 -11.606  -6.432   5.595
  350    HG2  GLU  45           1HG      GLU  45 -12.734  -8.174   7.020
  351    HG3  GLU  45           2HG      GLU  45 -11.808  -7.536   8.379
  352    H    GLN  46           H        GLN  46 -10.770  -8.002   3.574
  353    HA   GLN  46           HA       GLN  46 -12.697 -10.146   3.637
  354    HB2  GLN  46           1HB      GLN  46 -11.630  -8.448   1.373
  355    HB3  GLN  46           2HB      GLN  46 -12.890  -9.662   1.192
  356    HG2  GLN  46           1HG      GLN  46 -14.362  -8.431   2.630
  357    HG3  GLN  46           2HG      GLN  46 -13.089  -7.274   3.011
  358   HE21  GLN  46          1HE2      GLN  46 -12.532  -5.719   1.520
  359   HE22  GLN  46          2HE2      GLN  46 -13.515  -5.352   0.142
  360    H    TYR  47           H        TYR  47  -9.512  -9.479   2.242
  361    HA   TYR  47           HA       TYR  47  -9.109 -12.374   2.061
  362    HB2  TYR  47           1HB      TYR  47  -7.641 -11.799   0.019
  363    HB3  TYR  47           2HB      TYR  47  -9.386 -11.861  -0.160
  364    HD1  TYR  47           2HD      TYR  47  -6.667  -9.372   0.529
  365    HD2  TYR  47           1HD      TYR  47 -10.454 -10.171  -1.242
  366    HE1  TYR  47           2HE      TYR  47  -6.678  -7.124  -0.468
  367    HE2  TYR  47           1HE      TYR  47 -10.471  -7.926  -2.228
  368    HH   TYR  47           HH       TYR  47  -7.708  -5.883  -2.211
  369    HA   PRO  48           HA       PRO  48  -5.661 -10.711   4.518
  370    HB2  PRO  48           1HB      PRO  48  -5.567 -12.644   6.347
  371    HB3  PRO  48           2HB      PRO  48  -6.805 -11.389   6.406
  372    HG2  PRO  48           1HG      PRO  48  -7.019 -14.201   5.408
  373    HG3  PRO  48           2HG      PRO  48  -8.165 -13.274   6.393
  374    HD2  PRO  48           1HD      PRO  48  -8.389 -13.624   3.670
  375    HD3  PRO  48           2HD      PRO  48  -9.096 -12.263   4.562
  376    H    GLN  49           H        GLN  49  -6.070 -13.286   2.464
  377    HA   GLN  49           HA       GLN  49  -3.543 -14.589   2.916
  378    HB2  GLN  49           1HB      GLN  49  -4.223 -16.171   1.456
  379    HB3  GLN  49           2HB      GLN  49  -5.800 -15.478   1.813
  380    HG2  GLN  49           1HG      GLN  49  -4.093 -14.536  -0.423
  381    HG3  GLN  49           2HG      GLN  49  -5.233 -15.872  -0.617
  382   HE21  GLN  49          1HE2      GLN  49  -5.175 -13.255  -1.900
  383   HE22  GLN  49          2HE2      GLN  49  -6.691 -12.504  -1.537
  384    H    ALA  50           H        ALA  50  -4.440 -11.700   1.605
  385    HA   ALA  50           HA       ALA  50  -2.084 -11.567  -0.169
  386    HB1  ALA  50           1HB      ALA  50  -4.269  -9.551   0.388
  387    HB2  ALA  50           2HB      ALA  50  -4.144 -10.577  -1.043
  388    HB3  ALA  50           3HB      ALA  50  -2.935  -9.326  -0.741
  389    H    ASP  51           H        ASP  51  -0.638  -9.594   0.239
  390    HA   ASP  51           HA       ASP  51  -0.213  -9.536   3.110
  391    HB2  ASP  51           1HB      ASP  51   1.559  -9.052   0.786
  392    HB3  ASP  51           2HB      ASP  51   1.897  -8.159   2.254
  393    H    PHE  52           H        PHE  52  -0.109  -7.787   4.346
  394    HA   PHE  52           HA       PHE  52  -1.330  -5.368   3.209
  395    HB2  PHE  52           1HB      PHE  52  -2.321  -5.308   5.675
  396    HB3  PHE  52           2HB      PHE  52  -3.120  -6.206   4.392
  397    HD1  PHE  52           2HD      PHE  52  -0.853  -6.543   7.304
  398    HD2  PHE  52           1HD      PHE  52  -3.384  -8.541   4.530
  399    HE1  PHE  52           2HE      PHE  52  -0.679  -8.600   8.635
  400    HE2  PHE  52           1HE      PHE  52  -3.214 -10.604   5.857
  401    HZ   PHE  52           HZ       PHE  52  -1.857 -10.636   7.912
  402    H    TYR  53           H        TYR  53   0.067  -3.735   3.360
  403    HA   TYR  53           HA       TYR  53   1.471  -3.359   5.895
  404    HB2  TYR  53           1HB      TYR  53   2.836  -3.328   3.193
  405    HB3  TYR  53           2HB      TYR  53   3.574  -2.815   4.706
  406    HD1  TYR  53           1HD      TYR  53   3.942  -4.514   6.518
  407    HD2  TYR  53           2HD      TYR  53   2.762  -5.612   2.582
  408    HE1  TYR  53           1HE      TYR  53   4.674  -6.818   6.949
  409    HE2  TYR  53           2HE      TYR  53   3.496  -7.924   2.997
  410    HH   TYR  53           HH       TYR  53   4.861  -9.189   4.424
  411    H    LYS  54           H        LYS  54   2.092  -1.225   6.328
  412    HA   LYS  54           HA       LYS  54   1.011   0.856   4.600
  413    HB2  LYS  54           1HB      LYS  54  -0.564   1.647   6.221
  414    HB3  LYS  54           2HB      LYS  54  -0.850  -0.074   6.009
  415    HG2  LYS  54           1HG      LYS  54   0.665  -0.366   8.060
  416    HG3  LYS  54           2HG      LYS  54   0.381   1.351   8.330
  417    HD2  LYS  54           1HD      LYS  54  -1.711  -0.808   8.157
  418    HD3  LYS  54           2HD      LYS  54  -1.185   0.018   9.617
  419    HE2  LYS  54           1HE      LYS  54  -2.002   2.148   8.644
  420    HE3  LYS  54           2HE      LYS  54  -2.628   1.238   7.269
  421    HZ1  LYS  54           3HZ      LYS  54  -4.094   0.031   8.732
  422    HZ2  LYS  54           1HZ      LYS  54  -4.321   1.693   8.971
  423    HZ3  LYS  54           2HZ      LYS  54  -3.432   0.795  10.093
  424    H    LEU  55           H        LEU  55   1.731   2.982   5.194
  425    HA   LEU  55           HA       LEU  55   3.420   3.348   7.489
  426    HB2  LEU  55           1HB      LEU  55   5.005   2.214   6.102
  427    HB3  LEU  55           2HB      LEU  55   4.578   3.185   4.710
  428    HG   LEU  55           HG       LEU  55   5.748   4.561   7.089
  429   HD11  LEU  55          1HD1      LEU  55   7.308   2.967   5.056
  430   HD12  LEU  55          2HD1      LEU  55   7.219   2.655   6.790
  431   HD13  LEU  55          3HD1      LEU  55   8.003   4.118   6.196
  432   HD21  LEU  55          3HD2      LEU  55   6.513   6.097   5.468
  433   HD22  LEU  55          1HD2      LEU  55   4.863   5.687   5.001
  434   HD23  LEU  55          2HD2      LEU  55   6.228   4.962   4.148
  435    H    ASP  56           H        ASP  56   3.802   5.561   7.922
  436    HA   ASP  56           HA       ASP  56   2.389   7.413   6.173
  437    HB2  ASP  56           1HB      ASP  56   2.509   8.987   8.004
  438    HB3  ASP  56           2HB      ASP  56   1.770   7.491   8.545
  439    H    VAL  57           H        VAL  57   3.389   8.855   4.974
  440    HA   VAL  57           HA       VAL  57   6.211   8.711   4.625
  441    HB   VAL  57           HB       VAL  57   5.919  10.132   2.791
  442   HG11  VAL  57          1HG1      VAL  57   3.209   8.848   3.099
  443   HG12  VAL  57          2HG1      VAL  57   4.674   7.966   2.665
  444   HG13  VAL  57          3HG1      VAL  57   4.053   9.218   1.595
  445   HG21  VAL  57          3HG2      VAL  57   4.955  12.047   3.827
  446   HG22  VAL  57          1HG2      VAL  57   3.474  11.172   4.208
  447   HG23  VAL  57          2HG2      VAL  57   3.858  11.564   2.537
  448    H    ASP  58           H        ASP  58   4.273  10.444   6.759
  449    HA   ASP  58           HA       ASP  58   5.758  12.858   6.953
  450    HB2  ASP  58           1HB      ASP  58   3.473  12.701   7.808
  451    HB3  ASP  58           2HB      ASP  58   3.978  11.492   8.984
  452    H    GLU  59           H        GLU  59   5.752   9.817   8.791
  453    HA   GLU  59           HA       GLU  59   8.204  10.485  10.148
  454    HB2  GLU  59           1HB      GLU  59   6.616   7.936   9.906
  455    HB3  GLU  59           2HB      GLU  59   8.156   8.004  10.749
  456    HG2  GLU  59           1HG      GLU  59   5.817   9.753  11.449
  457    HG3  GLU  59           2HG      GLU  59   6.108   8.182  12.190
  458    H    LEU  60           H        LEU  60   7.317   8.516   7.310
  459    HA   LEU  60           HA       LEU  60  10.220   8.234   6.802
  460    HB2  LEU  60           1HB      LEU  60   8.045   6.213   6.530
  461    HB3  LEU  60           2HB      LEU  60   9.471   6.097   5.523
  462    HG   LEU  60           HG       LEU  60   9.878   4.661   7.330
  463   HD11  LEU  60          1HD1      LEU  60  11.748   6.188   6.791
  464   HD12  LEU  60          2HD1      LEU  60  11.778   5.592   8.448
  465   HD13  LEU  60          3HD1      LEU  60  11.231   7.234   8.115
  466   HD21  LEU  60          3HD2      LEU  60   8.080   5.385   8.790
  467   HD22  LEU  60          1HD2      LEU  60   8.969   6.857   9.182
  468   HD23  LEU  60          2HD2      LEU  60   9.601   5.286   9.677
  469    H    GLY  61           H        GLY  61  10.089  10.163   5.563
  470    HA2  GLY  61           1HA      GLY  61   8.437  10.299   3.222
  471    HA3  GLY  61           2HA      GLY  61   9.707  11.425   3.671
  472    H    ASP  62           H        ASP  62  11.853   9.523   3.814
  473    HA   ASP  62           HA       ASP  62  12.553   9.489   1.059
  474    HB2  ASP  62           1HB      ASP  62  14.643   8.513   1.711
  475    HB3  ASP  62           2HB      ASP  62  14.214   9.719   2.917
  476    H    VAL  63           H        VAL  63  11.091   7.204   3.165
  477    HA   VAL  63           HA       VAL  63  11.460   4.913   1.528
  478    HB   VAL  63           HB       VAL  63   9.229   5.507   3.466
  479   HG11  VAL  63          1HG1      VAL  63   8.594   3.759   1.922
  480   HG12  VAL  63          2HG1      VAL  63   8.944   3.044   3.496
  481   HG13  VAL  63          3HG1      VAL  63  10.121   2.925   2.189
  482   HG21  VAL  63          3HG2      VAL  63  11.698   3.828   3.884
  483   HG22  VAL  63          1HG2      VAL  63  10.472   4.237   5.082
  484   HG23  VAL  63          2HG2      VAL  63  11.532   5.497   4.443
  485    H    ALA  64           H        ALA  64   8.750   7.215   1.888
  486    HA   ALA  64           HA       ALA  64   7.129   6.291  -0.147
  487    HB1  ALA  64           1HB      ALA  64   6.465   8.073   1.371
  488    HB2  ALA  64           2HB      ALA  64   6.268   8.578  -0.308
  489    HB3  ALA  64           3HB      ALA  64   7.642   9.158   0.632
  490    H    GLN  65           H        GLN  65   9.979   8.326  -0.322
  491    HA   GLN  65           HA       GLN  65   9.723   8.962  -3.097
  492    HB2  GLN  65           1HB      GLN  65  12.113   9.075  -1.242
  493    HB3  GLN  65           2HB      GLN  65  12.090   9.734  -2.872
  494    HG2  GLN  65           1HG      GLN  65  10.379  11.315  -2.257
  495    HG3  GLN  65           2HG      GLN  65  10.256  10.600  -0.649
  496   HE21  GLN  65          1HE2      GLN  65  11.797  11.072   0.879
  497   HE22  GLN  65          2HE2      GLN  65  12.983  12.314   0.669
  498    H    LYS  66           H        LYS  66  11.151   6.355  -1.314
  499    HA   LYS  66           HA       LYS  66  12.704   5.248  -3.363
  500    HB2  LYS  66           1HB      LYS  66  13.348   4.253  -1.444
  501    HB3  LYS  66           2HB      LYS  66  11.809   4.582  -0.662
  502    HG2  LYS  66           1HG      LYS  66  12.002   2.274  -0.661
  503    HG3  LYS  66           2HG      LYS  66  10.895   2.642  -1.978
  504    HD2  LYS  66           1HD      LYS  66  12.792   2.454  -3.562
  505    HD3  LYS  66           2HD      LYS  66  13.819   1.954  -2.215
  506    HE2  LYS  66           1HE      LYS  66  12.375   0.033  -1.818
  507    HE3  LYS  66           2HE      LYS  66  11.325   0.540  -3.141
  508    HZ1  LYS  66           3HZ      LYS  66  12.948  -1.236  -3.702
  509    HZ2  LYS  66           1HZ      LYS  66  14.192  -0.109  -3.488
  510    HZ3  LYS  66           2HZ      LYS  66  13.042   0.132  -4.702
  511    H    ASN  67           H        ASN  67   9.304   5.263  -2.719
  512    HA   ASN  67           HA       ASN  67   8.863   2.864  -4.351
  513    HB2  ASN  67           1HB      ASN  67   6.826   4.285  -2.671
  514    HB3  ASN  67           2HB      ASN  67   6.807   2.633  -3.242
  515   HD21  ASN  67          1HD2      ASN  67   6.858   4.187  -0.602
  516   HD22  ASN  67          2HD2      ASN  67   7.936   3.266   0.357
  517    H    GLU  68           H        GLU  68   8.788   6.187  -4.472
  518    HA   GLU  68           HA       GLU  68   8.250   7.573  -6.177
  519    HB2  GLU  68           1HB      GLU  68   8.370   5.606  -7.699
  520    HB3  GLU  68           2HB      GLU  68   6.660   5.299  -7.384
  521    HG2  GLU  68           1HG      GLU  68   6.150   7.528  -8.340
  522    HG3  GLU  68           2HG      GLU  68   7.857   7.731  -8.720
  523    H    VAL  69           H        VAL  69   6.567   6.708  -3.751
  524    HA   VAL  69           HA       VAL  69   4.017   7.821  -4.623
  525    HB   VAL  69           HB       VAL  69   3.464   6.058  -3.253
  526   HG11  VAL  69          1HG1      VAL  69   4.607   5.172  -1.453
  527   HG12  VAL  69          2HG1      VAL  69   5.391   6.707  -1.062
  528   HG13  VAL  69          3HG1      VAL  69   5.911   5.790  -2.468
  529   HG21  VAL  69          3HG2      VAL  69   2.349   8.081  -2.461
  530   HG22  VAL  69          1HG2      VAL  69   3.646   8.339  -1.296
  531   HG23  VAL  69          2HG2      VAL  69   2.603   6.925  -1.154
  532    H    SER  70           H        SER  70   4.026   9.909  -4.824
  533    HA   SER  70           HA       SER  70   5.319  11.549  -2.754
  534    HB2  SER  70           1HB      SER  70   5.262  13.318  -4.640
  535    HB3  SER  70           2HB      SER  70   6.441  12.012  -4.763
  536    HG   SER  70           HG       SER  70   5.484  11.336  -6.502
  537    H    ALA  71           H        ALA  71   2.385  10.766  -4.318
  538    HA   ALA  71           HA       ALA  71   1.006  12.996  -3.004
  539    HB1  ALA  71           1HB      ALA  71   0.436  12.637  -5.361
  540    HB2  ALA  71           2HB      ALA  71  -0.951  12.319  -4.320
  541    HB3  ALA  71           3HB      ALA  71  -0.032  10.975  -4.999
  542    H    MET  72           H        MET  72  -0.642  12.548  -1.473
  543    HA   MET  72           HA       MET  72  -0.846   9.749  -0.625
  544    HB2  MET  72           1HB      MET  72  -0.313  12.059   1.259
  545    HB3  MET  72           2HB      MET  72  -0.654  10.406   1.747
  546    HG2  MET  72           1HG      MET  72   1.632  10.492   1.922
  547    HG3  MET  72           2HG      MET  72   1.422   9.821   0.307
  548    HE1  MET  72           3HE      MET  72   4.228  10.891   0.922
  549    HE2  MET  72           1HE      MET  72   4.538  11.939  -0.459
  550    HE3  MET  72           2HE      MET  72   3.712  10.399  -0.687
  551    HA   PRO  73           HA       PRO  73  -1.829   8.668   0.868
  552    HB2  PRO  73           1HB      PRO  73  -3.948   7.010   0.913
  553    HB3  PRO  73           2HB      PRO  73  -3.601   8.142   2.220
  554    HG2  PRO  73           1HG      PRO  73  -5.633   8.309   0.054
  555    HG3  PRO  73           2HG      PRO  73  -5.740   8.864   1.741
  556    HD2  PRO  73           1HD      PRO  73  -5.214  10.470  -0.482
  557    HD3  PRO  73           2HD      PRO  73  -4.878  10.902   1.205
  558    H    THR  74           H        THR  74  -1.213   6.769  -0.165
  559    HA   THR  74           HA       THR  74  -2.125   6.337  -2.929
  560    HB   THR  74           HB       THR  74   0.677   6.871  -1.969
  561    HG1  THR  74           1HG      THR  74   0.129   8.615  -3.020
  562   HG21  THR  74          3HG2      THR  74   0.923   4.746  -3.082
  563   HG22  THR  74          1HG2      THR  74   1.549   6.018  -4.129
  564   HG23  THR  74          2HG2      THR  74  -0.035   5.302  -4.459
  565    H    LEU  75           H        LEU  75  -2.089   4.284  -3.620
  566    HA   LEU  75           HA       LEU  75  -1.317   2.203  -1.676
  567    HB2  LEU  75           1HB      LEU  75  -3.334   2.032  -3.904
  568    HB3  LEU  75           2HB      LEU  75  -3.012   0.808  -2.695
  569    HG   LEU  75           HG       LEU  75  -3.761   2.833  -1.091
  570   HD11  LEU  75          1HD1      LEU  75  -4.205   4.329  -3.035
  571   HD12  LEU  75          2HD1      LEU  75  -5.627   4.033  -2.038
  572   HD13  LEU  75          3HD1      LEU  75  -5.447   3.196  -3.579
  573   HD21  LEU  75          3HD2      LEU  75  -5.410   0.788  -2.529
  574   HD22  LEU  75          1HD2      LEU  75  -6.038   1.769  -1.205
  575   HD23  LEU  75          2HD2      LEU  75  -4.676   0.682  -0.929
  576    H    LEU  76           H        LEU  76   0.302   0.877  -2.358
  577    HA   LEU  76           HA       LEU  76   0.775   0.714  -5.261
  578    HB2  LEU  76           1HB      LEU  76   2.599   1.343  -3.078
  579    HB3  LEU  76           2HB      LEU  76   3.171   0.015  -4.068
  580    HG   LEU  76           HG       LEU  76   2.379   2.727  -5.145
  581   HD11  LEU  76          1HD1      LEU  76   5.137   1.584  -4.683
  582   HD12  LEU  76          2HD1      LEU  76   4.386   2.870  -3.740
  583   HD13  LEU  76          3HD1      LEU  76   4.770   3.138  -5.451
  584   HD21  LEU  76          3HD2      LEU  76   2.089   0.953  -6.769
  585   HD22  LEU  76          1HD2      LEU  76   3.711   0.346  -6.438
  586   HD23  LEU  76          2HD2      LEU  76   3.497   1.925  -7.191
  587    H    LEU  77           H        LEU  77   0.200  -1.162  -6.014
  588    HA   LEU  77           HA       LEU  77   0.308  -3.555  -4.332
  589    HB2  LEU  77           1HB      LEU  77  -0.904  -2.951  -7.025
  590    HB3  LEU  77           2HB      LEU  77  -0.747  -4.588  -6.434
  591    HG   LEU  77           HG       LEU  77  -2.315  -4.183  -4.660
  592   HD11  LEU  77          1HD1      LEU  77  -3.435  -2.035  -4.357
  593   HD12  LEU  77          2HD1      LEU  77  -2.409  -1.315  -5.598
  594   HD13  LEU  77          3HD1      LEU  77  -1.698  -1.881  -4.087
  595   HD21  LEU  77          3HD2      LEU  77  -3.080  -4.627  -7.016
  596   HD22  LEU  77          1HD2      LEU  77  -3.430  -2.901  -7.136
  597   HD23  LEU  77          2HD2      LEU  77  -4.274  -3.890  -5.943
  598    H    PHE  78           H        PHE  78   1.973  -4.938  -4.498
  599    HA   PHE  78           HA       PHE  78   3.500  -4.950  -7.011
  600    HB2  PHE  78           1HB      PHE  78   4.540  -5.025  -4.195
  601    HB3  PHE  78           2HB      PHE  78   5.470  -5.679  -5.533
  602    HD1  PHE  78           1HD      PHE  78   3.968  -2.579  -4.188
  603    HD2  PHE  78           2HD      PHE  78   6.667  -4.292  -6.995
  604    HE1  PHE  78           1HE      PHE  78   4.885  -0.351  -4.676
  605    HE2  PHE  78           2HE      PHE  78   7.580  -2.064  -7.487
  606    HZ   PHE  78           HZ       PHE  78   6.689  -0.089  -6.324
  607    H    LYS  79           H        LYS  79   4.290  -6.963  -7.733
  608    HA   LYS  79           HA       LYS  79   3.646  -9.253  -6.005
  609    HB2  LYS  79           1HB      LYS  79   1.922  -8.888  -7.839
  610    HB3  LYS  79           2HB      LYS  79   3.197  -9.298  -8.973
  611    HG2  LYS  79           1HG      LYS  79   3.392 -11.502  -8.065
  612    HG3  LYS  79           2HG      LYS  79   2.266 -11.108  -6.762
  613    HD2  LYS  79           1HD      LYS  79   0.480 -10.784  -8.379
  614    HD3  LYS  79           2HD      LYS  79   1.601 -11.105  -9.702
  615    HE2  LYS  79           1HE      LYS  79   1.939 -13.374  -8.881
  616    HE3  LYS  79           2HE      LYS  79   0.849 -13.056  -7.530
  617    HZ1  LYS  79           3HZ      LYS  79  -0.983 -12.886  -8.976
  618    HZ2  LYS  79           1HZ      LYS  79  -0.132 -14.257  -9.485
  619    HZ3  LYS  79           2HZ      LYS  79   0.001 -12.815 -10.356
  620    H    ASN  80           H        ASN  80   5.488 -10.097  -5.521
  621    HA   ASN  80           HA       ASN  80   7.518 -11.094  -5.591
  622    HB2  ASN  80           1HB      ASN  80   7.536 -11.508  -8.523
  623    HB3  ASN  80           2HB      ASN  80   7.868 -12.635  -7.218
  624   HD21  ASN  80          1HD2      ASN  80   6.226 -12.783  -9.687
  625   HD22  ASN  80          2HD2      ASN  80   4.677 -13.330  -9.149
  626    H    GLY  81           H        GLY  81   7.892  -8.491  -5.456
  627    HA2  GLY  81           1HA      GLY  81   9.652  -6.996  -5.685
  628    HA3  GLY  81           2HA      GLY  81  10.476  -8.216  -6.655
  629    H    LYS  82           H        LYS  82   7.418  -7.617  -7.815
  630    HA   LYS  82           HA       LYS  82   8.342  -5.553  -9.697
  631    HB2  LYS  82           1HB      LYS  82   6.509  -7.878 -10.348
  632    HB3  LYS  82           2HB      LYS  82   7.120  -6.674 -11.474
  633    HG2  LYS  82           1HG      LYS  82   9.313  -7.547 -11.364
  634    HG3  LYS  82           2HG      LYS  82   8.911  -8.565  -9.979
  635    HD2  LYS  82           1HD      LYS  82   7.355  -9.840 -11.403
  636    HD3  LYS  82           2HD      LYS  82   7.830  -8.845 -12.782
  637    HE2  LYS  82           1HE      LYS  82   9.018 -10.979 -12.777
  638    HE3  LYS  82           2HE      LYS  82  10.128  -9.626 -12.566
  639    HZ1  LYS  82           3HZ      LYS  82   9.099 -11.373 -10.394
  640    HZ2  LYS  82           1HZ      LYS  82  10.168 -10.078 -10.190
  641    HZ3  LYS  82           2HZ      LYS  82  10.647 -11.442 -11.064
  642    H    GLU  83           H        GLU  83   6.492  -4.265 -10.522
  643    HA   GLU  83           HA       GLU  83   4.591  -3.741  -8.453
  644    HB2  GLU  83           1HB      GLU  83   5.625  -2.081 -10.110
  645    HB3  GLU  83           2HB      GLU  83   4.507  -2.730 -11.297
  646    HG2  GLU  83           1HG      GLU  83   2.614  -1.943 -10.068
  647    HG3  GLU  83           2HG      GLU  83   3.640  -1.517  -8.688
  648    H    VAL  84           H        VAL  84   2.194  -3.551  -9.197
  649    HA   VAL  84           HA       VAL  84   1.439  -5.165 -11.453
  650    HB   VAL  84           HB       VAL  84  -0.514  -6.142 -10.019
  651   HG11  VAL  84          1HG1      VAL  84   0.664  -8.226  -9.804
  652   HG12  VAL  84          2HG1      VAL  84   2.221  -7.397  -9.887
  653   HG13  VAL  84          3HG1      VAL  84   1.164  -7.437 -11.301
  654   HG21  VAL  84          3HG2      VAL  84   0.157  -6.787  -7.787
  655   HG22  VAL  84          1HG2      VAL  84   0.181  -5.034  -7.961
  656   HG23  VAL  84          2HG2      VAL  84   1.691  -5.940  -7.990
  657    H    ALA  85           H        ALA  85   0.692  -2.918  -8.898
  658    HA   ALA  85           HA       ALA  85  -0.857  -1.382 -10.712
  659    HB1  ALA  85           1HB      ALA  85  -2.896  -1.320  -9.214
  660    HB2  ALA  85           2HB      ALA  85  -2.248  -2.784  -8.472
  661    HB3  ALA  85           3HB      ALA  85  -2.666  -2.776 -10.180
  662    H    LYS  86           H        LYS  86  -1.547   0.654  -9.848
  663    HA   LYS  86           HA       LYS  86  -0.252   1.524  -7.389
  664    HB2  LYS  86           1HB      LYS  86   1.492   1.705  -9.079
  665    HB3  LYS  86           2HB      LYS  86   0.419   2.614 -10.132
  666    HG2  LYS  86           1HG      LYS  86   0.350   4.383  -8.335
  667    HG3  LYS  86           2HG      LYS  86   1.656   3.498  -7.538
  668    HD2  LYS  86           1HD      LYS  86   1.710   4.682 -10.316
  669    HD3  LYS  86           2HD      LYS  86   2.590   5.270  -8.905
  670    HE2  LYS  86           1HE      LYS  86   3.978   3.344  -8.862
  671    HE3  LYS  86           2HE      LYS  86   2.963   2.502 -10.029
  672    HZ1  LYS  86           3HZ      LYS  86   4.933   3.298 -11.100
  673    HZ2  LYS  86           1HZ      LYS  86   4.662   4.882 -10.560
  674    HZ3  LYS  86           2HZ      LYS  86   3.611   4.171 -11.685
  675    H    VAL  87           H        VAL  87  -1.613   2.896  -6.374
  676    HA   VAL  87           HA       VAL  87  -3.650   4.265  -8.006
  677    HB   VAL  87           HB       VAL  87  -4.263   2.866  -5.405
  678   HG11  VAL  87          1HG1      VAL  87  -5.695   4.778  -5.958
  679   HG12  VAL  87          2HG1      VAL  87  -6.582   3.255  -6.001
  680   HG13  VAL  87          3HG1      VAL  87  -6.084   4.028  -7.506
  681   HG21  VAL  87          3HG2      VAL  87  -4.968   1.923  -8.178
  682   HG22  VAL  87          1HG2      VAL  87  -5.335   1.116  -6.656
  683   HG23  VAL  87          2HG2      VAL  87  -3.663   1.253  -7.200
  684    H    VAL  88           H        VAL  88  -4.079   6.312  -7.404
  685    HA   VAL  88           HA       VAL  88  -2.872   7.253  -4.887
  686    HB   VAL  88           HB       VAL  88  -2.867   9.534  -5.986
  687   HG11  VAL  88          1HG1      VAL  88  -0.825   9.098  -7.267
  688   HG12  VAL  88          2HG1      VAL  88  -1.189   7.373  -7.259
  689   HG13  VAL  88          3HG1      VAL  88  -0.835   8.207  -5.746
  690   HG21  VAL  88          3HG2      VAL  88  -2.933   9.607  -8.436
  691   HG22  VAL  88          1HG2      VAL  88  -4.476   9.074  -7.767
  692   HG23  VAL  88          2HG2      VAL  88  -3.369   7.899  -8.476
  693    H    GLY  89           H        GLY  89  -5.287   6.164  -4.523
  694    HA2  GLY  89           1HA      GLY  89  -6.880   8.162  -3.445
  695    HA3  GLY  89           2HA      GLY  89  -7.497   7.861  -5.062
  696    H    ALA  90           H        ALA  90  -7.961   7.131  -1.948
  697    HA   ALA  90           HA       ALA  90  -8.389   4.403  -1.769
  698    HB1  ALA  90           1HB      ALA  90  -9.700   4.882   0.142
  699    HB2  ALA  90           2HB      ALA  90 -10.082   6.500  -0.459
  700    HB3  ALA  90           3HB      ALA  90  -8.440   6.122   0.052
  701    H    ASN  91           H        ASN  91  -9.475   3.322  -3.325
  702    HA   ASN  91           HA       ASN  91 -12.262   4.146  -3.787
  703    HB2  ASN  91           1HB      ASN  91 -10.237   3.706  -5.664
  704    HB3  ASN  91           2HB      ASN  91 -11.239   2.257  -5.731
  705   HD21  ASN  91          1HD2      ASN  91 -13.636   3.766  -4.894
  706   HD22  ASN  91          2HD2      ASN  91 -14.142   4.628  -6.301
  707    HA   PRO  92           HA       PRO  92 -12.540   0.653  -0.800
  708    HB2  PRO  92           1HB      PRO  92 -15.336   1.214  -1.717
  709    HB3  PRO  92           2HB      PRO  92 -14.752   0.791  -0.101
  710    HG2  PRO  92           1HG      PRO  92 -15.258   3.329  -0.768
  711    HG3  PRO  92           2HG      PRO  92 -13.906   2.901   0.294
  712    HD2  PRO  92           1HD      PRO  92 -13.864   3.906  -2.467
  713    HD3  PRO  92           2HD      PRO  92 -12.574   3.898  -1.256
  714    H    ALA  93           H        ALA  93 -14.738   0.586  -3.617
  715    HA   ALA  93           HA       ALA  93 -14.666  -2.298  -3.555
  716    HB1  ALA  93           1HB      ALA  93 -16.372  -2.201  -5.271
  717    HB2  ALA  93           2HB      ALA  93 -16.110  -0.467  -5.459
  718    HB3  ALA  93           3HB      ALA  93 -16.769  -1.100  -3.951
  719    H    ALA  94           H        ALA  94 -13.775   0.220  -5.888
  720    HA   ALA  94           HA       ALA  94 -13.010  -1.516  -7.944
  721    HB1  ALA  94           1HB      ALA  94 -11.871   0.404  -8.920
  722    HB2  ALA  94           2HB      ALA  94 -12.012   1.273  -7.393
  723    HB3  ALA  94           3HB      ALA  94 -13.461   0.850  -8.304
  724    H    ILE  95           H        ILE  95 -11.234  -0.409  -5.121
  725    HA   ILE  95           HA       ILE  95  -8.727  -1.310  -6.276
  726    HB   ILE  95           HB       ILE  95  -9.218  -0.300  -3.477
  727   HG12  ILE  95          1HG1      ILE  95  -9.687   1.500  -4.952
  728   HG13  ILE  95          2HG1      ILE  95  -8.038   1.754  -4.399
  729   HG21  ILE  95          1HG2      ILE  95  -6.815  -0.039  -3.360
  730   HG22  ILE  95          2HG2      ILE  95  -6.641  -0.662  -4.998
  731   HG23  ILE  95          3HG2      ILE  95  -7.222  -1.716  -3.709
  732   HD11  ILE  95          3HD1      ILE  95  -8.886   0.626  -7.057
  733   HD12  ILE  95          1HD1      ILE  95  -7.219   0.770  -6.503
  734   HD13  ILE  95          2HD1      ILE  95  -8.192   2.218  -6.751
  735    H    LYS  96           H        LYS  96 -11.003  -2.379  -3.774
  736    HA   LYS  96           HA       LYS  96  -9.642  -4.707  -3.018
  737    HB2  LYS  96           1HB      LYS  96 -11.495  -4.300  -1.699
  738    HB3  LYS  96           2HB      LYS  96 -12.517  -3.869  -3.065
  739    HG2  LYS  96           1HG      LYS  96 -11.621  -6.688  -2.720
  740    HG3  LYS  96           2HG      LYS  96 -12.917  -6.063  -1.709
  741    HD2  LYS  96           1HD      LYS  96 -14.141  -5.420  -3.765
  742    HD3  LYS  96           2HD      LYS  96 -12.858  -6.156  -4.726
  743    HE2  LYS  96           1HE      LYS  96 -13.308  -8.309  -3.569
  744    HE3  LYS  96           2HE      LYS  96 -14.676  -7.545  -2.763
  745    HZ1  LYS  96           3HZ      LYS  96 -15.651  -7.117  -4.944
  746    HZ2  LYS  96           1HZ      LYS  96 -15.400  -8.771  -4.695
  747    HZ3  LYS  96           2HZ      LYS  96 -14.352  -7.897  -5.693
  748    H    GLN  97           H        GLN  97 -11.714  -3.974  -5.741
  749    HA   GLN  97           HA       GLN  97 -11.604  -6.550  -6.926
  750    HB2  GLN  97           1HB      GLN  97 -13.355  -4.880  -7.445
  751    HB3  GLN  97           2HB      GLN  97 -12.144  -3.844  -8.185
  752    HG2  GLN  97           1HG      GLN  97 -13.322  -4.974  -9.915
  753    HG3  GLN  97           2HG      GLN  97 -11.695  -5.649  -9.831
  754   HE21  GLN  97          1HE2      GLN  97 -12.199  -7.588 -10.728
  755   HE22  GLN  97          2HE2      GLN  97 -13.174  -8.775  -9.938
  756    H    ALA  98           H        ALA  98  -9.406  -3.885  -6.788
  757    HA   ALA  98           HA       ALA  98  -7.975  -4.601  -9.181
  758    HB1  ALA  98           1HB      ALA  98  -8.001  -2.283  -8.400
  759    HB2  ALA  98           2HB      ALA  98  -6.363  -2.923  -8.499
  760    HB3  ALA  98           3HB      ALA  98  -7.156  -2.775  -6.931
  761    H    ILE  99           H        ILE  99  -7.222  -4.606  -5.747
  762    HA   ILE  99           HA       ILE  99  -4.897  -6.067  -5.778
  763    HB   ILE  99           HB       ILE  99  -7.049  -6.153  -3.644
  764   HG12  ILE  99          1HG1      ILE  99  -4.617  -4.451  -3.511
  765   HG13  ILE  99          2HG1      ILE  99  -5.877  -3.967  -4.655
  766   HG21  ILE  99          1HG2      ILE  99  -4.096  -6.781  -3.582
  767   HG22  ILE  99          2HG2      ILE  99  -5.413  -7.936  -3.389
  768   HG23  ILE  99          3HG2      ILE  99  -5.150  -6.688  -2.171
  769   HD11  ILE  99          3HD1      ILE  99  -7.486  -3.853  -2.940
  770   HD12  ILE  99          1HD1      ILE  99  -6.075  -2.912  -2.454
  771   HD13  ILE  99          2HD1      ILE  99  -6.351  -4.508  -1.753
  772    H    ALA 100           H        ALA 100  -8.253  -7.272  -5.732
  773    HA   ALA 100           HA       ALA 100  -7.582 -10.017  -5.551
  774    HB1  ALA 100           1HB      ALA 100  -9.872 -10.433  -6.262
  775    HB2  ALA 100           2HB      ALA 100 -10.037  -8.749  -6.756
  776    HB3  ALA 100           3HB      ALA 100  -9.818  -9.151  -5.052
  777    H    ALA 101           H        ALA 101  -7.892  -7.801  -8.252
  778    HA   ALA 101           HA       ALA 101  -7.808  -9.768 -10.312
  779    HB1  ALA 101           1HB      ALA 101  -7.073  -6.845 -10.480
  780    HB2  ALA 101           2HB      ALA 101  -8.716  -7.482 -10.608
  781    HB3  ALA 101           3HB      ALA 101  -7.509  -7.910 -11.819
  782    H    ASN 102           H        ASN 102  -5.383  -7.892  -8.609
  783    HA   ASN 102           HA       ASN 102  -3.277  -8.638 -10.449
  784    HB2  ASN 102           1HB      ASN 102  -3.198  -7.052  -7.888
  785    HB3  ASN 102           2HB      ASN 102  -1.818  -7.297  -8.945
  786   HD21  ASN 102          1HD2      ASN 102  -4.677  -5.552  -8.365
  787   HD22  ASN 102          2HD2      ASN 102  -4.640  -4.533  -9.757
  788    H    ALA 103           H        ALA 103  -4.615  -9.836  -7.541
  789    HA   ALA 103           HA       ALA 103  -2.285 -11.270  -6.677
  790    HB1  ALA 103           1HB      ALA 103  -4.024 -10.582  -5.090
  791    HB2  ALA 103           2HB      ALA 103  -3.776 -12.328  -5.067
  792    HB3  ALA 103           3HB      ALA 103  -5.175 -11.647  -5.896
  Start of MODEL   15
    1    H1   MET   1           1H       MET   1  -6.714  -6.585  11.272
    2    H2   MET   1           2H       MET   1  -5.454  -7.397  10.489
    3    H3   MET   1           3H       MET   1  -6.530  -6.451   9.598
    4    HA   MET   1           HA       MET   1  -5.752  -4.457  10.657
    5    HB2  MET   1           1HB      MET   1  -3.999  -4.432  12.230
    6    HB3  MET   1           2HB      MET   1  -5.135  -5.636  12.799
    7    HG2  MET   1           1HG      MET   1  -3.728  -7.404  12.261
    8    HG3  MET   1           2HG      MET   1  -2.759  -6.420  11.160
    9    HE1  MET   1           3HE      MET   1  -1.111  -4.494  11.976
   10    HE2  MET   1           1HE      MET   1  -0.892  -4.055  13.669
   11    HE3  MET   1           2HE      MET   1  -2.442  -3.770  12.876
   12    H    VAL   2           H        VAL   2  -3.884  -3.307   9.863
   13    HA   VAL   2           HA       VAL   2  -2.403  -4.819   7.823
   14    HB   VAL   2           HB       VAL   2  -3.331  -1.943   7.781
   15   HG11  VAL   2          1HG1      VAL   2  -2.354  -1.915   5.491
   16   HG12  VAL   2          2HG1      VAL   2  -1.585  -3.460   5.854
   17   HG13  VAL   2          3HG1      VAL   2  -1.157  -2.026   6.782
   18   HG21  VAL   2          3HG2      VAL   2  -5.109  -3.445   7.264
   19   HG22  VAL   2          1HG2      VAL   2  -4.082  -4.366   6.170
   20   HG23  VAL   2          2HG2      VAL   2  -4.552  -2.722   5.757
   21    H    THR   3           H        THR   3  -0.231  -4.735   7.895
   22    HA   THR   3           HA       THR   3   0.851  -3.970  10.445
   23    HB   THR   3           HB       THR   3   2.262  -5.217   8.085
   24    HG1  THR   3           1HG      THR   3   0.645  -6.282  10.154
   25   HG21  THR   3          3HG2      THR   3   3.792  -4.346   9.788
   26   HG22  THR   3          1HG2      THR   3   3.790  -6.109   9.791
   27   HG23  THR   3          2HG2      THR   3   2.911  -5.225  11.037
   28    H    GLN   4           H        GLN   4   2.304  -2.500  10.969
   29    HA   GLN   4           HA       GLN   4   2.730  -0.235   9.232
   30    HB2  GLN   4           1HB      GLN   4   3.257  -0.910  12.084
   31    HB3  GLN   4           2HB      GLN   4   4.042   0.490  11.387
   32    HG2  GLN   4           1HG      GLN   4   1.074   0.017  11.459
   33    HG3  GLN   4           2HG      GLN   4   1.969   0.995  12.624
   34   HE21  GLN   4          1HE2      GLN   4   0.936   0.700   9.349
   35   HE22  GLN   4          2HE2      GLN   4   1.205   2.334   8.908
   36    H    PHE   5           H        PHE   5   4.458   0.033   7.963
   37    HA   PHE   5           HA       PHE   5   6.914  -1.495   8.237
   38    HB2  PHE   5           1HB      PHE   5   6.025   0.768   6.466
   39    HB3  PHE   5           2HB      PHE   5   7.698   0.237   6.498
   40    HD1  PHE   5           1HD      PHE   5   6.852  -2.782   6.869
   41    HD2  PHE   5           2HD      PHE   5   5.770   0.304   4.145
   42    HE1  PHE   5           1HE      PHE   5   6.376  -4.468   5.151
   43    HE2  PHE   5           2HE      PHE   5   5.286  -1.383   2.426
   44    HZ   PHE   5           HZ       PHE   5   5.593  -3.770   2.926
   45    H    LYS   6           H        LYS   6   9.003  -0.275   8.213
   46    HA   LYS   6           HA       LYS   6   8.930   2.028  10.026
   47    HB2  LYS   6           1HB      LYS   6  11.056  -0.109  10.142
   48    HB3  LYS   6           2HB      LYS   6  10.759   1.177  11.302
   49    HG2  LYS   6           1HG      LYS   6   8.885  -1.107  10.758
   50    HG3  LYS   6           2HG      LYS   6  10.045  -1.050  12.086
   51    HD2  LYS   6           1HD      LYS   6   8.927   0.873  13.033
   52    HD3  LYS   6           2HD      LYS   6   7.836   0.962  11.648
   53    HE2  LYS   6           1HE      LYS   6   6.908  -1.213  12.227
   54    HE3  LYS   6           2HE      LYS   6   8.020  -1.339  13.588
   55    HZ1  LYS   6           3HZ      LYS   6   5.800  -0.624  14.263
   56    HZ2  LYS   6           1HZ      LYS   6   5.931   0.746  13.282
   57    HZ3  LYS   6           2HZ      LYS   6   6.961   0.555  14.607
   58    H    THR   7           H        THR   7  10.648   0.240   7.550
   59    HA   THR   7           HA       THR   7  12.014   2.719   6.751
   60    HB   THR   7           HB       THR   7  14.013   1.298   6.154
   61    HG1  THR   7           1HG      THR   7  13.478  -0.624   8.005
   62   HG21  THR   7          3HG2      THR   7  14.015   2.722   8.148
   63   HG22  THR   7          1HG2      THR   7  14.912   1.230   8.429
   64   HG23  THR   7          2HG2      THR   7  13.285   1.418   9.083
   65    H    ALA   8           H        ALA   8  13.146   2.279   4.499
   66    HA   ALA   8           HA       ALA   8  11.180   1.377   2.641
   67    HB1  ALA   8           1HB      ALA   8  14.079   2.107   2.276
   68    HB2  ALA   8           2HB      ALA   8  12.664   3.097   1.911
   69    HB3  ALA   8           3HB      ALA   8  13.004   1.659   0.957
   70    H    SER   9           H        SER   9  13.956   0.001   4.220
   71    HA   SER   9           HA       SER   9  14.263  -2.367   2.796
   72    HB2  SER   9           1HB      SER   9  15.738  -1.591   4.668
   73    HB3  SER   9           2HB      SER   9  14.465  -2.036   5.803
   74    HG   SER   9           HG       SER   9  15.424  -3.904   5.774
   75    H    GLU  10           H        GLU  10  12.073  -1.587   5.500
   76    HA   GLU  10           HA       GLU  10  10.653  -3.942   5.667
   77    HB2  GLU  10           1HB      GLU  10  10.042  -1.086   6.168
   78    HB3  GLU  10           2HB      GLU  10   8.688  -2.206   6.107
   79    HG2  GLU  10           1HG      GLU  10  11.086  -2.677   7.803
   80    HG3  GLU  10           2HG      GLU  10   9.705  -1.763   8.364
   81    H    PHE  11           H        PHE  11  10.043  -1.159   3.542
   82    HA   PHE  11           HA       PHE  11   7.702  -2.126   2.346
   83    HB2  PHE  11           1HB      PHE  11   8.616   0.237   2.244
   84    HB3  PHE  11           2HB      PHE  11   9.760  -0.327   1.030
   85    HD1  PHE  11           1HD      PHE  11   8.703  -1.451  -1.077
   86    HD2  PHE  11           2HD      PHE  11   6.579   1.102   1.585
   87    HE1  PHE  11           1HE      PHE  11   7.060  -0.968  -2.847
   88    HE2  PHE  11           2HE      PHE  11   4.933   1.586  -0.198
   89    HZ   PHE  11           HZ       PHE  11   5.178   0.542  -2.399
   90    H    ASP  12           H        ASP  12  11.000  -2.137   1.093
   91    HA   ASP  12           HA       ASP  12  10.406  -3.542  -1.274
   92    HB2  ASP  12           1HB      ASP  12  12.407  -2.111  -0.891
   93    HB3  ASP  12           2HB      ASP  12  13.065  -3.365   0.151
   94    H    SER  13           H        SER  13  11.397  -4.663   1.926
   95    HA   SER  13           HA       SER  13  11.992  -7.321   1.220
   96    HB2  SER  13           1HB      SER  13  12.599  -6.330   3.401
   97    HB3  SER  13           2HB      SER  13  10.896  -6.279   3.845
   98    HG   SER  13           HG       SER  13  12.572  -8.526   3.481
   99    H    ALA  14           H        ALA  14   8.952  -5.788   2.245
  100    HA   ALA  14           HA       ALA  14   7.404  -8.130   2.131
  101    HB1  ALA  14           1HB      ALA  14   6.468  -5.286   1.716
  102    HB2  ALA  14           2HB      ALA  14   6.655  -6.076   3.281
  103    HB3  ALA  14           3HB      ALA  14   5.456  -6.677   2.132
  104    H    ILE  15           H        ILE  15   8.268  -5.688  -0.227
  105    HA   ILE  15           HA       ILE  15   6.567  -6.372  -2.319
  106    HB   ILE  15           HB       ILE  15   9.380  -5.350  -2.533
  107   HG12  ILE  15          1HG1      ILE  15   8.299  -3.750  -1.227
  108   HG13  ILE  15          2HG1      ILE  15   8.121  -3.153  -2.872
  109   HG21  ILE  15          1HG2      ILE  15   7.199  -4.851  -4.498
  110   HG22  ILE  15          2HG2      ILE  15   8.217  -6.284  -4.601
  111   HG23  ILE  15          3HG2      ILE  15   8.943  -4.677  -4.699
  112   HD11  ILE  15          3HD1      ILE  15   5.847  -3.976  -2.950
  113   HD12  ILE  15          1HD1      ILE  15   6.071  -2.906  -1.568
  114   HD13  ILE  15          2HD1      ILE  15   6.016  -4.651  -1.330
  115    H    ALA  16           H        ALA  16   9.630  -7.772  -1.347
  116    HA   ALA  16           HA       ALA  16  10.136  -9.080  -3.819
  117    HB1  ALA  16           1HB      ALA  16  11.927  -8.362  -2.338
  118    HB2  ALA  16           2HB      ALA  16  12.025 -10.093  -2.664
  119    HB3  ALA  16           3HB      ALA  16  11.393  -9.519  -1.120
  120    H    GLN  17           H        GLN  17   7.763  -9.804  -1.774
  121    HA   GLN  17           HA       GLN  17   8.104 -12.635  -1.524
  122    HB2  GLN  17           1HB      GLN  17   5.949 -12.574  -0.503
  123    HB3  GLN  17           2HB      GLN  17   6.843 -11.189   0.079
  124    HG2  GLN  17           1HG      GLN  17   5.658  -9.778  -1.545
  125    HG3  GLN  17           2HG      GLN  17   4.724 -11.181  -2.055
  126   HE21  GLN  17          1HE2      GLN  17   5.655 -10.372   1.252
  127   HE22  GLN  17          2HE2      GLN  17   4.041 -10.150   1.834
  128    H    ASP  18           H        ASP  18   6.850 -14.233  -2.621
  129    HA   ASP  18           HA       ASP  18   6.262 -13.518  -5.374
  130    HB2  ASP  18           1HB      ASP  18   6.436 -16.143  -3.910
  131    HB3  ASP  18           2HB      ASP  18   5.790 -16.046  -5.544
  132    H    LYS  19           H        LYS  19   4.495 -12.274  -3.772
  133    HA   LYS  19           HA       LYS  19   1.978 -13.335  -4.656
  134    HB2  LYS  19           1HB      LYS  19   1.020 -13.110  -2.261
  135    HB3  LYS  19           2HB      LYS  19   1.892 -14.578  -2.678
  136    HG2  LYS  19           1HG      LYS  19   3.821 -13.866  -1.497
  137    HG3  LYS  19           2HG      LYS  19   3.166 -12.243  -1.283
  138    HD2  LYS  19           1HD      LYS  19   1.428 -13.102   0.166
  139    HD3  LYS  19           2HD      LYS  19   1.985 -14.755  -0.105
  140    HE2  LYS  19           1HE      LYS  19   4.030 -14.340   1.032
  141    HE3  LYS  19           2HE      LYS  19   3.735 -12.603   1.064
  142    HZ1  LYS  19           3HZ      LYS  19   2.062 -14.598   2.484
  143    HZ2  LYS  19           1HZ      LYS  19   1.961 -12.909   2.605
  144    HZ3  LYS  19           2HZ      LYS  19   3.320 -13.728   3.206
  145    H    LEU  20           H        LEU  20   0.201 -11.750  -3.483
  146    HA   LEU  20           HA       LEU  20   0.940  -9.222  -4.637
  147    HB2  LEU  20           1HB      LEU  20  -1.309 -10.437  -4.839
  148    HB3  LEU  20           2HB      LEU  20  -1.647  -9.836  -3.233
  149    HG   LEU  20           HG       LEU  20  -2.653  -8.496  -5.098
  150   HD11  LEU  20          1HD1      LEU  20  -2.109  -6.326  -4.172
  151   HD12  LEU  20          2HD1      LEU  20  -0.682  -6.998  -3.383
  152   HD13  LEU  20          3HD1      LEU  20  -2.292  -7.516  -2.883
  153   HD21  LEU  20          3HD2      LEU  20   0.206  -7.710  -5.618
  154   HD22  LEU  20          1HD2      LEU  20  -1.225  -7.019  -6.381
  155   HD23  LEU  20          2HD2      LEU  20  -0.796  -8.706  -6.673
  156    H    VAL  21           H        VAL  21   1.902  -7.678  -3.579
  157    HA   VAL  21           HA       VAL  21   1.369  -7.321  -0.699
  158    HB   VAL  21           HB       VAL  21   3.557  -5.718  -1.642
  159   HG11  VAL  21          1HG1      VAL  21   4.757  -6.854   0.157
  160   HG12  VAL  21          2HG1      VAL  21   3.430  -8.009   0.307
  161   HG13  VAL  21          3HG1      VAL  21   3.162  -6.304   0.672
  162   HG21  VAL  21          3HG2      VAL  21   3.978  -7.290  -3.374
  163   HG22  VAL  21          1HG2      VAL  21   3.747  -8.654  -2.276
  164   HG23  VAL  21          2HG2      VAL  21   5.149  -7.606  -2.092
  165    H    VAL  22           H        VAL  22  -0.198  -5.779  -0.497
  166    HA   VAL  22           HA       VAL  22   0.044  -3.438  -2.222
  167    HB   VAL  22           HB       VAL  22  -2.070  -4.095  -2.625
  168   HG11  VAL  22          1HG1      VAL  22  -2.274  -5.135   0.166
  169   HG12  VAL  22          2HG1      VAL  22  -2.135  -6.055  -1.336
  170   HG13  VAL  22          3HG1      VAL  22  -3.596  -5.132  -1.003
  171   HG21  VAL  22          3HG2      VAL  22  -2.235  -1.841  -1.726
  172   HG22  VAL  22          1HG2      VAL  22  -2.473  -2.497  -0.106
  173   HG23  VAL  22          2HG2      VAL  22  -3.691  -2.765  -1.354
  174    H    VAL  23           H        VAL  23   0.863  -1.735  -1.392
  175    HA   VAL  23           HA       VAL  23   1.080  -1.594   1.525
  176    HB   VAL  23           HB       VAL  23   2.754  -0.169  -0.542
  177   HG11  VAL  23          1HG1      VAL  23   2.610   1.058   1.552
  178   HG12  VAL  23          2HG1      VAL  23   4.215   0.349   1.371
  179   HG13  VAL  23          3HG1      VAL  23   3.038  -0.395   2.454
  180   HG21  VAL  23          3HG2      VAL  23   3.329  -2.608   1.133
  181   HG22  VAL  23          1HG2      VAL  23   4.521  -1.753   0.153
  182   HG23  VAL  23          2HG2      VAL  23   3.155  -2.556  -0.623
  183    H    ALA  24           H        ALA  24   0.159  -0.131   2.593
  184    HA   ALA  24           HA       ALA  24  -1.471   1.904   1.298
  185    HB1  ALA  24           1HB      ALA  24  -2.215   2.286   3.668
  186    HB2  ALA  24           2HB      ALA  24  -1.113   0.995   4.165
  187    HB3  ALA  24           3HB      ALA  24  -2.460   0.641   3.087
  188    H    PHE  25           H        PHE  25  -0.093   3.538   0.620
  189    HA   PHE  25           HA       PHE  25   1.817   4.592   2.574
  190    HB2  PHE  25           1HB      PHE  25   2.077   4.065  -0.130
  191    HB3  PHE  25           2HB      PHE  25   1.876   5.814  -0.071
  192    HD1  PHE  25           2HD      PHE  25   3.466   7.211   1.133
  193    HD2  PHE  25           1HD      PHE  25   4.003   3.013   0.761
  194    HE1  PHE  25           2HE      PHE  25   5.817   7.451   1.803
  195    HE2  PHE  25           1HE      PHE  25   6.354   3.248   1.430
  196    HZ   PHE  25           HZ       PHE  25   7.265   5.473   1.947
  197    H    TYR  26           H        TYR  26   1.158   6.232   3.767
  198    HA   TYR  26           HA       TYR  26  -0.497   8.302   2.535
  199    HB2  TYR  26           1HB      TYR  26  -1.947   8.320   4.584
  200    HB3  TYR  26           2HB      TYR  26  -2.150   6.915   3.550
  201    HD1  TYR  26           1HD      TYR  26  -0.449   8.059   6.668
  202    HD2  TYR  26           2HD      TYR  26  -1.954   4.772   4.433
  203    HE1  TYR  26           1HE      TYR  26  -0.055   6.576   8.592
  204    HE2  TYR  26           2HE      TYR  26  -1.569   3.284   6.337
  205    HH   TYR  26           HH       TYR  26  -0.810   4.469   9.471
  206    H    ALA  27           H        ALA  27  -0.890  10.051   4.388
  207    HA   ALA  27           HA       ALA  27   1.643  10.444   5.834
  208    HB1  ALA  27           1HB      ALA  27   1.601  11.845   3.804
  209    HB2  ALA  27           2HB      ALA  27   1.608  12.800   5.286
  210    HB3  ALA  27           3HB      ALA  27   0.111  12.594   4.378
  211    H    THR  28           H        THR  28   1.410  10.966   7.904
  212    HA   THR  28           HA       THR  28  -1.138  10.821   9.119
  213    HB   THR  28           HB       THR  28   0.163  11.654  11.181
  214    HG1  THR  28           1HG      THR  28   2.499  10.922   9.811
  215   HG21  THR  28          3HG2      THR  28   1.218   9.461  11.463
  216   HG22  THR  28          1HG2      THR  28   1.046   9.152   9.736
  217   HG23  THR  28          2HG2      THR  28  -0.386   9.305  10.752
  218    H    TRP  29           H        TRP  29   0.592  13.499   7.815
  219    HA   TRP  29           HA       TRP  29  -0.941  15.456   9.303
  220    HB2  TRP  29           1HB      TRP  29   0.239  17.133   7.929
  221    HB3  TRP  29           2HB      TRP  29   1.352  16.026   8.717
  222    HD1  TRP  29           HD       TRP  29   3.029  14.745   7.193
  223    HE1  TRP  29           1HE      TRP  29   3.474  14.670   4.659
  224    HE3  TRP  29           3HE      TRP  29  -1.103  17.275   5.567
  225    HZ2  TRP  29           2HZ      TRP  29   2.229  15.555   2.289
  226    HZ3  TRP  29           3HZ      TRP  29  -1.406  17.612   3.155
  227    HH2  TRP  29           HH       TRP  29   0.230  16.774   1.545
  228    H    CYS  30           H        CYS  30  -1.456  13.515   6.633
  229    HA   CYS  30           HA       CYS  30  -2.993  15.476   5.128
  230    HB2  CYS  30           1HB      CYS  30  -1.501  13.983   3.902
  231    HB3  CYS  30           2HB      CYS  30  -2.335  12.580   4.558
  232    HG   CYS  30           HG       CYS  30  -3.326  14.710   2.113
  233    H    GLY  31           H        GLY  31  -5.184  15.218   4.632
  234    HA2  GLY  31           1HA      GLY  31  -6.722  14.179   6.837
  235    HA3  GLY  31           2HA      GLY  31  -7.336  15.095   5.473
  236    HA   PRO  32           HA       PRO  32  -9.040  11.631   3.420
  237    HB2  PRO  32           1HB      PRO  32  -7.069  11.616   1.205
  238    HB3  PRO  32           2HB      PRO  32  -8.826  11.790   1.151
  239    HG2  PRO  32           1HG      PRO  32  -7.239  13.884   0.731
  240    HG3  PRO  32           2HG      PRO  32  -8.749  14.052   1.647
  241    HD2  PRO  32           1HD      PRO  32  -5.932  13.895   2.650
  242    HD3  PRO  32           2HD      PRO  32  -7.268  14.926   3.201
  243    H    CYS  33           H        CYS  33  -5.790  11.370   4.337
  244    HA   CYS  33           HA       CYS  33  -5.158   8.775   3.438
  245    HB2  CYS  33           1HB      CYS  33  -4.166  10.425   5.749
  246    HB3  CYS  33           2HB      CYS  33  -3.522   8.829   5.381
  247    HG   CYS  33           HG       CYS  33  -3.458  11.505   3.238
  248    H    LYS  34           H        LYS  34  -7.067   9.933   6.089
  249    HA   LYS  34           HA       LYS  34  -7.139   7.590   7.641
  250    HB2  LYS  34           1HB      LYS  34  -9.250   8.495   8.554
  251    HB3  LYS  34           2HB      LYS  34  -7.965   9.693   8.516
  252    HG2  LYS  34           1HG      LYS  34  -8.936  10.606   6.431
  253    HG3  LYS  34           2HG      LYS  34 -10.271   9.464   6.596
  254    HD2  LYS  34           1HD      LYS  34 -10.971  10.471   8.648
  255    HD3  LYS  34           2HD      LYS  34  -9.524  11.480   8.707
  256    HE2  LYS  34           1HE      LYS  34 -10.252  12.617   6.655
  257    HE3  LYS  34           2HE      LYS  34 -11.712  11.628   6.637
  258    HZ1  LYS  34           3HZ      LYS  34 -12.041  13.853   7.594
  259    HZ2  LYS  34           1HZ      LYS  34 -10.961  13.469   8.838
  260    HZ3  LYS  34           2HZ      LYS  34 -12.414  12.613   8.684
  261    H    MET  35           H        MET  35  -8.392   8.211   4.507
  262    HA   MET  35           HA       MET  35 -10.586   6.335   4.702
  263    HB2  MET  35           1HB      MET  35 -10.419   8.259   3.012
  264    HB3  MET  35           2HB      MET  35  -9.263   7.235   2.148
  265    HG2  MET  35           1HG      MET  35 -10.940   5.498   1.928
  266    HG3  MET  35           2HG      MET  35 -12.099   6.477   2.823
  267    HE1  MET  35           3HE      MET  35 -13.757   5.941   0.650
  268    HE2  MET  35           1HE      MET  35 -12.379   5.059  -0.012
  269    HE3  MET  35           2HE      MET  35 -13.219   6.253  -1.003
  270    H    ILE  36           H        ILE  36  -7.225   6.316   3.968
  271    HA   ILE  36           HA       ILE  36  -7.196   3.709   2.798
  272    HB   ILE  36           HB       ILE  36  -5.232   5.777   3.430
  273   HG12  ILE  36          1HG1      ILE  36  -4.341   5.079   1.276
  274   HG13  ILE  36          2HG1      ILE  36  -5.373   3.652   1.297
  275   HG21  ILE  36          1HG2      ILE  36  -3.332   4.073   3.200
  276   HG22  ILE  36          2HG2      ILE  36  -4.516   2.897   3.774
  277   HG23  ILE  36          3HG2      ILE  36  -4.088   4.277   4.780
  278   HD11  ILE  36          3HD1      ILE  36  -6.462   5.180  -0.099
  279   HD12  ILE  36          1HD1      ILE  36  -6.179   6.521   1.012
  280   HD13  ILE  36          2HD1      ILE  36  -7.330   5.260   1.441
  281    H    ALA  37           H        ALA  37  -7.052   5.062   5.968
  282    HA   ALA  37           HA       ALA  37  -6.150   2.891   7.411
  283    HB1  ALA  37           1HB      ALA  37  -8.318   4.842   8.157
  284    HB2  ALA  37           2HB      ALA  37  -6.600   4.970   8.513
  285    HB3  ALA  37           3HB      ALA  37  -7.568   3.705   9.273
  286    HA   PRO  38           HA       PRO  38 -10.261   0.693   7.673
  287    HB2  PRO  38           1HB      PRO  38 -12.602   1.617   6.811
  288    HB3  PRO  38           2HB      PRO  38 -11.868   2.246   8.291
  289    HG2  PRO  38           1HG      PRO  38 -11.898   3.425   5.543
  290    HG3  PRO  38           2HG      PRO  38 -12.155   4.223   7.106
  291    HD2  PRO  38           1HD      PRO  38  -9.767   4.226   5.736
  292    HD3  PRO  38           2HD      PRO  38  -9.926   4.457   7.484
  293    H    MET  39           H        MET  39 -10.135   2.308   4.482
  294    HA   MET  39           HA       MET  39 -11.628   0.286   3.134
  295    HB2  MET  39           1HB      MET  39 -11.505   2.464   2.122
  296    HB3  MET  39           2HB      MET  39  -9.757   2.467   2.201
  297    HG2  MET  39           1HG      MET  39 -11.174   0.451   0.518
  298    HG3  MET  39           2HG      MET  39 -10.954   2.101  -0.059
  299    HE1  MET  39           3HE      MET  39  -8.449   3.202   0.622
  300    HE2  MET  39           1HE      MET  39  -6.957   2.285   0.395
  301    HE3  MET  39           2HE      MET  39  -7.885   2.094   1.885
  302    H    ILE  40           H        ILE  40  -8.249   0.782   3.809
  303    HA   ILE  40           HA       ILE  40  -7.428  -1.427   2.172
  304    HB   ILE  40           HB       ILE  40  -6.139   0.698   3.712
  305   HG12  ILE  40          1HG1      ILE  40  -5.399  -0.786   1.195
  306   HG13  ILE  40          2HG1      ILE  40  -6.401   0.652   1.274
  307   HG21  ILE  40          1HG2      ILE  40  -4.784  -1.981   3.434
  308   HG22  ILE  40          2HG2      ILE  40  -5.119  -1.099   4.923
  309   HG23  ILE  40          3HG2      ILE  40  -3.938  -0.474   3.775
  310   HD11  ILE  40          3HD1      ILE  40  -4.447   1.638   0.776
  311   HD12  ILE  40          1HD1      ILE  40  -3.486   0.355   1.511
  312   HD13  ILE  40          2HD1      ILE  40  -4.246   1.575   2.527
  313    H    GLU  41           H        GLU  41  -7.964  -0.831   5.619
  314    HA   GLU  41           HA       GLU  41  -7.156  -3.426   6.426
  315    HB2  GLU  41           1HB      GLU  41  -9.072  -1.423   7.622
  316    HB3  GLU  41           2HB      GLU  41  -8.780  -2.991   8.365
  317    HG2  GLU  41           1HG      GLU  41  -6.446  -2.476   8.641
  318    HG3  GLU  41           2HG      GLU  41  -6.647  -0.955   7.773
  319    H    LYS  42           H        LYS  42  -9.928  -2.207   4.799
  320    HA   LYS  42           HA       LYS  42 -11.653  -4.388   5.426
  321    HB2  LYS  42           1HB      LYS  42 -12.478  -2.106   4.938
  322    HB3  LYS  42           2HB      LYS  42 -11.942  -2.278   3.273
  323    HG2  LYS  42           1HG      LYS  42 -14.339  -2.658   3.484
  324    HG3  LYS  42           2HG      LYS  42 -13.513  -4.128   2.961
  325    HD2  LYS  42           1HD      LYS  42 -13.587  -5.002   5.229
  326    HD3  LYS  42           2HD      LYS  42 -14.338  -3.510   5.798
  327    HE2  LYS  42           1HE      LYS  42 -16.306  -3.945   4.492
  328    HE3  LYS  42           2HE      LYS  42 -15.546  -5.344   3.738
  329    HZ1  LYS  42           3HZ      LYS  42 -17.072  -5.980   5.507
  330    HZ2  LYS  42           1HZ      LYS  42 -16.169  -5.091   6.628
  331    HZ3  LYS  42           2HZ      LYS  42 -15.490  -6.441   5.872
  332    H    PHE  43           H        PHE  43  -9.464  -3.616   2.728
  333    HA   PHE  43           HA       PHE  43 -10.470  -5.574   0.975
  334    HB2  PHE  43           1HB      PHE  43  -8.525  -5.363  -0.358
  335    HB3  PHE  43           2HB      PHE  43  -8.805  -3.773   0.335
  336    HD1  PHE  43           2HD      PHE  43  -6.817  -6.844   1.211
  337    HD2  PHE  43           1HD      PHE  43  -6.941  -2.613   0.863
  338    HE1  PHE  43           2HE      PHE  43  -4.457  -6.728   1.876
  339    HE2  PHE  43           1HE      PHE  43  -4.573  -2.492   1.515
  340    HZ   PHE  43           HZ       PHE  43  -3.331  -4.547   2.030
  341    H    SER  44           H        SER  44  -7.945  -5.876   3.528
  342    HA   SER  44           HA       SER  44  -7.669  -8.689   2.880
  343    HB2  SER  44           1HB      SER  44  -5.960  -8.742   4.584
  344    HB3  SER  44           2HB      SER  44  -5.692  -7.372   3.511
  345    HG   SER  44           HG       SER  44  -5.776  -6.148   5.204
  346    H    GLU  45           H        GLU  45  -9.554  -6.747   4.996
  347    HA   GLU  45           HA       GLU  45 -10.179  -8.638   6.968
  348    HB2  GLU  45           1HB      GLU  45 -10.878  -6.265   7.035
  349    HB3  GLU  45           2HB      GLU  45 -12.033  -6.587   5.750
  350    HG2  GLU  45           1HG      GLU  45 -13.118  -6.538   7.921
  351    HG3  GLU  45           2HG      GLU  45 -13.221  -8.142   7.195
  352    H    GLN  46           H        GLN  46 -11.162  -8.265   3.634
  353    HA   GLN  46           HA       GLN  46 -12.974 -10.497   3.801
  354    HB2  GLN  46           1HB      GLN  46 -13.836  -9.048   2.260
  355    HB3  GLN  46           2HB      GLN  46 -12.260  -8.407   1.824
  356    HG2  GLN  46           1HG      GLN  46 -13.126  -9.524  -0.063
  357    HG3  GLN  46           2HG      GLN  46 -11.816 -10.485   0.616
  358   HE21  GLN  46          1HE2      GLN  46 -12.560 -12.340  -0.407
  359   HE22  GLN  46          2HE2      GLN  46 -13.957 -13.194   0.150
  360    H    TYR  47           H        TYR  47  -9.883  -9.652   2.219
  361    HA   TYR  47           HA       TYR  47  -9.307 -12.520   2.103
  362    HB2  TYR  47           1HB      TYR  47  -7.933 -11.960   0.017
  363    HB3  TYR  47           2HB      TYR  47  -9.682 -12.029  -0.127
  364    HD1  TYR  47           1HD      TYR  47  -6.844  -9.629   0.229
  365    HD2  TYR  47           2HD      TYR  47 -10.873 -10.248  -0.982
  366    HE1  TYR  47           1HE      TYR  47  -6.885  -7.382  -0.799
  367    HE2  TYR  47           2HE      TYR  47 -10.928  -8.009  -1.977
  368    HH   TYR  47           HH       TYR  47  -8.233  -6.202  -2.594
  369    HA   PRO  48           HA       PRO  48  -5.720 -10.866   4.412
  370    HB2  PRO  48           1HB      PRO  48  -5.350 -13.102   5.871
  371    HB3  PRO  48           2HB      PRO  48  -6.486 -11.843   6.346
  372    HG2  PRO  48           1HG      PRO  48  -7.025 -14.437   4.948
  373    HG3  PRO  48           2HG      PRO  48  -7.913 -13.685   6.287
  374    HD2  PRO  48           1HD      PRO  48  -8.762 -13.528   3.725
  375    HD3  PRO  48           2HD      PRO  48  -9.029 -12.219   4.891
  376    H    GLN  49           H        GLN  49  -6.392 -13.076   2.072
  377    HA   GLN  49           HA       GLN  49  -4.082 -14.643   1.822
  378    HB2  GLN  49           1HB      GLN  49  -6.007 -15.205   0.534
  379    HB3  GLN  49           2HB      GLN  49  -6.092 -13.597  -0.167
  380    HG2  GLN  49           1HG      GLN  49  -3.694 -14.290  -1.068
  381    HG3  GLN  49           2HG      GLN  49  -4.389 -15.900  -0.894
  382   HE21  GLN  49          1HE2      GLN  49  -4.645 -12.819  -2.493
  383   HE22  GLN  49          2HE2      GLN  49  -5.676 -13.351  -3.780
  384    H    ALA  50           H        ALA  50  -4.666 -11.302   1.180
  385    HA   ALA  50           HA       ALA  50  -2.160 -11.094  -0.345
  386    HB1  ALA  50           1HB      ALA  50  -4.360  -9.084   0.113
  387    HB2  ALA  50           2HB      ALA  50  -4.055  -9.991  -1.372
  388    HB3  ALA  50           3HB      ALA  50  -2.891  -8.782  -0.814
  389    H    ASP  51           H        ASP  51  -0.623  -9.410   0.315
  390    HA   ASP  51           HA       ASP  51  -0.488  -9.463   3.210
  391    HB2  ASP  51           1HB      ASP  51   1.556  -9.055   1.072
  392    HB3  ASP  51           2HB      ASP  51   1.878  -8.459   2.693
  393    H    PHE  52           H        PHE  52  -0.699  -7.857   4.477
  394    HA   PHE  52           HA       PHE  52  -1.553  -5.321   3.289
  395    HB2  PHE  52           1HB      PHE  52  -2.479  -5.192   5.796
  396    HB3  PHE  52           2HB      PHE  52  -3.369  -5.993   4.512
  397    HD1  PHE  52           2HD      PHE  52  -1.149  -6.544   7.415
  398    HD2  PHE  52           1HD      PHE  52  -3.762  -8.327   4.568
  399    HE1  PHE  52           2HE      PHE  52  -1.135  -8.632   8.714
  400    HE2  PHE  52           1HE      PHE  52  -3.752 -10.417   5.864
  401    HZ   PHE  52           HZ       PHE  52  -2.435 -10.572   7.936
  402    H    TYR  53           H        TYR  53  -0.019  -3.779   3.362
  403    HA   TYR  53           HA       TYR  53   1.245  -3.365   5.983
  404    HB2  TYR  53           1HB      TYR  53   2.709  -3.290   3.332
  405    HB3  TYR  53           2HB      TYR  53   3.378  -2.774   4.877
  406    HD1  TYR  53           1HD      TYR  53   3.628  -4.506   6.716
  407    HD2  TYR  53           2HD      TYR  53   2.756  -5.545   2.684
  408    HE1  TYR  53           1HE      TYR  53   4.378  -6.807   7.152
  409    HE2  TYR  53           2HE      TYR  53   3.511  -7.849   3.107
  410    HH   TYR  53           HH       TYR  53   4.927  -9.075   4.649
  411    H    LYS  54           H        LYS  54   1.790  -1.282   6.522
  412    HA   LYS  54           HA       LYS  54   0.645   0.892   4.884
  413    HB2  LYS  54           1HB      LYS  54   0.018   0.042   7.657
  414    HB3  LYS  54           2HB      LYS  54   0.079   1.766   7.362
  415    HG2  LYS  54           1HG      LYS  54  -1.702   1.560   5.746
  416    HG3  LYS  54           2HG      LYS  54  -1.695  -0.192   5.925
  417    HD2  LYS  54           1HD      LYS  54  -2.337   0.049   8.275
  418    HD3  LYS  54           2HD      LYS  54  -2.328   1.803   8.097
  419    HE2  LYS  54           1HE      LYS  54  -4.127   1.658   6.457
  420    HE3  LYS  54           2HE      LYS  54  -4.116  -0.099   6.586
  421    HZ1  LYS  54           3HZ      LYS  54  -4.757   1.784   8.789
  422    HZ2  LYS  54           1HZ      LYS  54  -4.766   0.099   8.901
  423    HZ3  LYS  54           2HZ      LYS  54  -5.888   0.884   7.912
  424    H    LEU  55           H        LEU  55   1.670   2.960   5.210
  425    HA   LEU  55           HA       LEU  55   3.635   3.263   7.287
  426    HB2  LEU  55           1HB      LEU  55   4.980   2.077   5.676
  427    HB3  LEU  55           2HB      LEU  55   4.469   3.145   4.390
  428    HG   LEU  55           HG       LEU  55   5.939   4.341   6.705
  429   HD11  LEU  55          1HD1      LEU  55   8.070   3.859   5.557
  430   HD12  LEU  55          2HD1      LEU  55   7.210   2.785   4.451
  431   HD13  LEU  55          3HD1      LEU  55   7.292   2.400   6.170
  432   HD21  LEU  55          3HD2      LEU  55   4.881   5.562   4.737
  433   HD22  LEU  55          1HD2      LEU  55   6.181   4.876   3.767
  434   HD23  LEU  55          2HD2      LEU  55   6.560   5.941   5.120
  435    H    ASP  56           H        ASP  56   4.241   5.407   7.625
  436    HA   ASP  56           HA       ASP  56   2.579   7.402   6.258
  437    HB2  ASP  56           1HB      ASP  56   2.275   7.441   8.625
  438    HB3  ASP  56           2HB      ASP  56   4.008   7.401   8.915
  439    H    VAL  57           H        VAL  57   3.470   8.657   4.769
  440    HA   VAL  57           HA       VAL  57   6.246   8.561   4.159
  441    HB   VAL  57           HB       VAL  57   4.616   8.827   2.404
  442   HG11  VAL  57          1HG1      VAL  57   4.026  11.471   3.675
  443   HG12  VAL  57          2HG1      VAL  57   2.985  10.052   3.694
  444   HG13  VAL  57          3HG1      VAL  57   3.338  10.865   2.169
  445   HG21  VAL  57          3HG2      VAL  57   6.270  11.338   2.640
  446   HG22  VAL  57          1HG2      VAL  57   5.625  10.637   1.156
  447   HG23  VAL  57          2HG2      VAL  57   6.873   9.785   2.067
  448    H    ASP  58           H        ASP  58   4.333  10.584   6.200
  449    HA   ASP  58           HA       ASP  58   5.916  12.918   6.162
  450    HB2  ASP  58           1HB      ASP  58   3.692  12.868   7.194
  451    HB3  ASP  58           2HB      ASP  58   4.290  11.781   8.442
  452    H    GLU  59           H        GLU  59   6.116   9.922   7.987
  453    HA   GLU  59           HA       GLU  59   8.544  10.765   9.318
  454    HB2  GLU  59           1HB      GLU  59   7.069   8.137   9.265
  455    HB3  GLU  59           2HB      GLU  59   8.582   8.374  10.125
  456    HG2  GLU  59           1HG      GLU  59   7.473  10.191  11.420
  457    HG3  GLU  59           2HG      GLU  59   5.956   9.734  10.646
  458    H    LEU  60           H        LEU  60   7.657   8.525   6.682
  459    HA   LEU  60           HA       LEU  60  10.544   8.227   6.150
  460    HB2  LEU  60           1HB      LEU  60   8.276   6.331   5.607
  461    HB3  LEU  60           2HB      LEU  60   9.880   6.119   4.956
  462    HG   LEU  60           HG       LEU  60   9.814   4.688   6.788
  463   HD11  LEU  60          1HD1      LEU  60  11.031   7.226   7.855
  464   HD12  LEU  60          2HD1      LEU  60  11.821   6.076   6.777
  465   HD13  LEU  60          3HD1      LEU  60  11.369   5.586   8.409
  466   HD21  LEU  60          3HD2      LEU  60   8.957   5.260   8.985
  467   HD22  LEU  60          1HD2      LEU  60   7.720   5.494   7.751
  468   HD23  LEU  60          2HD2      LEU  60   8.567   6.886   8.426
  469    H    GLY  61           H        GLY  61  10.519  10.169   4.892
  470    HA2  GLY  61           1HA      GLY  61   8.871  10.394   2.553
  471    HA3  GLY  61           2HA      GLY  61  10.220  11.434   2.983
  472    H    ASP  62           H        ASP  62  12.234   9.470   3.156
  473    HA   ASP  62           HA       ASP  62  12.970   9.248   0.423
  474    HB2  ASP  62           1HB      ASP  62  14.159   7.963   2.879
  475    HB3  ASP  62           2HB      ASP  62  14.898   7.918   1.284
  476    H    VAL  63           H        VAL  63  11.328   7.176   2.604
  477    HA   VAL  63           HA       VAL  63  11.581   4.774   1.117
  478    HB   VAL  63           HB       VAL  63   9.399   5.662   2.992
  479   HG11  VAL  63          1HG1      VAL  63  10.020   2.928   1.876
  480   HG12  VAL  63          2HG1      VAL  63   8.579   3.892   1.563
  481   HG13  VAL  63          3HG1      VAL  63   8.873   3.247   3.176
  482   HG21  VAL  63          3HG2      VAL  63  11.624   5.539   4.022
  483   HG22  VAL  63          1HG2      VAL  63  11.782   3.874   3.462
  484   HG23  VAL  63          2HG2      VAL  63  10.548   4.287   4.648
  485    H    ALA  64           H        ALA  64   8.964   7.206   1.326
  486    HA   ALA  64           HA       ALA  64   7.299   6.397  -0.668
  487    HB1  ALA  64           1HB      ALA  64   6.988   8.400   0.727
  488    HB2  ALA  64           2HB      ALA  64   6.703   8.714  -0.983
  489    HB3  ALA  64           3HB      ALA  64   8.210   9.233  -0.229
  490    H    GLN  65           H        GLN  65  10.358   8.102  -1.037
  491    HA   GLN  65           HA       GLN  65  10.075   8.482  -3.867
  492    HB2  GLN  65           1HB      GLN  65  12.541   8.687  -2.131
  493    HB3  GLN  65           2HB      GLN  65  12.390   9.293  -3.775
  494    HG2  GLN  65           1HG      GLN  65  10.669  10.856  -3.054
  495    HG3  GLN  65           2HG      GLN  65  10.784  10.236  -1.409
  496   HE21  GLN  65          1HE2      GLN  65  13.703   9.965  -1.588
  497   HE22  GLN  65          2HE2      GLN  65  14.328  11.568  -1.448
  498    H    LYS  66           H        LYS  66  11.383   6.005  -1.829
  499    HA   LYS  66           HA       LYS  66  12.862   4.622  -3.774
  500    HB2  LYS  66           1HB      LYS  66  13.485   3.812  -1.759
  501    HB3  LYS  66           2HB      LYS  66  11.958   4.256  -1.011
  502    HG2  LYS  66           1HG      LYS  66  12.100   1.950  -0.786
  503    HG3  LYS  66           2HG      LYS  66  10.983   2.223  -2.118
  504    HD2  LYS  66           1HD      LYS  66  12.778   1.772  -3.723
  505    HD3  LYS  66           2HD      LYS  66  13.901   1.502  -2.388
  506    HE2  LYS  66           1HE      LYS  66  12.632  -0.395  -1.639
  507    HE3  LYS  66           2HE      LYS  66  11.378  -0.082  -2.837
  508    HZ1  LYS  66           3HZ      LYS  66  12.936  -1.882  -3.456
  509    HZ2  LYS  66           1HZ      LYS  66  14.193  -0.745  -3.508
  510    HZ3  LYS  66           2HZ      LYS  66  12.895  -0.618  -4.584
  511    H    ASN  67           H        ASN  67   9.473   4.920  -3.169
  512    HA   ASN  67           HA       ASN  67   8.886   2.401  -4.566
  513    HB2  ASN  67           1HB      ASN  67   6.956   4.075  -3.005
  514    HB3  ASN  67           2HB      ASN  67   6.839   2.383  -3.420
  515   HD21  ASN  67          1HD2      ASN  67   6.982   4.161  -0.943
  516   HD22  ASN  67          2HD2      ASN  67   8.008   3.278   0.104
  517    H    GLU  68           H        GLU  68   8.843   5.754  -4.893
  518    HA   GLU  68           HA       GLU  68   8.205   7.105  -6.588
  519    HB2  GLU  68           1HB      GLU  68   8.430   5.145  -8.090
  520    HB3  GLU  68           2HB      GLU  68   6.745   4.736  -7.764
  521    HG2  GLU  68           1HG      GLU  68   7.130   5.905  -9.927
  522    HG3  GLU  68           2HG      GLU  68   5.995   6.727  -8.858
  523    H    VAL  69           H        VAL  69   6.715   6.573  -4.100
  524    HA   VAL  69           HA       VAL  69   4.137   7.651  -5.008
  525    HB   VAL  69           HB       VAL  69   3.505   5.920  -3.612
  526   HG11  VAL  69          1HG1      VAL  69   4.487   5.319  -1.493
  527   HG12  VAL  69          2HG1      VAL  69   5.628   6.664  -1.606
  528   HG13  VAL  69          3HG1      VAL  69   5.721   5.330  -2.750
  529   HG21  VAL  69          3HG2      VAL  69   2.642   6.916  -1.550
  530   HG22  VAL  69          1HG2      VAL  69   2.407   7.976  -2.939
  531   HG23  VAL  69          2HG2      VAL  69   3.700   8.306  -1.785
  532    H    SER  70           H        SER  70   3.874   9.751  -4.921
  533    HA   SER  70           HA       SER  70   5.514  11.284  -3.018
  534    HB2  SER  70           1HB      SER  70   6.094  11.682  -5.396
  535    HB3  SER  70           2HB      SER  70   4.438  12.200  -5.697
  536    HG   SER  70           HG       SER  70   6.213  13.424  -3.837
  537    H    ALA  71           H        ALA  71   2.341  11.006  -4.552
  538    HA   ALA  71           HA       ALA  71   1.237  12.995  -2.726
  539    HB1  ALA  71           1HB      ALA  71  -0.842  12.697  -4.009
  540    HB2  ALA  71           2HB      ALA  71  -0.054  11.448  -4.972
  541    HB3  ALA  71           3HB      ALA  71   0.524  13.112  -5.041
  542    H    MET  72           H        MET  72  -0.851  12.420  -1.618
  543    HA   MET  72           HA       MET  72  -1.050   9.616  -0.854
  544    HB2  MET  72           1HB      MET  72  -0.939  10.138   1.547
  545    HB3  MET  72           2HB      MET  72   0.571  10.508   0.732
  546    HG2  MET  72           1HG      MET  72  -1.515  12.588   1.311
  547    HG3  MET  72           2HG      MET  72  -0.239  12.170   2.449
  548    HE1  MET  72           3HE      MET  72   2.249  11.632   0.492
  549    HE2  MET  72           1HE      MET  72   2.316  12.531   2.008
  550    HE3  MET  72           2HE      MET  72   2.985  13.234   0.535
  551    HA   PRO  73           HA       PRO  73  -2.058   8.580   0.776
  552    HB2  PRO  73           1HB      PRO  73  -4.173   6.916   0.799
  553    HB3  PRO  73           2HB      PRO  73  -3.841   8.058   2.101
  554    HG2  PRO  73           1HG      PRO  73  -5.845   8.214  -0.098
  555    HG3  PRO  73           2HG      PRO  73  -5.980   8.770   1.587
  556    HD2  PRO  73           1HD      PRO  73  -5.438  10.396  -0.602
  557    HD3  PRO  73           2HD      PRO  73  -5.066  10.803   1.084
  558    H    THR  74           H        THR  74  -1.358   6.729  -0.224
  559    HA   THR  74           HA       THR  74  -2.219   6.249  -2.998
  560    HB   THR  74           HB       THR  74   0.583   6.717  -1.979
  561    HG1  THR  74           1HG      THR  74   0.182   8.540  -2.948
  562   HG21  THR  74          3HG2      THR  74   1.462   5.940  -4.125
  563   HG22  THR  74          1HG2      THR  74  -0.158   5.423  -4.614
  564   HG23  THR  74          2HG2      THR  74   0.655   4.635  -3.258
  565    H    LEU  75           H        LEU  75  -2.485   4.196  -3.484
  566    HA   LEU  75           HA       LEU  75  -1.517   2.151  -1.603
  567    HB2  LEU  75           1HB      LEU  75  -3.490   1.940  -3.872
  568    HB3  LEU  75           2HB      LEU  75  -3.078   0.656  -2.749
  569    HG   LEU  75           HG       LEU  75  -3.943   2.587  -1.042
  570   HD11  LEU  75          1HD1      LEU  75  -5.662   2.818  -3.520
  571   HD12  LEU  75          2HD1      LEU  75  -4.601   4.076  -2.884
  572   HD13  LEU  75          3HD1      LEU  75  -5.996   3.541  -1.946
  573   HD21  LEU  75          3HD2      LEU  75  -6.059   1.277  -1.030
  574   HD22  LEU  75          1HD2      LEU  75  -4.590   0.303  -0.938
  575   HD23  LEU  75          2HD2      LEU  75  -5.477   0.426  -2.460
  576    H    LEU  76           H        LEU  76   0.260   1.021  -2.217
  577    HA   LEU  76           HA       LEU  76   0.792   0.849  -5.106
  578    HB2  LEU  76           1HB      LEU  76   2.461   1.797  -3.013
  579    HB3  LEU  76           2HB      LEU  76   3.144   0.289  -3.588
  580    HG   LEU  76           HG       LEU  76   2.492   2.664  -5.340
  581   HD11  LEU  76          1HD1      LEU  76   4.357   3.132  -3.841
  582   HD12  LEU  76          2HD1      LEU  76   4.920   2.956  -5.512
  583   HD13  LEU  76          3HD1      LEU  76   5.151   1.639  -4.347
  584   HD21  LEU  76          3HD2      LEU  76   4.016   0.145  -5.994
  585   HD22  LEU  76          1HD2      LEU  76   3.612   1.462  -7.094
  586   HD23  LEU  76          2HD2      LEU  76   2.336   0.435  -6.436
  587    H    LEU  77           H        LEU  77   0.291  -1.078  -5.832
  588    HA   LEU  77           HA       LEU  77   0.560  -3.439  -4.114
  589    HB2  LEU  77           1HB      LEU  77  -0.730  -3.024  -6.816
  590    HB3  LEU  77           2HB      LEU  77  -0.545  -4.597  -6.081
  591    HG   LEU  77           HG       LEU  77  -2.205  -4.148  -4.427
  592   HD11  LEU  77          1HD1      LEU  77  -1.499  -1.845  -3.840
  593   HD12  LEU  77          2HD1      LEU  77  -3.236  -1.956  -4.125
  594   HD13  LEU  77          3HD1      LEU  77  -2.183  -1.261  -5.356
  595   HD21  LEU  77          3HD2      LEU  77  -2.997  -4.592  -6.707
  596   HD22  LEU  77          1HD2      LEU  77  -3.043  -2.855  -7.024
  597   HD23  LEU  77          2HD2      LEU  77  -4.111  -3.558  -5.809
  598    H    PHE  78           H        PHE  78   2.139  -4.886  -4.427
  599    HA   PHE  78           HA       PHE  78   3.681  -4.753  -6.931
  600    HB2  PHE  78           1HB      PHE  78   4.677  -4.986  -4.096
  601    HB3  PHE  78           2HB      PHE  78   5.643  -5.510  -5.470
  602    HD1  PHE  78           2HD      PHE  78   4.051  -2.590  -3.879
  603    HD2  PHE  78           1HD      PHE  78   6.812  -3.965  -6.805
  604    HE1  PHE  78           2HE      PHE  78   4.914  -0.309  -4.141
  605    HE2  PHE  78           1HE      PHE  78   7.681  -1.683  -7.067
  606    HZ   PHE  78           HZ       PHE  78   6.730   0.153  -5.733
  607    H    LYS  79           H        LYS  79   4.573  -6.776  -7.653
  608    HA   LYS  79           HA       LYS  79   4.040  -9.086  -5.913
  609    HB2  LYS  79           1HB      LYS  79   2.408  -8.782  -7.989
  610    HB3  LYS  79           2HB      LYS  79   3.783  -9.480  -8.856
  611    HG2  LYS  79           1HG      LYS  79   3.639 -11.495  -7.742
  612    HG3  LYS  79           2HG      LYS  79   2.726 -10.810  -6.397
  613    HD2  LYS  79           1HD      LYS  79   1.299 -12.203  -7.796
  614    HD3  LYS  79           2HD      LYS  79   0.789 -10.516  -7.864
  615    HE2  LYS  79           1HE      LYS  79   2.045 -10.281  -9.990
  616    HE3  LYS  79           2HE      LYS  79   2.401 -12.007  -9.930
  617    HZ1  LYS  79           3HZ      LYS  79   0.517 -11.649 -11.331
  618    HZ2  LYS  79           1HZ      LYS  79  -0.279 -10.750 -10.136
  619    HZ3  LYS  79           2HZ      LYS  79  -0.024 -12.405  -9.915
  620    H    ASN  80           H        ASN  80   5.993  -9.835  -5.416
  621    HA   ASN  80           HA       ASN  80   7.984 -10.891  -5.699
  622    HB2  ASN  80           1HB      ASN  80   6.786 -12.152  -7.396
  623    HB3  ASN  80           2HB      ASN  80   7.105 -10.898  -8.578
  624   HD21  ASN  80          1HD2      ASN  80   8.110 -12.140  -9.987
  625   HD22  ASN  80          2HD2      ASN  80   9.663 -12.872  -9.721
  626    H    GLY  81           H        GLY  81   8.181  -8.231  -5.342
  627    HA2  GLY  81           1HA      GLY  81   9.864  -6.648  -5.384
  628    HA3  GLY  81           2HA      GLY  81  10.768  -7.715  -6.454
  629    H    LYS  82           H        LYS  82   7.752  -7.236  -7.757
  630    HA   LYS  82           HA       LYS  82   8.586  -4.834  -9.241
  631    HB2  LYS  82           1HB      LYS  82   7.226  -7.302 -10.357
  632    HB3  LYS  82           2HB      LYS  82   7.466  -5.804 -11.246
  633    HG2  LYS  82           1HG      LYS  82   9.670  -7.539 -10.152
  634    HG3  LYS  82           2HG      LYS  82   9.111  -7.532 -11.826
  635    HD2  LYS  82           1HD      LYS  82   9.714  -5.142 -11.983
  636    HD3  LYS  82           2HD      LYS  82  10.343  -5.216 -10.335
  637    HE2  LYS  82           1HE      LYS  82  11.337  -6.832 -12.679
  638    HE3  LYS  82           2HE      LYS  82  12.128  -5.411 -12.002
  639    HZ1  LYS  82           3HZ      LYS  82  11.666  -7.984 -10.592
  640    HZ2  LYS  82           1HZ      LYS  82  12.385  -6.614  -9.910
  641    HZ3  LYS  82           2HZ      LYS  82  13.147  -7.424 -11.181
  642    H    GLU  83           H        GLU  83   6.693  -3.650 -10.132
  643    HA   GLU  83           HA       GLU  83   4.672  -3.371  -8.158
  644    HB2  GLU  83           1HB      GLU  83   5.638  -1.591  -9.727
  645    HB3  GLU  83           2HB      GLU  83   4.607  -2.273 -10.973
  646    HG2  GLU  83           1HG      GLU  83   2.630  -1.719  -9.684
  647    HG3  GLU  83           2HG      GLU  83   3.643  -1.117  -8.367
  648    H    VAL  84           H        VAL  84   2.282  -3.339  -8.894
  649    HA   VAL  84           HA       VAL  84   1.694  -4.869 -11.276
  650    HB   VAL  84           HB       VAL  84  -0.321  -5.887  -9.962
  651   HG11  VAL  84          1HG1      VAL  84   2.430  -7.090  -9.712
  652   HG12  VAL  84          2HG1      VAL  84   1.425  -7.152 -11.161
  653   HG13  VAL  84          3HG1      VAL  84   0.889  -7.954  -9.685
  654   HG21  VAL  84          3HG2      VAL  84   0.189  -4.822  -7.852
  655   HG22  VAL  84          1HG2      VAL  84   1.766  -5.605  -7.821
  656   HG23  VAL  84          2HG2      VAL  84   0.297  -6.576  -7.701
  657    H    ALA  85           H        ALA  85   0.716  -2.692  -8.727
  658    HA   ALA  85           HA       ALA  85  -0.675  -1.035 -10.541
  659    HB1  ALA  85           1HB      ALA  85  -2.446  -2.600 -10.450
  660    HB2  ALA  85           2HB      ALA  85  -2.931  -1.229  -9.449
  661    HB3  ALA  85           3HB      ALA  85  -2.338  -2.713  -8.699
  662    H    LYS  86           H        LYS  86  -0.789   1.034  -9.774
  663    HA   LYS  86           HA       LYS  86  -0.825   1.375  -6.865
  664    HB2  LYS  86           1HB      LYS  86   0.659   3.363  -7.076
  665    HB3  LYS  86           2HB      LYS  86   1.447   1.834  -7.414
  666    HG2  LYS  86           1HG      LYS  86   1.321   2.281  -9.801
  667    HG3  LYS  86           2HG      LYS  86   0.489   3.804  -9.478
  668    HD2  LYS  86           1HD      LYS  86   2.422   4.646  -8.286
  669    HD3  LYS  86           2HD      LYS  86   3.246   3.099  -8.473
  670    HE2  LYS  86           1HE      LYS  86   2.416   4.924 -10.725
  671    HE3  LYS  86           2HE      LYS  86   4.046   4.790 -10.068
  672    HZ1  LYS  86           3HZ      LYS  86   2.509   2.694 -11.492
  673    HZ2  LYS  86           1HZ      LYS  86   3.965   2.392 -10.682
  674    HZ3  LYS  86           2HZ      LYS  86   3.930   3.451 -12.002
  675    H    VAL  87           H        VAL  87  -2.124   2.920  -6.086
  676    HA   VAL  87           HA       VAL  87  -3.633   4.558  -8.015
  677    HB   VAL  87           HB       VAL  87  -4.929   3.027  -5.755
  678   HG11  VAL  87          1HG1      VAL  87  -7.025   3.698  -6.820
  679   HG12  VAL  87          2HG1      VAL  87  -6.121   4.591  -8.041
  680   HG13  VAL  87          3HG1      VAL  87  -6.063   5.099  -6.354
  681   HG21  VAL  87          3HG2      VAL  87  -4.959   2.399  -8.706
  682   HG22  VAL  87          1HG2      VAL  87  -5.929   1.591  -7.475
  683   HG23  VAL  87          2HG2      VAL  87  -4.172   1.450  -7.446
  684    H    VAL  88           H        VAL  88  -3.613   6.623  -7.419
  685    HA   VAL  88           HA       VAL  88  -2.856   7.294  -4.684
  686    HB   VAL  88           HB       VAL  88  -3.322   9.228  -6.956
  687   HG11  VAL  88          1HG1      VAL  88  -1.855  10.694  -5.677
  688   HG12  VAL  88          2HG1      VAL  88  -1.693   9.457  -4.430
  689   HG13  VAL  88          3HG1      VAL  88  -3.260  10.214  -4.725
  690   HG21  VAL  88          3HG2      VAL  88  -1.664   7.598  -7.675
  691   HG22  VAL  88          1HG2      VAL  88  -0.750   7.854  -6.189
  692   HG23  VAL  88          2HG2      VAL  88  -0.905   9.160  -7.364
  693    H    GLY  89           H        GLY  89  -5.142   6.270  -4.268
  694    HA2  GLY  89           1HA      GLY  89  -6.701   8.087  -3.006
  695    HA3  GLY  89           2HA      GLY  89  -7.340   8.104  -4.642
  696    H    ALA  90           H        ALA  90  -7.932   6.916  -1.726
  697    HA   ALA  90           HA       ALA  90  -8.403   4.192  -2.018
  698    HB1  ALA  90           1HB      ALA  90  -8.499   5.508   0.087
  699    HB2  ALA  90           2HB      ALA  90  -9.835   4.370  -0.126
  700    HB3  ALA  90           3HB      ALA  90 -10.081   6.094  -0.416
  701    H    ASN  91           H        ASN  91  -9.490   3.311  -3.600
  702    HA   ASN  91           HA       ASN  91 -12.148   4.395  -4.240
  703    HB2  ASN  91           1HB      ASN  91 -10.128   4.097  -5.994
  704    HB3  ASN  91           2HB      ASN  91 -10.796   2.472  -6.063
  705   HD21  ASN  91          1HD2      ASN  91 -12.754   5.312  -5.458
  706   HD22  ASN  91          2HD2      ASN  91 -13.601   5.269  -6.963
  707    HA   PRO  92           HA       PRO  92 -12.856   1.034  -1.244
  708    HB2  PRO  92           1HB      PRO  92 -15.528   1.480  -2.528
  709    HB3  PRO  92           2HB      PRO  92 -15.139   1.175  -0.830
  710    HG2  PRO  92           1HG      PRO  92 -15.577   3.659  -1.759
  711    HG3  PRO  92           2HG      PRO  92 -14.413   3.328  -0.466
  712    HD2  PRO  92           1HD      PRO  92 -13.924   4.196  -3.214
  713    HD3  PRO  92           2HD      PRO  92 -12.820   4.188  -1.830
  714    H    ALA  93           H        ALA  93 -14.973   0.623  -4.093
  715    HA   ALA  93           HA       ALA  93 -14.692  -2.225  -3.827
  716    HB1  ALA  93           1HB      ALA  93 -16.170  -0.623  -5.912
  717    HB2  ALA  93           2HB      ALA  93 -16.847  -1.216  -4.395
  718    HB3  ALA  93           3HB      ALA  93 -16.323  -2.358  -5.633
  719    H    ALA  94           H        ALA  94 -13.383   0.240  -5.936
  720    HA   ALA  94           HA       ALA  94 -12.498  -1.602  -7.946
  721    HB1  ALA  94           1HB      ALA  94 -11.558   1.210  -7.414
  722    HB2  ALA  94           2HB      ALA  94 -12.916   0.764  -8.448
  723    HB3  ALA  94           3HB      ALA  94 -11.278   0.271  -8.879
  724    H    ILE  95           H        ILE  95 -11.174  -0.313  -4.992
  725    HA   ILE  95           HA       ILE  95  -8.496  -1.199  -5.519
  726    HB   ILE  95           HB       ILE  95  -9.824  -0.312  -2.965
  727   HG12  ILE  95          1HG1      ILE  95  -9.462   1.477  -4.586
  728   HG13  ILE  95          2HG1      ILE  95  -8.361   1.663  -3.226
  729   HG21  ILE  95          1HG2      ILE  95  -8.111  -1.906  -2.394
  730   HG22  ILE  95          2HG2      ILE  95  -7.548  -0.282  -1.997
  731   HG23  ILE  95          3HG2      ILE  95  -6.957  -1.092  -3.450
  732   HD11  ILE  95          3HD1      ILE  95  -7.689   0.583  -5.951
  733   HD12  ILE  95          1HD1      ILE  95  -6.576   0.637  -4.585
  734   HD13  ILE  95          2HD1      ILE  95  -7.204   2.135  -5.270
  735    H    LYS  96           H        LYS  96 -11.153  -2.346  -3.457
  736    HA   LYS  96           HA       LYS  96  -9.831  -4.656  -2.555
  737    HB2  LYS  96           1HB      LYS  96 -12.801  -4.154  -2.864
  738    HB3  LYS  96           2HB      LYS  96 -12.073  -5.478  -1.942
  739    HG2  LYS  96           1HG      LYS  96 -11.162  -4.013  -0.347
  740    HG3  LYS  96           2HG      LYS  96 -11.507  -2.595  -1.337
  741    HD2  LYS  96           1HD      LYS  96 -13.059  -2.991   0.619
  742    HD3  LYS  96           2HD      LYS  96 -13.832  -2.770  -0.949
  743    HE2  LYS  96           1HE      LYS  96 -14.831  -4.597   0.375
  744    HE3  LYS  96           2HE      LYS  96 -14.179  -5.142  -1.167
  745    HZ1  LYS  96           3HZ      LYS  96 -12.781  -5.397   1.441
  746    HZ2  LYS  96           1HZ      LYS  96 -12.261  -6.009  -0.048
  747    HZ3  LYS  96           2HZ      LYS  96 -13.649  -6.635   0.683
  748    H    GLN  97           H        GLN  97 -11.524  -3.932  -5.494
  749    HA   GLN  97           HA       GLN  97 -11.472  -6.641  -6.458
  750    HB2  GLN  97           1HB      GLN  97 -13.155  -5.108  -7.301
  751    HB3  GLN  97           2HB      GLN  97 -11.914  -4.002  -7.870
  752    HG2  GLN  97           1HG      GLN  97 -11.151  -5.754  -9.443
  753    HG3  GLN  97           2HG      GLN  97 -12.504  -6.757  -8.922
  754   HE21  GLN  97          1HE2      GLN  97 -11.848  -5.606 -11.537
  755   HE22  GLN  97          2HE2      GLN  97 -13.234  -4.686 -12.001
  756    H    ALA  98           H        ALA  98  -9.375  -3.838  -6.592
  757    HA   ALA  98           HA       ALA  98  -7.731  -4.676  -8.724
  758    HB1  ALA  98           1HB      ALA  98  -7.028  -2.890  -6.408
  759    HB2  ALA  98           2HB      ALA  98  -7.764  -2.373  -7.924
  760    HB3  ALA  98           3HB      ALA  98  -6.133  -3.040  -7.920
  761    H    ILE  99           H        ILE  99  -7.312  -4.899  -5.226
  762    HA   ILE  99           HA       ILE  99  -4.860  -6.174  -5.157
  763    HB   ILE  99           HB       ILE  99  -7.017  -6.964  -3.215
  764   HG12  ILE  99          1HG1      ILE  99  -7.380  -4.629  -3.265
  765   HG13  ILE  99          2HG1      ILE  99  -6.308  -4.899  -1.896
  766   HG21  ILE  99          1HG2      ILE  99  -4.061  -6.471  -3.038
  767   HG22  ILE  99          2HG2      ILE  99  -4.895  -8.023  -2.949
  768   HG23  ILE  99          3HG2      ILE  99  -5.087  -6.842  -1.653
  769   HD11  ILE  99          3HD1      ILE  99  -4.410  -4.280  -3.364
  770   HD12  ILE  99          1HD1      ILE  99  -5.570  -2.980  -3.072
  771   HD13  ILE  99          2HD1      ILE  99  -5.594  -3.854  -4.606
  772    H    ALA 100           H        ALA 100  -8.099  -7.530  -5.569
  773    HA   ALA 100           HA       ALA 100  -7.205 -10.265  -5.491
  774    HB1  ALA 100           1HB      ALA 100  -9.457  -9.639  -4.772
  775    HB2  ALA 100           2HB      ALA 100  -9.500 -10.820  -6.081
  776    HB3  ALA 100           3HB      ALA 100  -9.837  -9.122  -6.415
  777    H    ALA 101           H        ALA 101  -7.422  -7.829  -7.892
  778    HA   ALA 101           HA       ALA 101  -7.523  -9.627 -10.142
  779    HB1  ALA 101           1HB      ALA 101  -7.304  -7.624 -11.499
  780    HB2  ALA 101           2HB      ALA 101  -6.914  -6.669 -10.066
  781    HB3  ALA 101           3HB      ALA 101  -8.524  -7.375 -10.248
  782    H    ASN 102           H        ASN 102  -5.103  -7.665  -8.496
  783    HA   ASN 102           HA       ASN 102  -3.055  -8.245 -10.435
  784    HB2  ASN 102           1HB      ASN 102  -2.870  -6.882  -7.755
  785    HB3  ASN 102           2HB      ASN 102  -1.594  -6.927  -8.959
  786   HD21  ASN 102          1HD2      ASN 102  -4.455  -5.437  -7.916
  787   HD22  ASN 102          2HD2      ASN 102  -4.627  -4.291  -9.199
  788    H    ALA 103           H        ALA 103  -4.139  -9.656  -7.490
  789    HA   ALA 103           HA       ALA 103  -1.774 -10.887  -6.617
  790    HB1  ALA 103           1HB      ALA 103  -3.224 -12.387  -5.349
  791    HB2  ALA 103           2HB      ALA 103  -4.615 -11.842  -6.286
  792    HB3  ALA 103           3HB      ALA 103  -3.773 -10.717  -5.223
  Start of MODEL   16
    1    H1   MET   1           1H       MET   1  -5.693  -7.043  10.192
    2    H2   MET   1           2H       MET   1  -6.459  -5.981   9.123
    3    H3   MET   1           3H       MET   1  -6.956  -6.054  10.735
    4    HA   MET   1           HA       MET   1  -5.652  -4.089  10.343
    5    HB2  MET   1           1HB      MET   1  -5.554  -5.166  12.542
    6    HB3  MET   1           2HB      MET   1  -4.224  -6.177  12.001
    7    HG2  MET   1           1HG      MET   1  -2.780  -4.283  11.797
    8    HG3  MET   1           2HG      MET   1  -4.113  -3.174  12.113
    9    HE1  MET   1           3HE      MET   1  -5.351  -2.969  14.392
   10    HE2  MET   1           1HE      MET   1  -4.930  -3.870  15.852
   11    HE3  MET   1           2HE      MET   1  -5.655  -4.704  14.475
   12    H    VAL   2           H        VAL   2  -3.988  -3.091   9.412
   13    HA   VAL   2           HA       VAL   2  -2.303  -4.710   7.642
   14    HB   VAL   2           HB       VAL   2  -3.193  -1.828   7.576
   15   HG11  VAL   2          1HG1      VAL   2  -1.960  -1.596   5.482
   16   HG12  VAL   2          2HG1      VAL   2  -1.287  -3.213   5.696
   17   HG13  VAL   2          3HG1      VAL   2  -0.871  -1.928   6.829
   18   HG21  VAL   2          3HG2      VAL   2  -4.635  -3.843   6.823
   19   HG22  VAL   2          1HG2      VAL   2  -3.573  -3.856   5.418
   20   HG23  VAL   2          2HG2      VAL   2  -4.524  -2.420   5.788
   21    H    THR   3           H        THR   3  -0.093  -4.592   7.675
   22    HA   THR   3           HA       THR   3   1.004  -3.915  10.260
   23    HB   THR   3           HB       THR   3   2.475  -5.080   7.893
   24    HG1  THR   3           1HG      THR   3   1.198  -6.744   8.120
   25   HG21  THR   3          3HG2      THR   3   3.865  -4.372   9.798
   26   HG22  THR   3          1HG2      THR   3   3.868  -6.125   9.604
   27   HG23  THR   3          2HG2      THR   3   2.893  -5.380  10.871
   28    H    GLN   4           H        GLN   4   2.717  -2.572  10.701
   29    HA   GLN   4           HA       GLN   4   2.894  -0.254   8.930
   30    HB2  GLN   4           1HB      GLN   4   2.250  -0.006  11.304
   31    HB3  GLN   4           2HB      GLN   4   3.809  -0.657  11.782
   32    HG2  GLN   4           1HG      GLN   4   3.740   1.781  11.950
   33    HG3  GLN   4           2HG      GLN   4   4.956   1.224  10.804
   34   HE21  GLN   4          1HE2      GLN   4   1.516   1.340  10.167
   35   HE22  GLN   4          2HE2      GLN   4   1.601   2.560   8.953
   36    H    PHE   5           H        PHE   5   4.713   0.334   7.878
   37    HA   PHE   5           HA       PHE   5   7.250  -1.092   8.378
   38    HB2  PHE   5           1HB      PHE   5   6.371   0.814   6.200
   39    HB3  PHE   5           2HB      PHE   5   8.023   0.260   6.376
   40    HD1  PHE   5           2HD      PHE   5   7.248  -2.638   7.133
   41    HD2  PHE   5           1HD      PHE   5   6.033   0.015   4.038
   42    HE1  PHE   5           2HE      PHE   5   6.774  -4.561   5.675
   43    HE2  PHE   5           1HE      PHE   5   5.556  -1.902   2.575
   44    HZ   PHE   5           HZ       PHE   5   5.929  -4.190   3.394
   45    H    LYS   6           H        LYS   6   9.202   0.148   8.763
   46    HA   LYS   6           HA       LYS   6   8.786   3.019   9.195
   47    HB2  LYS   6           1HB      LYS   6  10.182   3.015  11.175
   48    HB3  LYS   6           2HB      LYS   6   8.823   1.925  11.391
   49    HG2  LYS   6           1HG      LYS   6  10.374   0.044  10.772
   50    HG3  LYS   6           2HG      LYS   6  11.692   1.211  10.881
   51    HD2  LYS   6           1HD      LYS   6   9.768   0.529  13.104
   52    HD3  LYS   6           2HD      LYS   6  11.417  -0.078  12.958
   53    HE2  LYS   6           1HE      LYS   6  10.666   2.833  13.197
   54    HE3  LYS   6           2HE      LYS   6  11.198   1.820  14.536
   55    HZ1  LYS   6           3HZ      LYS   6  13.301   1.476  13.367
   56    HZ2  LYS   6           1HZ      LYS   6  13.022   3.116  13.676
   57    HZ3  LYS   6           2HZ      LYS   6  12.789   2.498  12.122
   58    H    THR   7           H        THR   7  10.362   0.684   7.504
   59    HA   THR   7           HA       THR   7  12.457   2.602   6.745
   60    HB   THR   7           HB       THR   7  14.047   0.673   6.432
   61    HG1  THR   7           1HG      THR   7  12.085  -0.663   8.025
   62   HG21  THR   7          3HG2      THR   7  14.700   0.535   8.792
   63   HG22  THR   7          1HG2      THR   7  13.141   1.213   9.260
   64   HG23  THR   7          2HG2      THR   7  14.282   2.186   8.334
   65    H    ALA   8           H        ALA   8  13.353   2.209   4.596
   66    HA   ALA   8           HA       ALA   8  11.332   1.441   2.720
   67    HB1  ALA   8           1HB      ALA   8  14.215   2.124   2.192
   68    HB2  ALA   8           2HB      ALA   8  12.893   3.287   2.270
   69    HB3  ALA   8           3HB      ALA   8  12.912   2.061   1.009
   70    H    SER   9           H        SER   9  14.156  -0.022   4.121
   71    HA   SER   9           HA       SER   9  14.457  -2.233   2.441
   72    HB2  SER   9           1HB      SER   9  14.760  -2.222   5.454
   73    HB3  SER   9           2HB      SER   9  15.557  -3.302   4.310
   74    HG   SER   9           HG       SER   9  16.478  -1.289   3.400
   75    H    GLU  10           H        GLU  10  12.405  -1.756   5.298
   76    HA   GLU  10           HA       GLU  10  11.013  -4.120   5.321
   77    HB2  GLU  10           1HB      GLU  10  10.398  -1.315   6.102
   78    HB3  GLU  10           2HB      GLU  10   9.103  -2.501   6.150
   79    HG2  GLU  10           1HG      GLU  10  10.388  -3.882   7.633
   80    HG3  GLU  10           2HG      GLU  10  11.750  -2.775   7.540
   81    H    PHE  11           H        PHE  11  10.246  -1.178   3.421
   82    HA   PHE  11           HA       PHE  11   7.898  -2.173   2.250
   83    HB2  PHE  11           1HB      PHE  11   8.689   0.211   2.142
   84    HB3  PHE  11           2HB      PHE  11   9.880  -0.284   0.944
   85    HD1  PHE  11           1HD      PHE  11   8.934  -1.428  -1.198
   86    HD2  PHE  11           2HD      PHE  11   6.604   0.949   1.453
   87    HE1  PHE  11           1HE      PHE  11   7.300  -1.026  -2.992
   88    HE2  PHE  11           2HE      PHE  11   4.963   1.359  -0.356
   89    HZ   PHE  11           HZ       PHE  11   5.319   0.360  -2.566
   90    H    ASP  12           H        ASP  12  11.152  -2.070   0.896
   91    HA   ASP  12           HA       ASP  12  10.637  -3.485  -1.469
   92    HB2  ASP  12           1HB      ASP  12  12.641  -2.103  -1.040
   93    HB3  ASP  12           2HB      ASP  12  13.214  -3.296   0.114
   94    H    SER  13           H        SER  13  11.505  -4.623   1.749
   95    HA   SER  13           HA       SER  13  12.092  -7.287   1.080
   96    HB2  SER  13           1HB      SER  13  12.630  -6.180   3.261
   97    HB3  SER  13           2HB      SER  13  10.922  -6.272   3.681
   98    HG   SER  13           HG       SER  13  12.530  -8.520   3.028
   99    H    ALA  14           H        ALA  14   9.047  -5.794   2.202
  100    HA   ALA  14           HA       ALA  14   7.510  -8.133   2.069
  101    HB1  ALA  14           1HB      ALA  14   6.573  -5.282   1.753
  102    HB2  ALA  14           2HB      ALA  14   6.769  -6.137   3.283
  103    HB3  ALA  14           3HB      ALA  14   5.550  -6.679   2.123
  104    H    ILE  15           H        ILE  15   8.450  -5.782  -0.309
  105    HA   ILE  15           HA       ILE  15   6.663  -6.453  -2.370
  106    HB   ILE  15           HB       ILE  15   9.493  -5.482  -2.652
  107   HG12  ILE  15          1HG1      ILE  15   8.482  -3.815  -1.379
  108   HG13  ILE  15          2HG1      ILE  15   8.273  -3.278  -3.042
  109   HG21  ILE  15          1HG2      ILE  15   7.301  -4.920  -4.580
  110   HG22  ILE  15          2HG2      ILE  15   8.187  -6.438  -4.662
  111   HG23  ILE  15          3HG2      ILE  15   9.048  -4.904  -4.825
  112   HD11  ILE  15          3HD1      ILE  15   6.180  -4.655  -1.380
  113   HD12  ILE  15          1HD1      ILE  15   5.981  -4.067  -3.030
  114   HD13  ILE  15          2HD1      ILE  15   6.260  -2.926  -1.717
  115    H    ALA  16           H        ALA  16   9.767  -7.787  -1.405
  116    HA   ALA  16           HA       ALA  16  10.134  -9.316  -3.799
  117    HB1  ALA  16           1HB      ALA  16  11.565  -9.502  -1.153
  118    HB2  ALA  16           2HB      ALA  16  12.022  -8.465  -2.504
  119    HB3  ALA  16           3HB      ALA  16  12.098 -10.219  -2.675
  120    H    GLN  17           H        GLN  17   7.945  -9.715  -1.531
  121    HA   GLN  17           HA       GLN  17   8.222 -12.548  -1.013
  122    HB2  GLN  17           1HB      GLN  17   7.327 -10.903   0.647
  123    HB3  GLN  17           2HB      GLN  17   5.943 -10.668  -0.405
  124    HG2  GLN  17           1HG      GLN  17   5.225 -12.914  -0.081
  125    HG3  GLN  17           2HG      GLN  17   6.696 -13.305   0.809
  126   HE21  GLN  17          1HE2      GLN  17   5.107 -10.247   1.221
  127   HE22  GLN  17          2HE2      GLN  17   4.478 -10.555   2.803
  128    H    ASP  18           H        ASP  18   6.889 -14.153  -1.879
  129    HA   ASP  18           HA       ASP  18   5.939 -13.544  -4.547
  130    HB2  ASP  18           1HB      ASP  18   7.299 -15.564  -4.126
  131    HB3  ASP  18           2HB      ASP  18   6.024 -16.195  -3.091
  132    H    LYS  19           H        LYS  19   4.217 -12.178  -3.701
  133    HA   LYS  19           HA       LYS  19   1.709 -13.428  -3.954
  134    HB2  LYS  19           1HB      LYS  19   0.774 -13.025  -1.734
  135    HB3  LYS  19           2HB      LYS  19   2.142 -14.123  -1.615
  136    HG2  LYS  19           1HG      LYS  19   3.541 -12.111  -1.016
  137    HG3  LYS  19           2HG      LYS  19   2.028 -11.219  -0.866
  138    HD2  LYS  19           1HD      LYS  19   2.710 -13.729   0.658
  139    HD3  LYS  19           2HD      LYS  19   2.866 -12.093   1.292
  140    HE2  LYS  19           1HE      LYS  19   0.416 -11.792   0.862
  141    HE3  LYS  19           2HE      LYS  19   0.339 -13.512   0.472
  142    HZ1  LYS  19           3HZ      LYS  19  -0.259 -13.052   2.791
  143    HZ2  LYS  19           1HZ      LYS  19   1.279 -12.390   3.058
  144    HZ3  LYS  19           2HZ      LYS  19   1.116 -14.032   2.682
  145    H    LEU  20           H        LEU  20  -0.049 -11.660  -3.215
  146    HA   LEU  20           HA       LEU  20   0.762  -9.230  -4.543
  147    HB2  LEU  20           1HB      LEU  20  -1.503 -10.435  -4.733
  148    HB3  LEU  20           2HB      LEU  20  -1.879  -9.717  -3.182
  149    HG   LEU  20           HG       LEU  20  -2.814  -8.499  -5.153
  150   HD11  LEU  20          1HD1      LEU  20  -0.833  -6.905  -3.540
  151   HD12  LEU  20          2HD1      LEU  20  -2.446  -7.371  -3.003
  152   HD13  LEU  20          3HD1      LEU  20  -2.256  -6.284  -4.378
  153   HD21  LEU  20          3HD2      LEU  20  -0.696  -8.951  -6.514
  154   HD22  LEU  20          1HD2      LEU  20  -0.026  -7.542  -5.689
  155   HD23  LEU  20          2HD2      LEU  20  -1.478  -7.373  -6.696
  156    H    VAL  21           H        VAL  21   1.630  -7.576  -3.546
  157    HA   VAL  21           HA       VAL  21   1.399  -7.369  -0.629
  158    HB   VAL  21           HB       VAL  21   3.199  -5.618  -2.250
  159   HG11  VAL  21          1HG1      VAL  21   4.621  -5.791  -0.267
  160   HG12  VAL  21          2HG1      VAL  21   3.457  -6.896   0.465
  161   HG13  VAL  21          3HG1      VAL  21   3.000  -5.225   0.134
  162   HG21  VAL  21          3HG2      VAL  21   3.736  -7.703  -3.230
  163   HG22  VAL  21          1HG2      VAL  21   3.695  -8.529  -1.667
  164   HG23  VAL  21          2HG2      VAL  21   4.984  -7.382  -2.024
  165    H    VAL  22           H        VAL  22  -0.281  -6.137  -0.020
  166    HA   VAL  22           HA       VAL  22  -1.047  -3.810  -1.617
  167    HB   VAL  22           HB       VAL  22  -2.318  -4.815   0.937
  168   HG11  VAL  22          1HG1      VAL  22  -4.261  -3.523   0.180
  169   HG12  VAL  22          2HG1      VAL  22  -3.341  -2.967  -1.218
  170   HG13  VAL  22          3HG1      VAL  22  -2.842  -2.502   0.409
  171   HG21  VAL  22          3HG2      VAL  22  -2.405  -6.567  -0.748
  172   HG22  VAL  22          1HG2      VAL  22  -3.087  -5.430  -1.912
  173   HG23  VAL  22          2HG2      VAL  22  -4.007  -5.880  -0.475
  174    H    VAL  23           H        VAL  23   0.319  -2.135  -1.248
  175    HA   VAL  23           HA       VAL  23   1.040  -1.624   1.548
  176    HB   VAL  23           HB       VAL  23   2.382  -0.448  -0.882
  177   HG11  VAL  23          1HG1      VAL  23   4.163   0.044   0.788
  178   HG12  VAL  23          2HG1      VAL  23   3.058  -0.489   2.054
  179   HG13  VAL  23          3HG1      VAL  23   2.657   0.914   1.066
  180   HG21  VAL  23          3HG2      VAL  23   4.202  -2.031  -0.400
  181   HG22  VAL  23          1HG2      VAL  23   2.709  -2.858  -0.854
  182   HG23  VAL  23          2HG2      VAL  23   3.195  -2.782   0.840
  183    H    ALA  24           H        ALA  24   0.451   0.077   2.552
  184    HA   ALA  24           HA       ALA  24  -1.329   2.012   1.192
  185    HB1  ALA  24           1HB      ALA  24  -2.429   2.247   3.284
  186    HB2  ALA  24           2HB      ALA  24  -1.129   1.433   4.146
  187    HB3  ALA  24           3HB      ALA  24  -2.169   0.515   3.064
  188    H    PHE  25           H        PHE  25   0.094   3.708   0.637
  189    HA   PHE  25           HA       PHE  25   1.768   4.740   2.818
  190    HB2  PHE  25           1HB      PHE  25   2.081   4.657  -0.093
  191    HB3  PHE  25           2HB      PHE  25   2.528   6.197   0.640
  192    HD1  PHE  25           2HD      PHE  25   2.817   2.680   1.780
  193    HD2  PHE  25           1HD      PHE  25   4.818   6.313   0.862
  194    HE1  PHE  25           2HE      PHE  25   4.929   1.701   2.558
  195    HE2  PHE  25           1HE      PHE  25   6.938   5.345   1.647
  196    HZ   PHE  25           HZ       PHE  25   6.992   3.034   2.496
  197    H    TYR  26           H        TYR  26   1.030   6.311   3.955
  198    HA   TYR  26           HA       TYR  26  -0.514   8.446   2.676
  199    HB2  TYR  26           1HB      TYR  26  -2.024   8.445   4.707
  200    HB3  TYR  26           2HB      TYR  26  -2.237   7.089   3.609
  201    HD1  TYR  26           1HD      TYR  26  -0.829   8.096   6.882
  202    HD2  TYR  26           2HD      TYR  26  -1.846   4.858   4.322
  203    HE1  TYR  26           1HE      TYR  26  -0.509   6.526   8.746
  204    HE2  TYR  26           2HE      TYR  26  -1.546   3.281   6.167
  205    HH   TYR  26           HH       TYR  26  -0.990   4.383   9.451
  206    H    ALA  27           H        ALA  27  -0.853  10.247   4.459
  207    HA   ALA  27           HA       ALA  27   1.645  10.484   5.997
  208    HB1  ALA  27           1HB      ALA  27   1.797  12.820   5.439
  209    HB2  ALA  27           2HB      ALA  27   0.281  12.745   4.545
  210    HB3  ALA  27           3HB      ALA  27   1.698  11.883   3.948
  211    H    THR  28           H        THR  28   1.422  11.120   8.047
  212    HA   THR  28           HA       THR  28  -1.110  11.025   9.254
  213    HB   THR  28           HB       THR  28   0.787  12.250  10.971
  214    HG1  THR  28           1HG      THR  28   1.767   9.891   9.702
  215   HG21  THR  28          3HG2      THR  28   0.593  10.135  12.177
  216   HG22  THR  28          1HG2      THR  28  -0.173   9.402  10.767
  217   HG23  THR  28          2HG2      THR  28  -0.993  10.695  11.644
  218    H    TRP  29           H        TRP  29   0.555  13.657   7.812
  219    HA   TRP  29           HA       TRP  29  -0.956  15.643   9.299
  220    HB2  TRP  29           1HB      TRP  29   0.189  17.303   7.883
  221    HB3  TRP  29           2HB      TRP  29   1.325  16.225   8.676
  222    HD1  TRP  29           HD       TRP  29   2.988  14.931   7.166
  223    HE1  TRP  29           1HE      TRP  29   3.414  14.814   4.631
  224    HE3  TRP  29           3HE      TRP  29  -1.183  17.394   5.526
  225    HZ2  TRP  29           2HZ      TRP  29   2.147  15.652   2.255
  226    HZ3  TRP  29           3HZ      TRP  29  -1.502  17.691   3.109
  227    HH2  TRP  29           HH       TRP  29   0.132  16.841   1.505
  228    H    CYS  30           H        CYS  30  -1.458  13.653   6.658
  229    HA   CYS  30           HA       CYS  30  -3.025  15.523   5.093
  230    HB2  CYS  30           1HB      CYS  30  -1.642  13.821   3.973
  231    HB3  CYS  30           2HB      CYS  30  -2.563  12.546   4.761
  232    HG   CYS  30           HG       CYS  30  -3.454  14.536   2.164
  233    H    GLY  31           H        GLY  31  -5.249  15.466   4.866
  234    HA2  GLY  31           1HA      GLY  31  -6.726  14.586   7.136
  235    HA3  GLY  31           2HA      GLY  31  -7.389  15.314   5.685
  236    HA   PRO  32           HA       PRO  32  -9.000  11.528   4.227
  237    HB2  PRO  32           1HB      PRO  32  -7.530  11.582   1.679
  238    HB3  PRO  32           2HB      PRO  32  -9.263  11.727   1.983
  239    HG2  PRO  32           1HG      PRO  32  -7.813  13.835   1.204
  240    HG3  PRO  32           2HG      PRO  32  -9.140  14.006   2.369
  241    HD2  PRO  32           1HD      PRO  32  -6.184  13.859   2.876
  242    HD3  PRO  32           2HD      PRO  32  -7.390  14.962   3.575
  243    H    CYS  33           H        CYS  33  -5.928  11.421   5.189
  244    HA   CYS  33           HA       CYS  33  -4.943   9.015   4.038
  245    HB2  CYS  33           1HB      CYS  33  -3.455   8.918   5.997
  246    HB3  CYS  33           2HB      CYS  33  -3.489  10.540   5.314
  247    HG   CYS  33           HG       CYS  33  -4.298  11.778   7.431
  248    H    LYS  34           H        LYS  34  -7.192   9.812   6.511
  249    HA   LYS  34           HA       LYS  34  -7.414   7.331   7.813
  250    HB2  LYS  34           1HB      LYS  34  -9.550   8.204   8.656
  251    HB3  LYS  34           2HB      LYS  34  -8.265   9.396   8.790
  252    HG2  LYS  34           1HG      LYS  34  -9.089  10.532   6.801
  253    HG3  LYS  34           2HG      LYS  34 -10.363   9.322   6.630
  254    HD2  LYS  34           1HD      LYS  34 -11.262   9.984   8.815
  255    HD3  LYS  34           2HD      LYS  34 -10.000  11.208   8.956
  256    HE2  LYS  34           1HE      LYS  34 -10.848  12.329   6.967
  257    HE3  LYS  34           2HE      LYS  34 -12.096  11.096   6.792
  258    HZ1  LYS  34           3HZ      LYS  34 -11.813  12.968   9.080
  259    HZ2  LYS  34           1HZ      LYS  34 -13.006  11.776   8.929
  260    HZ3  LYS  34           2HZ      LYS  34 -12.967  13.076   7.848
  261    H    MET  35           H        MET  35  -8.233   8.170   4.630
  262    HA   MET  35           HA       MET  35 -10.547   6.438   4.428
  263    HB2  MET  35           1HB      MET  35  -9.593   8.465   2.870
  264    HB3  MET  35           2HB      MET  35  -9.009   7.063   1.983
  265    HG2  MET  35           1HG      MET  35 -11.859   7.738   2.670
  266    HG3  MET  35           2HG      MET  35 -11.116   7.721   1.076
  267    HE1  MET  35           3HE      MET  35 -13.371   4.724   0.433
  268    HE2  MET  35           1HE      MET  35 -12.643   6.198  -0.203
  269    HE3  MET  35           2HE      MET  35 -13.773   6.284   1.150
  270    H    ILE  36           H        ILE  36  -7.098   6.317   3.888
  271    HA   ILE  36           HA       ILE  36  -7.123   3.760   2.621
  272    HB   ILE  36           HB       ILE  36  -5.115   5.759   3.329
  273   HG12  ILE  36          1HG1      ILE  36  -4.219   5.147   1.171
  274   HG13  ILE  36          2HG1      ILE  36  -5.207   3.691   1.138
  275   HG21  ILE  36          1HG2      ILE  36  -4.131   4.064   4.676
  276   HG22  ILE  36          2HG2      ILE  36  -3.218   4.148   3.169
  277   HG23  ILE  36          3HG2      ILE  36  -4.381   2.849   3.424
  278   HD11  ILE  36          3HD1      ILE  36  -6.201   6.522   1.060
  279   HD12  ILE  36          1HD1      ILE  36  -7.220   5.084   1.135
  280   HD13  ILE  36          2HD1      ILE  36  -6.186   5.363  -0.271
  281    H    ALA  37           H        ALA  37  -6.945   4.928   5.874
  282    HA   ALA  37           HA       ALA  37  -5.861   2.713   7.135
  283    HB1  ALA  37           1HB      ALA  37  -6.184   4.614   8.457
  284    HB2  ALA  37           2HB      ALA  37  -7.305   3.420   9.112
  285    HB3  ALA  37           3HB      ALA  37  -7.897   4.709   8.069
  286    HA   PRO  38           HA       PRO  38  -9.891   0.410   7.588
  287    HB2  PRO  38           1HB      PRO  38 -12.310   1.367   7.007
  288    HB3  PRO  38           2HB      PRO  38 -11.455   1.876   8.469
  289    HG2  PRO  38           1HG      PRO  38 -11.757   3.296   5.857
  290    HG3  PRO  38           2HG      PRO  38 -11.841   3.949   7.504
  291    HD2  PRO  38           1HD      PRO  38  -9.611   4.072   5.870
  292    HD3  PRO  38           2HD      PRO  38  -9.586   4.197   7.637
  293    H    MET  39           H        MET  39  -9.830   2.188   4.498
  294    HA   MET  39           HA       MET  39 -11.509   0.303   3.143
  295    HB2  MET  39           1HB      MET  39 -11.342   2.471   2.151
  296    HB3  MET  39           2HB      MET  39  -9.596   2.442   2.233
  297    HG2  MET  39           1HG      MET  39 -10.004   0.309   0.669
  298    HG3  MET  39           2HG      MET  39 -11.417   1.276   0.253
  299    HE1  MET  39           3HE      MET  39  -7.347   1.407   0.365
  300    HE2  MET  39           1HE      MET  39  -8.038   2.548   1.518
  301    HE3  MET  39           2HE      MET  39  -7.225   3.146   0.071
  302    H    ILE  40           H        ILE  40  -8.065   0.758   3.554
  303    HA   ILE  40           HA       ILE  40  -7.313  -1.394   1.826
  304    HB   ILE  40           HB       ILE  40  -6.067   0.753   3.212
  305   HG12  ILE  40          1HG1      ILE  40  -4.696  -1.123   1.314
  306   HG13  ILE  40          2HG1      ILE  40  -5.981  -0.049   0.770
  307   HG21  ILE  40          1HG2      ILE  40  -4.693  -1.896   3.640
  308   HG22  ILE  40          2HG2      ILE  40  -5.296  -0.800   4.885
  309   HG23  ILE  40          3HG2      ILE  40  -3.940  -0.316   3.868
  310   HD11  ILE  40          3HD1      ILE  40  -3.465   0.656   0.647
  311   HD12  ILE  40          1HD1      ILE  40  -3.743   1.104   2.328
  312   HD13  ILE  40          2HD1      ILE  40  -4.726   1.820   1.051
  313    H    GLU  41           H        GLU  41  -7.629  -0.964   5.342
  314    HA   GLU  41           HA       GLU  41  -6.808  -3.610   5.946
  315    HB2  GLU  41           1HB      GLU  41  -8.580  -1.694   7.482
  316    HB3  GLU  41           2HB      GLU  41  -8.071  -3.262   8.107
  317    HG2  GLU  41           1HG      GLU  41  -5.683  -2.416   7.603
  318    HG3  GLU  41           2HG      GLU  41  -6.433  -0.824   7.562
  319    H    LYS  42           H        LYS  42  -9.769  -2.259   4.764
  320    HA   LYS  42           HA       LYS  42 -11.481  -4.429   5.392
  321    HB2  LYS  42           1HB      LYS  42 -12.418  -2.261   4.924
  322    HB3  LYS  42           2HB      LYS  42 -11.695  -2.233   3.321
  323    HG2  LYS  42           1HG      LYS  42 -13.136  -4.090   2.645
  324    HG3  LYS  42           2HG      LYS  42 -13.853  -4.118   4.258
  325    HD2  LYS  42           1HD      LYS  42 -14.664  -1.836   3.942
  326    HD3  LYS  42           2HD      LYS  42 -13.927  -1.791   2.339
  327    HE2  LYS  42           1HE      LYS  42 -15.372  -3.632   1.626
  328    HE3  LYS  42           2HE      LYS  42 -16.107  -3.675   3.227
  329    HZ1  LYS  42           3HZ      LYS  42 -16.874  -1.401   2.877
  330    HZ2  LYS  42           1HZ      LYS  42 -17.482  -2.447   1.697
  331    HZ3  LYS  42           2HZ      LYS  42 -16.209  -1.404   1.321
  332    H    PHE  43           H        PHE  43  -9.474  -3.643   2.595
  333    HA   PHE  43           HA       PHE  43 -10.357  -5.532   0.766
  334    HB2  PHE  43           1HB      PHE  43  -7.490  -4.668   1.282
  335    HB3  PHE  43           2HB      PHE  43  -8.054  -5.511  -0.171
  336    HD1  PHE  43           2HD      PHE  43 -10.712  -3.948  -0.326
  337    HD2  PHE  43           1HD      PHE  43  -6.660  -2.760   0.176
  338    HE1  PHE  43           2HE      PHE  43 -11.229  -1.773  -1.343
  339    HE2  PHE  43           1HE      PHE  43  -7.173  -0.581  -0.836
  340    HZ   PHE  43           HZ       PHE  43  -9.459  -0.087  -1.593
  341    H    SER  44           H        SER  44  -7.588  -5.996   3.034
  342    HA   SER  44           HA       SER  44  -7.577  -8.812   2.503
  343    HB2  SER  44           1HB      SER  44  -6.079  -7.347   4.675
  344    HB3  SER  44           2HB      SER  44  -5.712  -8.924   3.971
  345    HG   SER  44           HG       SER  44  -4.408  -7.615   2.861
  346    H    GLU  45           H        GLU  45  -9.273  -6.800   4.694
  347    HA   GLU  45           HA       GLU  45  -9.838  -8.598   6.775
  348    HB2  GLU  45           1HB      GLU  45 -10.521  -6.196   6.727
  349    HB3  GLU  45           2HB      GLU  45 -11.717  -6.590   5.503
  350    HG2  GLU  45           1HG      GLU  45 -12.851  -8.061   7.104
  351    HG3  GLU  45           2HG      GLU  45 -11.665  -7.616   8.331
  352    H    GLN  46           H        GLN  46 -11.007  -8.312   3.500
  353    HA   GLN  46           HA       GLN  46 -12.881 -10.496   3.813
  354    HB2  GLN  46           1HB      GLN  46 -12.048  -8.906   1.386
  355    HB3  GLN  46           2HB      GLN  46 -13.316 -10.122   1.404
  356    HG2  GLN  46           1HG      GLN  46 -14.659  -8.797   2.868
  357    HG3  GLN  46           2HG      GLN  46 -13.350  -7.637   3.096
  358   HE21  GLN  46          1HE2      GLN  46 -12.560  -7.704   0.305
  359   HE22  GLN  46          2HE2      GLN  46 -13.762  -6.817  -0.560
  360    H    TYR  47           H        TYR  47  -9.856  -9.786   2.099
  361    HA   TYR  47           HA       TYR  47  -9.424 -12.678   1.872
  362    HB2  TYR  47           1HB      TYR  47  -8.160 -12.047  -0.298
  363    HB3  TYR  47           2HB      TYR  47  -9.913 -12.150  -0.313
  364    HD1  TYR  47           2HD      TYR  47  -7.075  -9.749  -0.213
  365    HD2  TYR  47           1HD      TYR  47 -11.241 -10.314  -0.876
  366    HE1  TYR  47           2HE      TYR  47  -7.235  -7.469  -1.143
  367    HE2  TYR  47           1HE      TYR  47 -11.409  -8.044  -1.793
  368    HH   TYR  47           HH       TYR  47  -8.737  -6.206  -2.669
  369    HA   PRO  48           HA       PRO  48  -5.829 -10.975   4.102
  370    HB2  PRO  48           1HB      PRO  48  -5.383 -13.133   5.641
  371    HB3  PRO  48           2HB      PRO  48  -6.628 -11.944   6.027
  372    HG2  PRO  48           1HG      PRO  48  -6.915 -14.616   4.710
  373    HG3  PRO  48           2HG      PRO  48  -7.925 -13.872   5.963
  374    HD2  PRO  48           1HD      PRO  48  -8.597 -13.889   3.323
  375    HD3  PRO  48           2HD      PRO  48  -9.097 -12.606   4.443
  376    H    GLN  49           H        GLN  49  -6.251 -13.338   1.809
  377    HA   GLN  49           HA       GLN  49  -3.788 -14.665   1.817
  378    HB2  GLN  49           1HB      GLN  49  -4.308 -15.141  -0.591
  379    HB3  GLN  49           2HB      GLN  49  -5.541 -15.627   0.558
  380    HG2  GLN  49           1HG      GLN  49  -6.934 -14.546  -0.763
  381    HG3  GLN  49           2HG      GLN  49  -6.239 -13.107  -0.024
  382   HE21  GLN  49          1HE2      GLN  49  -4.850 -11.817  -1.212
  383   HE22  GLN  49          2HE2      GLN  49  -4.620 -12.008  -2.912
  384    H    ALA  50           H        ALA  50  -4.541 -11.468   1.085
  385    HA   ALA  50           HA       ALA  50  -2.046 -11.088  -0.430
  386    HB1  ALA  50           1HB      ALA  50  -4.312  -9.170   0.135
  387    HB2  ALA  50           2HB      ALA  50  -4.016 -10.010  -1.388
  388    HB3  ALA  50           3HB      ALA  50  -2.871  -8.800  -0.810
  389    H    ASP  51           H        ASP  51  -0.500  -9.483   0.363
  390    HA   ASP  51           HA       ASP  51  -0.572  -9.517   3.270
  391    HB2  ASP  51           1HB      ASP  51   1.571  -9.824   1.465
  392    HB3  ASP  51           2HB      ASP  51   1.847  -8.306   2.315
  393    H    PHE  52           H        PHE  52  -0.337  -7.763   4.544
  394    HA   PHE  52           HA       PHE  52  -1.311  -5.309   3.256
  395    HB2  PHE  52           1HB      PHE  52  -2.326  -5.125   5.733
  396    HB3  PHE  52           2HB      PHE  52  -3.179  -5.916   4.413
  397    HD1  PHE  52           1HD      PHE  52  -1.018  -6.529   7.362
  398    HD2  PHE  52           2HD      PHE  52  -3.708  -8.203   4.523
  399    HE1  PHE  52           1HE      PHE  52  -1.107  -8.607   8.675
  400    HE2  PHE  52           2HE      PHE  52  -3.803 -10.283   5.830
  401    HZ   PHE  52           HZ       PHE  52  -2.501 -10.487   7.911
  402    H    TYR  53           H        TYR  53   0.125  -3.719   3.383
  403    HA   TYR  53           HA       TYR  53   1.475  -3.276   5.939
  404    HB2  TYR  53           1HB      TYR  53   2.923  -3.328   3.275
  405    HB3  TYR  53           2HB      TYR  53   3.624  -2.845   4.812
  406    HD1  TYR  53           2HD      TYR  53   3.973  -4.566   6.593
  407    HD2  TYR  53           1HD      TYR  53   2.761  -5.615   2.651
  408    HE1  TYR  53           2HE      TYR  53   4.690  -6.883   6.993
  409    HE2  TYR  53           1HE      TYR  53   3.477  -7.938   3.040
  410    HH   TYR  53           HH       TYR  53   4.194  -9.149   6.111
  411    H    LYS  54           H        LYS  54   2.158  -1.132   6.294
  412    HA   LYS  54           HA       LYS  54   1.209   0.904   4.443
  413    HB2  LYS  54           1HB      LYS  54  -0.366   1.851   6.004
  414    HB3  LYS  54           2HB      LYS  54  -0.754   0.152   5.753
  415    HG2  LYS  54           1HG      LYS  54   0.321  -0.409   7.869
  416    HG3  LYS  54           2HG      LYS  54   0.680   1.298   8.134
  417    HD2  LYS  54           1HD      LYS  54  -1.733   1.794   8.087
  418    HD3  LYS  54           2HD      LYS  54  -2.067   0.074   7.877
  419    HE2  LYS  54           1HE      LYS  54  -1.003  -0.397  10.023
  420    HE3  LYS  54           2HE      LYS  54  -0.650   1.316  10.232
  421    HZ1  LYS  54           3HZ      LYS  54  -3.049   1.744  10.211
  422    HZ2  LYS  54           1HZ      LYS  54  -2.604   0.712  11.475
  423    HZ3  LYS  54           2HZ      LYS  54  -3.349   0.086  10.094
  424    H    LEU  55           H        LEU  55   1.847   3.110   5.124
  425    HA   LEU  55           HA       LEU  55   3.639   3.394   7.355
  426    HB2  LEU  55           1HB      LEU  55   5.135   2.274   5.851
  427    HB3  LEU  55           2HB      LEU  55   4.688   3.332   4.531
  428    HG   LEU  55           HG       LEU  55   5.947   4.579   6.927
  429   HD11  LEU  55          1HD1      LEU  55   7.362   2.641   6.579
  430   HD12  LEU  55          2HD1      LEU  55   8.183   4.087   5.989
  431   HD13  LEU  55          3HD1      LEU  55   7.432   2.969   4.849
  432   HD21  LEU  55          3HD2      LEU  55   6.625   6.181   5.397
  433   HD22  LEU  55          1HD2      LEU  55   5.058   5.681   4.763
  434   HD23  LEU  55          2HD2      LEU  55   6.545   5.062   4.036
  435    H    ASP  56           H        ASP  56   4.197   5.568   7.790
  436    HA   ASP  56           HA       ASP  56   2.567   7.579   6.460
  437    HB2  ASP  56           1HB      ASP  56   4.337   7.674   8.911
  438    HB3  ASP  56           2HB      ASP  56   3.496   9.068   8.267
  439    H    VAL  57           H        VAL  57   3.429   8.484   4.660
  440    HA   VAL  57           HA       VAL  57   6.205   8.610   4.116
  441    HB   VAL  57           HB       VAL  57   4.679   8.621   2.280
  442   HG11  VAL  57          1HG1      VAL  57   3.120  10.440   1.906
  443   HG12  VAL  57          2HG1      VAL  57   3.634  11.185   3.420
  444   HG13  VAL  57          3HG1      VAL  57   2.820   9.625   3.439
  445   HG21  VAL  57          3HG2      VAL  57   6.023  11.314   2.521
  446   HG22  VAL  57          1HG2      VAL  57   5.397  10.617   1.025
  447   HG23  VAL  57          2HG2      VAL  57   6.736   9.839   1.868
  448    H    ASP  58           H        ASP  58   4.061  10.521   5.940
  449    HA   ASP  58           HA       ASP  58   5.272  12.998   6.104
  450    HB2  ASP  58           1HB      ASP  58   3.205  12.624   7.249
  451    HB3  ASP  58           2HB      ASP  58   3.902  11.331   8.219
  452    H    GLU  59           H        GLU  59   6.078  10.004   7.798
  453    HA   GLU  59           HA       GLU  59   8.362  11.311   9.056
  454    HB2  GLU  59           1HB      GLU  59   6.844   9.839  10.383
  455    HB3  GLU  59           2HB      GLU  59   7.366   8.478   9.400
  456    HG2  GLU  59           1HG      GLU  59   9.617   8.686  10.207
  457    HG3  GLU  59           2HG      GLU  59   9.214  10.169  11.065
  458    H    LEU  60           H        LEU  60   7.644   8.666   6.796
  459    HA   LEU  60           HA       LEU  60  10.529   8.475   6.247
  460    HB2  LEU  60           1HB      LEU  60   8.347   6.427   6.009
  461    HB3  LEU  60           2HB      LEU  60   9.895   6.225   5.227
  462    HG   LEU  60           HG       LEU  60  10.033   4.960   7.190
  463   HD11  LEU  60          1HD1      LEU  60  11.993   6.373   6.815
  464   HD12  LEU  60          2HD1      LEU  60  11.739   6.029   8.525
  465   HD13  LEU  60          3HD1      LEU  60  11.299   7.605   7.869
  466   HD21  LEU  60          3HD2      LEU  60   8.055   5.791   8.316
  467   HD22  LEU  60          1HD2      LEU  60   8.883   7.301   8.695
  468   HD23  LEU  60          2HD2      LEU  60   9.435   5.789   9.415
  469    H    GLY  61           H        GLY  61  10.153  10.394   4.885
  470    HA2  GLY  61           1HA      GLY  61   8.612  10.196   2.491
  471    HA3  GLY  61           2HA      GLY  61   9.831  11.412   2.845
  472    H    ASP  62           H        ASP  62  11.951   9.525   3.325
  473    HA   ASP  62           HA       ASP  62  12.935   9.237   0.689
  474    HB2  ASP  62           1HB      ASP  62  13.920   7.983   3.252
  475    HB3  ASP  62           2HB      ASP  62  14.812   8.000   1.737
  476    H    VAL  63           H        VAL  63  11.169   7.176   2.780
  477    HA   VAL  63           HA       VAL  63  11.626   4.750   1.355
  478    HB   VAL  63           HB       VAL  63   9.347   5.519   3.175
  479   HG11  VAL  63          1HG1      VAL  63   8.676   3.694   1.765
  480   HG12  VAL  63          2HG1      VAL  63   9.012   3.063   3.377
  481   HG13  VAL  63          3HG1      VAL  63  10.183   2.841   2.077
  482   HG21  VAL  63          3HG2      VAL  63  11.802   3.866   3.758
  483   HG22  VAL  63          1HG2      VAL  63  10.529   4.297   4.897
  484   HG23  VAL  63          2HG2      VAL  63  11.585   5.548   4.237
  485    H    ALA  64           H        ALA  64   8.899   7.050   1.455
  486    HA   ALA  64           HA       ALA  64   7.355   5.893  -0.540
  487    HB1  ALA  64           1HB      ALA  64   6.332   8.101  -0.792
  488    HB2  ALA  64           2HB      ALA  64   7.657   8.819   0.122
  489    HB3  ALA  64           3HB      ALA  64   6.558   7.683   0.905
  490    H    GLN  65           H        GLN  65  10.140   8.010  -0.788
  491    HA   GLN  65           HA       GLN  65   9.868   8.580  -3.565
  492    HB2  GLN  65           1HB      GLN  65  11.737   9.853  -3.258
  493    HB3  GLN  65           2HB      GLN  65  11.345   9.577  -1.575
  494    HG2  GLN  65           1HG      GLN  65  13.547   9.130  -1.510
  495    HG3  GLN  65           2HG      GLN  65  12.927   7.518  -1.847
  496   HE21  GLN  65          1HE2      GLN  65  14.538  10.310  -3.180
  497   HE22  GLN  65          2HE2      GLN  65  15.190   9.515  -4.570
  498    H    LYS  66           H        LYS  66  11.514   6.156  -1.703
  499    HA   LYS  66           HA       LYS  66  12.824   4.778  -3.722
  500    HB2  LYS  66           1HB      LYS  66  13.530   4.006  -1.710
  501    HB3  LYS  66           2HB      LYS  66  11.989   4.345  -0.937
  502    HG2  LYS  66           1HG      LYS  66  12.250   2.059  -0.752
  503    HG3  LYS  66           2HG      LYS  66  11.129   2.280  -2.086
  504    HD2  LYS  66           1HD      LYS  66  12.927   1.920  -3.690
  505    HD3  LYS  66           2HD      LYS  66  14.091   1.769  -2.372
  506    HE2  LYS  66           1HE      LYS  66  12.925  -0.211  -1.556
  507    HE3  LYS  66           2HE      LYS  66  11.730  -0.051  -2.841
  508    HZ1  LYS  66           3HZ      LYS  66  13.487  -0.404  -4.466
  509    HZ2  LYS  66           1HZ      LYS  66  13.395  -1.711  -3.392
  510    HZ3  LYS  66           2HZ      LYS  66  14.630  -0.564  -3.232
  511    H    ASN  67           H        ASN  67   9.464   5.038  -3.043
  512    HA   ASN  67           HA       ASN  67   8.855   2.478  -4.363
  513    HB2  ASN  67           1HB      ASN  67   7.030   4.249  -2.769
  514    HB3  ASN  67           2HB      ASN  67   6.748   2.581  -3.234
  515   HD21  ASN  67          1HD2      ASN  67   7.008   4.163  -0.707
  516   HD22  ASN  67          2HD2      ASN  67   8.024   3.206   0.279
  517    H    GLU  68           H        GLU  68   8.839   5.809  -4.828
  518    HA   GLU  68           HA       GLU  68   8.153   7.111  -6.538
  519    HB2  GLU  68           1HB      GLU  68   8.296   5.070  -7.978
  520    HB3  GLU  68           2HB      GLU  68   6.589   4.777  -7.637
  521    HG2  GLU  68           1HG      GLU  68   6.044   6.946  -8.662
  522    HG3  GLU  68           2HG      GLU  68   7.751   7.198  -9.021
  523    H    VAL  69           H        VAL  69   6.709   6.552  -3.995
  524    HA   VAL  69           HA       VAL  69   4.145   7.709  -4.832
  525    HB   VAL  69           HB       VAL  69   3.390   6.076  -3.435
  526   HG11  VAL  69          1HG1      VAL  69   5.434   5.025  -2.835
  527   HG12  VAL  69          2HG1      VAL  69   4.518   5.300  -1.360
  528   HG13  VAL  69          3HG1      VAL  69   5.883   6.348  -1.759
  529   HG21  VAL  69          3HG2      VAL  69   4.045   8.252  -1.456
  530   HG22  VAL  69          1HG2      VAL  69   2.845   6.980  -1.228
  531   HG23  VAL  69          2HG2      VAL  69   2.626   8.179  -2.501
  532    H    SER  70           H        SER  70   3.777   9.782  -4.528
  533    HA   SER  70           HA       SER  70   5.549  11.269  -2.711
  534    HB2  SER  70           1HB      SER  70   4.579  12.205  -5.422
  535    HB3  SER  70           2HB      SER  70   5.616  13.109  -4.321
  536    HG   SER  70           HG       SER  70   6.211  10.703  -5.703
  537    H    ALA  71           H        ALA  71   2.444  11.139  -4.382
  538    HA   ALA  71           HA       ALA  71   1.308  13.126  -2.589
  539    HB1  ALA  71           1HB      ALA  71   0.012  11.523  -4.795
  540    HB2  ALA  71           2HB      ALA  71   0.661  13.155  -4.954
  541    HB3  ALA  71           3HB      ALA  71  -0.728  12.856  -3.910
  542    H    MET  72           H        MET  72  -0.693  12.579  -1.384
  543    HA   MET  72           HA       MET  72  -0.956   9.751  -0.728
  544    HB2  MET  72           1HB      MET  72  -0.811  10.144   1.671
  545    HB3  MET  72           2HB      MET  72   0.684  10.611   0.882
  546    HG2  MET  72           1HG      MET  72  -1.471  12.570   1.608
  547    HG3  MET  72           2HG      MET  72  -0.154  12.138   2.692
  548    HE1  MET  72           3HE      MET  72   2.369  12.500   2.151
  549    HE2  MET  72           1HE      MET  72   2.984  13.441   0.788
  550    HE3  MET  72           2HE      MET  72   2.303  11.839   0.518
  551    HA   PRO  73           HA       PRO  73  -1.944   8.696   0.867
  552    HB2  PRO  73           1HB      PRO  73  -4.062   7.031   0.859
  553    HB3  PRO  73           2HB      PRO  73  -3.712   8.131   2.193
  554    HG2  PRO  73           1HG      PRO  73  -5.759   8.345   0.046
  555    HG3  PRO  73           2HG      PRO  73  -5.839   8.894   1.738
  556    HD2  PRO  73           1HD      PRO  73  -5.323  10.509  -0.486
  557    HD3  PRO  73           2HD      PRO  73  -4.965  10.932   1.198
  558    H    THR  74           H        THR  74  -1.211   6.896  -0.183
  559    HA   THR  74           HA       THR  74  -2.101   6.439  -2.951
  560    HB   THR  74           HB       THR  74   0.713   6.938  -1.982
  561    HG1  THR  74           1HG      THR  74   0.144   8.763  -2.895
  562   HG21  THR  74          3HG2      THR  74   0.995   4.930  -3.201
  563   HG22  THR  74          1HG2      THR  74   1.446   6.233  -4.299
  564   HG23  THR  74          2HG2      THR  74  -0.128   5.442  -4.467
  565    H    LEU  75           H        LEU  75  -2.245   4.400  -3.539
  566    HA   LEU  75           HA       LEU  75  -1.404   2.328  -1.630
  567    HB2  LEU  75           1HB      LEU  75  -3.348   2.158  -3.923
  568    HB3  LEU  75           2HB      LEU  75  -3.022   0.896  -2.751
  569    HG   LEU  75           HG       LEU  75  -3.841   2.877  -1.104
  570   HD11  LEU  75          1HD1      LEU  75  -4.333   4.391  -2.999
  571   HD12  LEU  75          2HD1      LEU  75  -5.776   3.984  -2.069
  572   HD13  LEU  75          3HD1      LEU  75  -5.485   3.207  -3.625
  573   HD21  LEU  75          3HD2      LEU  75  -6.059   1.719  -1.211
  574   HD22  LEU  75          1HD2      LEU  75  -4.658   0.667  -1.001
  575   HD23  LEU  75          2HD2      LEU  75  -5.431   0.803  -2.582
  576    H    LEU  76           H        LEU  76   0.193   0.956  -2.229
  577    HA   LEU  76           HA       LEU  76   0.807   0.783  -5.097
  578    HB2  LEU  76           1HB      LEU  76   2.499   1.623  -2.940
  579    HB3  LEU  76           2HB      LEU  76   3.141   0.153  -3.649
  580    HG   LEU  76           HG       LEU  76   2.474   2.657  -5.202
  581   HD11  LEU  76          1HD1      LEU  76   4.884   2.982  -5.384
  582   HD12  LEU  76          2HD1      LEU  76   5.155   1.566  -4.356
  583   HD13  LEU  76          3HD1      LEU  76   4.367   2.996  -3.691
  584   HD21  LEU  76          3HD2      LEU  76   3.636   1.562  -7.036
  585   HD22  LEU  76          1HD2      LEU  76   2.276   0.580  -6.494
  586   HD23  LEU  76          2HD2      LEU  76   3.920   0.139  -6.031
  587    H    LEU  77           H        LEU  77   0.284  -1.128  -5.816
  588    HA   LEU  77           HA       LEU  77   0.416  -3.482  -4.066
  589    HB2  LEU  77           1HB      LEU  77  -0.822  -2.979  -6.771
  590    HB3  LEU  77           2HB      LEU  77  -0.662  -4.583  -6.102
  591    HG   LEU  77           HG       LEU  77  -2.398  -4.295  -4.612
  592   HD11  LEU  77          1HD1      LEU  77  -2.059  -1.295  -4.789
  593   HD12  LEU  77          2HD1      LEU  77  -1.500  -2.308  -3.459
  594   HD13  LEU  77          3HD1      LEU  77  -3.225  -2.156  -3.786
  595   HD21  LEU  77          3HD2      LEU  77  -4.200  -3.277  -5.815
  596   HD22  LEU  77          1HD2      LEU  77  -3.123  -4.094  -6.954
  597   HD23  LEU  77          2HD2      LEU  77  -3.072  -2.330  -6.787
  598    H    PHE  78           H        PHE  78   2.014  -4.944  -4.302
  599    HA   PHE  78           HA       PHE  78   3.537  -4.923  -6.821
  600    HB2  PHE  78           1HB      PHE  78   4.597  -5.065  -4.012
  601    HB3  PHE  78           2HB      PHE  78   5.519  -5.662  -5.384
  602    HD1  PHE  78           2HD      PHE  78   4.009  -2.639  -3.897
  603    HD2  PHE  78           1HD      PHE  78   6.683  -4.204  -6.809
  604    HE1  PHE  78           2HE      PHE  78   4.893  -0.386  -4.303
  605    HE2  PHE  78           1HE      PHE  78   7.571  -1.950  -7.215
  606    HZ   PHE  78           HZ       PHE  78   6.673  -0.034  -5.960
  607    H    LYS  79           H        LYS  79   4.424  -6.971  -7.479
  608    HA   LYS  79           HA       LYS  79   3.842  -9.212  -5.682
  609    HB2  LYS  79           1HB      LYS  79   2.001  -9.042  -7.387
  610    HB3  LYS  79           2HB      LYS  79   3.205  -9.342  -8.630
  611    HG2  LYS  79           1HG      LYS  79   3.569 -11.535  -7.917
  612    HG3  LYS  79           2HG      LYS  79   2.798 -11.248  -6.357
  613    HD2  LYS  79           1HD      LYS  79   1.345 -12.568  -7.788
  614    HD3  LYS  79           2HD      LYS  79   0.634 -10.982  -7.491
  615    HE2  LYS  79           1HE      LYS  79   1.459 -10.224  -9.680
  616    HE3  LYS  79           2HE      LYS  79   2.125 -11.829  -9.973
  617    HZ1  LYS  79           3HZ      LYS  79  -0.022 -11.547 -11.043
  618    HZ2  LYS  79           1HZ      LYS  79  -0.749 -11.203  -9.552
  619    HZ3  LYS  79           2HZ      LYS  79  -0.106 -12.741  -9.849
  620    H    ASN  80           H        ASN  80   5.546 -10.406  -5.396
  621    HA   ASN  80           HA       ASN  80   7.690 -11.076  -5.408
  622    HB2  ASN  80           1HB      ASN  80   8.428 -12.286  -7.456
  623    HB3  ASN  80           2HB      ASN  80   6.861 -12.782  -6.835
  624   HD21  ASN  80          1HD2      ASN  80   5.072 -12.538  -8.107
  625   HD22  ASN  80          2HD2      ASN  80   5.141 -12.013  -9.755
  626    H    GLY  81           H        GLY  81   7.940  -8.488  -5.326
  627    HA2  GLY  81           1HA      GLY  81   9.727  -7.015  -5.461
  628    HA3  GLY  81           2HA      GLY  81  10.542  -8.176  -6.509
  629    H    LYS  82           H        LYS  82   7.546  -7.659  -7.767
  630    HA   LYS  82           HA       LYS  82   8.449  -5.374  -9.387
  631    HB2  LYS  82           1HB      LYS  82   6.674  -7.600 -10.389
  632    HB3  LYS  82           2HB      LYS  82   7.433  -6.329 -11.333
  633    HG2  LYS  82           1HG      LYS  82   9.649  -7.341 -10.713
  634    HG3  LYS  82           2HG      LYS  82   8.749  -8.703 -10.035
  635    HD2  LYS  82           1HD      LYS  82   8.642  -7.744 -12.896
  636    HD3  LYS  82           2HD      LYS  82   9.482  -9.179 -12.314
  637    HE2  LYS  82           1HE      LYS  82   7.370 -10.163 -11.624
  638    HE3  LYS  82           2HE      LYS  82   6.510  -8.707 -12.120
  639    HZ1  LYS  82           3HZ      LYS  82   6.343 -10.426 -13.793
  640    HZ2  LYS  82           1HZ      LYS  82   8.026 -10.517 -13.917
  641    HZ3  LYS  82           2HZ      LYS  82   7.215  -9.112 -14.397
  642    H    GLU  83           H        GLU  83   6.586  -4.110 -10.240
  643    HA   GLU  83           HA       GLU  83   4.664  -3.656  -8.185
  644    HB2  GLU  83           1HB      GLU  83   5.679  -1.967  -9.817
  645    HB3  GLU  83           2HB      GLU  83   4.586  -2.623 -11.023
  646    HG2  GLU  83           1HG      GLU  83   2.671  -1.886  -9.797
  647    HG3  GLU  83           2HG      GLU  83   3.681  -1.424  -8.419
  648    H    VAL  84           H        VAL  84   2.257  -3.476  -8.934
  649    HA   VAL  84           HA       VAL  84   1.525  -5.098 -11.205
  650    HB   VAL  84           HB       VAL  84  -0.449  -6.053  -9.807
  651   HG11  VAL  84          1HG1      VAL  84   0.790  -8.107  -9.377
  652   HG12  VAL  84          2HG1      VAL  84   2.312  -7.240  -9.585
  653   HG13  VAL  84          3HG1      VAL  84   1.211  -7.432 -10.951
  654   HG21  VAL  84          3HG2      VAL  84   0.167  -6.617  -7.526
  655   HG22  VAL  84          1HG2      VAL  84   0.109  -4.873  -7.772
  656   HG23  VAL  84          2HG2      VAL  84   1.663  -5.701  -7.706
  657    H    ALA  85           H        ALA  85   0.766  -2.789  -8.712
  658    HA   ALA  85           HA       ALA  85  -0.654  -1.175 -10.545
  659    HB1  ALA  85           1HB      ALA  85  -2.479  -2.680 -10.181
  660    HB2  ALA  85           2HB      ALA  85  -2.835  -1.164  -9.350
  661    HB3  ALA  85           3HB      ALA  85  -2.275  -2.564  -8.437
  662    H    LYS  86           H        LYS  86  -1.056   0.925  -9.778
  663    HA   LYS  86           HA       LYS  86  -0.527   1.483  -6.967
  664    HB2  LYS  86           1HB      LYS  86   1.063   3.279  -7.490
  665    HB3  LYS  86           2HB      LYS  86   1.664   1.713  -8.010
  666    HG2  LYS  86           1HG      LYS  86   0.808   2.309 -10.318
  667    HG3  LYS  86           2HG      LYS  86   0.594   3.948  -9.702
  668    HD2  LYS  86           1HD      LYS  86   3.178   2.388  -9.794
  669    HD3  LYS  86           2HD      LYS  86   2.734   3.733 -10.844
  670    HE2  LYS  86           1HE      LYS  86   3.089   3.885  -7.852
  671    HE3  LYS  86           2HE      LYS  86   4.270   4.413  -9.049
  672    HZ1  LYS  86           3HZ      LYS  86   2.610   6.003  -9.869
  673    HZ2  LYS  86           1HZ      LYS  86   3.024   6.285  -8.255
  674    HZ3  LYS  86           2HZ      LYS  86   1.559   5.539  -8.634
  675    H    VAL  87           H        VAL  87  -1.901   2.973  -6.183
  676    HA   VAL  87           HA       VAL  87  -3.389   4.649  -8.095
  677    HB   VAL  87           HB       VAL  87  -4.705   3.032  -5.906
  678   HG11  VAL  87          1HG1      VAL  87  -5.895   4.807  -8.036
  679   HG12  VAL  87          2HG1      VAL  87  -5.794   5.177  -6.315
  680   HG13  VAL  87          3HG1      VAL  87  -6.802   3.842  -6.871
  681   HG21  VAL  87          3HG2      VAL  87  -4.795   2.660  -8.900
  682   HG22  VAL  87          1HG2      VAL  87  -5.770   1.774  -7.729
  683   HG23  VAL  87          2HG2      VAL  87  -4.016   1.586  -7.738
  684    H    VAL  88           H        VAL  88  -3.726   6.672  -7.436
  685    HA   VAL  88           HA       VAL  88  -2.895   7.341  -4.707
  686    HB   VAL  88           HB       VAL  88  -1.654   8.479  -6.454
  687   HG11  VAL  88          1HG1      VAL  88  -2.710  10.063  -7.986
  688   HG12  VAL  88          2HG1      VAL  88  -4.296   9.591  -7.376
  689   HG13  VAL  88          3HG1      VAL  88  -3.294   8.418  -8.232
  690   HG21  VAL  88          3HG2      VAL  88  -1.993  10.819  -5.764
  691   HG22  VAL  88          1HG2      VAL  88  -1.980   9.705  -4.395
  692   HG23  VAL  88          2HG2      VAL  88  -3.509  10.353  -4.990
  693    H    GLY  89           H        GLY  89  -5.186   6.243  -4.418
  694    HA2  GLY  89           1HA      GLY  89  -6.838   8.132  -3.258
  695    HA3  GLY  89           2HA      GLY  89  -7.469   7.878  -4.877
  696    H    ALA  90           H        ALA  90  -8.054   7.087  -1.872
  697    HA   ALA  90           HA       ALA  90  -8.352   4.305  -1.808
  698    HB1  ALA  90           1HB      ALA  90 -10.085   6.295  -0.388
  699    HB2  ALA  90           2HB      ALA  90  -8.431   5.947   0.094
  700    HB3  ALA  90           3HB      ALA  90  -9.649   4.662   0.133
  701    H    ASN  91           H        ASN  91  -9.449   3.290  -3.411
  702    HA   ASN  91           HA       ASN  91 -12.218   4.179  -3.816
  703    HB2  ASN  91           1HB      ASN  91 -10.263   3.916  -5.754
  704    HB3  ASN  91           2HB      ASN  91 -11.184   2.417  -5.891
  705   HD21  ASN  91          1HD2      ASN  91 -12.545   5.442  -4.786
  706   HD22  ASN  91          2HD2      ASN  91 -13.603   5.669  -6.129
  707    HA   PRO  92           HA       PRO  92 -12.606   0.573  -1.048
  708    HB2  PRO  92           1HB      PRO  92 -15.375   1.231  -1.986
  709    HB3  PRO  92           2HB      PRO  92 -14.830   0.722  -0.383
  710    HG2  PRO  92           1HG      PRO  92 -15.273   3.298  -0.934
  711    HG3  PRO  92           2HG      PRO  92 -13.944   2.791   0.124
  712    HD2  PRO  92           1HD      PRO  92 -13.841   3.923  -2.593
  713    HD3  PRO  92           2HD      PRO  92 -12.572   3.834  -1.360
  714    H    ALA  93           H        ALA  93 -14.779   0.673  -3.895
  715    HA   ALA  93           HA       ALA  93 -14.822  -2.205  -3.910
  716    HB1  ALA  93           1HB      ALA  93 -16.853  -0.872  -4.337
  717    HB2  ALA  93           2HB      ALA  93 -16.492  -2.006  -5.639
  718    HB3  ALA  93           3HB      ALA  93 -16.127  -0.292  -5.837
  719    H    ALA  94           H        ALA  94 -13.677   0.327  -6.102
  720    HA   ALA  94           HA       ALA  94 -12.896  -1.420  -8.180
  721    HB1  ALA  94           1HB      ALA  94 -11.700   0.482  -9.097
  722    HB2  ALA  94           2HB      ALA  94 -11.836   1.336  -7.560
  723    HB3  ALA  94           3HB      ALA  94 -13.284   0.985  -8.505
  724    H    ILE  95           H        ILE  95 -11.273  -0.377  -5.254
  725    HA   ILE  95           HA       ILE  95  -8.741  -1.395  -6.250
  726    HB   ILE  95           HB       ILE  95  -9.357  -0.285  -3.514
  727   HG12  ILE  95          1HG1      ILE  95  -9.628   1.433  -5.206
  728   HG13  ILE  95          2HG1      ILE  95  -8.127   1.717  -4.334
  729   HG21  ILE  95          1HG2      ILE  95  -7.440  -1.812  -3.549
  730   HG22  ILE  95          2HG2      ILE  95  -6.943  -0.149  -3.248
  731   HG23  ILE  95          3HG2      ILE  95  -6.710  -0.861  -4.845
  732   HD11  ILE  95          3HD1      ILE  95  -6.878   0.713  -6.180
  733   HD12  ILE  95          1HD1      ILE  95  -7.836   2.097  -6.702
  734   HD13  ILE  95          2HD1      ILE  95  -8.388   0.461  -7.054
  735    H    LYS  96           H        LYS  96 -11.273  -2.336  -3.965
  736    HA   LYS  96           HA       LYS  96 -10.054  -4.695  -3.053
  737    HB2  LYS  96           1HB      LYS  96 -11.986  -4.319  -1.889
  738    HB3  LYS  96           2HB      LYS  96 -12.870  -3.749  -3.313
  739    HG2  LYS  96           1HG      LYS  96 -12.883  -6.179  -4.069
  740    HG3  LYS  96           2HG      LYS  96 -12.319  -6.570  -2.446
  741    HD2  LYS  96           1HD      LYS  96 -14.621  -6.797  -2.258
  742    HD3  LYS  96           2HD      LYS  96 -14.337  -5.166  -1.650
  743    HE2  LYS  96           1HE      LYS  96 -16.177  -4.957  -3.087
  744    HE3  LYS  96           2HE      LYS  96 -14.805  -4.384  -4.033
  745    HZ1  LYS  96           3HZ      LYS  96 -16.097  -7.048  -4.214
  746    HZ2  LYS  96           1HZ      LYS  96 -14.691  -6.619  -5.047
  747    HZ3  LYS  96           2HZ      LYS  96 -16.144  -5.822  -5.374
  748    H    GLN  97           H        GLN  97 -11.899  -3.979  -5.971
  749    HA   GLN  97           HA       GLN  97 -11.665  -6.560  -7.116
  750    HB2  GLN  97           1HB      GLN  97 -12.173  -3.828  -8.296
  751    HB3  GLN  97           2HB      GLN  97 -12.084  -5.281  -9.288
  752    HG2  GLN  97           1HG      GLN  97 -14.026  -4.776  -7.048
  753    HG3  GLN  97           2HG      GLN  97 -14.382  -4.718  -8.773
  754   HE21  GLN  97          1HE2      GLN  97 -12.709  -7.025  -9.381
  755   HE22  GLN  97          2HE2      GLN  97 -13.564  -8.413  -8.808
  756    H    ALA  98           H        ALA  98  -9.524  -3.819  -6.917
  757    HA   ALA  98           HA       ALA  98  -7.755  -4.587  -8.989
  758    HB1  ALA  98           1HB      ALA  98  -7.167  -2.968  -6.522
  759    HB2  ALA  98           2HB      ALA  98  -7.764  -2.326  -8.051
  760    HB3  ALA  98           3HB      ALA  98  -6.168  -3.070  -7.971
  761    H    ILE  99           H        ILE  99  -7.460  -4.860  -5.464
  762    HA   ILE  99           HA       ILE  99  -5.135  -6.313  -5.327
  763    HB   ILE  99           HB       ILE  99  -7.421  -6.951  -3.456
  764   HG12  ILE  99          1HG1      ILE  99  -7.588  -4.607  -3.501
  765   HG13  ILE  99          2HG1      ILE  99  -6.564  -4.956  -2.109
  766   HG21  ILE  99          1HG2      ILE  99  -4.433  -6.759  -3.179
  767   HG22  ILE  99          2HG2      ILE  99  -5.437  -8.205  -3.068
  768   HG23  ILE  99          3HG2      ILE  99  -5.531  -6.966  -1.816
  769   HD11  ILE  99          3HD1      ILE  99  -5.656  -3.103  -3.279
  770   HD12  ILE  99          1HD1      ILE  99  -5.722  -3.980  -4.812
  771   HD13  ILE  99          2HD1      ILE  99  -4.597  -4.489  -3.544
  772    H    ALA 100           H        ALA 100  -8.407  -7.424  -5.984
  773    HA   ALA 100           HA       ALA 100  -7.794 -10.221  -5.807
  774    HB1  ALA 100           1HB      ALA 100 -10.053 -10.564  -6.637
  775    HB2  ALA 100           2HB      ALA 100 -10.181  -8.851  -7.036
  776    HB3  ALA 100           3HB      ALA 100 -10.038  -9.356  -5.353
  777    H    ALA 101           H        ALA 101  -7.461  -7.825  -8.275
  778    HA   ALA 101           HA       ALA 101  -7.533  -9.759 -10.448
  779    HB1  ALA 101           1HB      ALA 101  -8.547  -7.531 -10.747
  780    HB2  ALA 101           2HB      ALA 101  -7.246  -7.833 -11.898
  781    HB3  ALA 101           3HB      ALA 101  -6.960  -6.796 -10.498
  782    H    ASN 102           H        ASN 102  -5.287  -7.827  -8.595
  783    HA   ASN 102           HA       ASN 102  -3.092  -8.528 -10.346
  784    HB2  ASN 102           1HB      ASN 102  -1.790  -7.147  -8.519
  785    HB3  ASN 102           2HB      ASN 102  -2.773  -6.377  -9.721
  786   HD21  ASN 102          1HD2      ASN 102  -4.358  -5.074  -9.141
  787   HD22  ASN 102          2HD2      ASN 102  -4.820  -4.805  -7.507
  788    H    ALA 103           H        ALA 103  -4.463  -9.741  -7.455
  789    HA   ALA 103           HA       ALA 103  -2.100 -11.010  -6.472
  790    HB1  ALA 103           1HB      ALA 103  -4.998 -11.660  -5.938
  791    HB2  ALA 103           2HB      ALA 103  -3.989 -10.567  -4.992
  792    HB3  ALA 103           3HB      ALA 103  -3.620 -12.291  -5.038
  Start of MODEL   17
    1    H1   MET   1           1H       MET   1  -6.576  -6.016   9.800
    2    H2   MET   1           2H       MET   1  -6.733  -6.089  11.480
    3    H3   MET   1           3H       MET   1  -5.495  -6.946  10.706
    4    HA   MET   1           HA       MET   1  -5.766  -4.006  10.801
    5    HB2  MET   1           1HB      MET   1  -3.852  -4.001  12.266
    6    HB3  MET   1           2HB      MET   1  -5.083  -5.041  12.962
    7    HG2  MET   1           1HG      MET   1  -2.687  -5.997  11.410
    8    HG3  MET   1           2HG      MET   1  -2.807  -5.951  13.166
    9    HE1  MET   1           3HE      MET   1  -4.630  -7.364  14.537
   10    HE2  MET   1           1HE      MET   1  -5.745  -8.503  13.781
   11    HE3  MET   1           2HE      MET   1  -5.919  -6.773  13.485
   12    H    VAL   2           H        VAL   2  -3.621  -3.003  10.140
   13    HA   VAL   2           HA       VAL   2  -2.409  -4.527   7.939
   14    HB   VAL   2           HB       VAL   2  -3.140  -1.602   8.060
   15   HG11  VAL   2          1HG1      VAL   2  -2.107  -1.401   5.844
   16   HG12  VAL   2          2HG1      VAL   2  -1.497  -3.049   5.992
   17   HG13  VAL   2          3HG1      VAL   2  -0.925  -1.797   7.091
   18   HG21  VAL   2          3HG2      VAL   2  -3.947  -3.823   6.192
   19   HG22  VAL   2          1HG2      VAL   2  -4.422  -2.134   6.042
   20   HG23  VAL   2          2HG2      VAL   2  -4.953  -3.077   7.431
   21    H    THR   3           H        THR   3  -0.240  -4.620   7.896
   22    HA   THR   3           HA       THR   3   1.072  -4.057  10.380
   23    HB   THR   3           HB       THR   3   2.333  -5.180   7.879
   24    HG1  THR   3           1HG      THR   3   1.026  -6.819   8.119
   25   HG21  THR   3          3HG2      THR   3   3.866  -4.619   9.721
   26   HG22  THR   3          1HG2      THR   3   3.777  -6.360   9.459
   27   HG23  THR   3          2HG2      THR   3   2.915  -5.628  10.811
   28    H    GLN   4           H        GLN   4   2.873  -2.828  10.754
   29    HA   GLN   4           HA       GLN   4   3.044  -0.448   9.079
   30    HB2  GLN   4           1HB      GLN   4   2.570  -0.284  11.499
   31    HB3  GLN   4           2HB      GLN   4   4.122  -1.024  11.839
   32    HG2  GLN   4           1HG      GLN   4   4.147   1.416  12.118
   33    HG3  GLN   4           2HG      GLN   4   5.298   0.844  10.913
   34   HE21  GLN   4          1HE2      GLN   4   1.867   1.080  10.324
   35   HE22  GLN   4          2HE2      GLN   4   1.969   2.368   9.173
   36    H    PHE   5           H        PHE   5   4.850   0.170   8.009
   37    HA   PHE   5           HA       PHE   5   7.208  -1.541   8.044
   38    HB2  PHE   5           1HB      PHE   5   6.432   0.886   6.439
   39    HB3  PHE   5           2HB      PHE   5   8.052   0.214   6.377
   40    HD1  PHE   5           1HD      PHE   5   7.137  -2.731   6.522
   41    HD2  PHE   5           2HD      PHE   5   5.891   0.593   4.178
   42    HE1  PHE   5           1HE      PHE   5   6.456  -4.259   4.725
   43    HE2  PHE   5           2HE      PHE   5   5.199  -0.932   2.378
   44    HZ   PHE   5           HZ       PHE   5   5.483  -3.362   2.649
   45    H    LYS   6           H        LYS   6   9.378  -0.541   8.306
   46    HA   LYS   6           HA       LYS   6   9.314   1.926   9.865
   47    HB2  LYS   6           1HB      LYS   6  10.983   1.061  11.435
   48    HB3  LYS   6           2HB      LYS   6   9.492   0.140  11.486
   49    HG2  LYS   6           1HG      LYS   6  10.663  -1.498   9.915
   50    HG3  LYS   6           2HG      LYS   6  12.149  -0.662  10.367
   51    HD2  LYS   6           1HD      LYS   6  10.223  -2.056  12.227
   52    HD3  LYS   6           2HD      LYS   6  11.838  -2.605  11.781
   53    HE2  LYS   6           1HE      LYS   6  12.831  -0.701  12.887
   54    HE3  LYS   6           2HE      LYS   6  11.239  -0.032  13.235
   55    HZ1  LYS   6           3HZ      LYS   6  12.129  -1.120  15.172
   56    HZ2  LYS   6           1HZ      LYS   6  12.345  -2.564  14.318
   57    HZ3  LYS   6           2HZ      LYS   6  10.786  -1.980  14.613
   58    H    THR   7           H        THR   7  10.803   0.082   7.395
   59    HA   THR   7           HA       THR   7  12.388   2.443   6.758
   60    HB   THR   7           HB       THR   7  14.393   1.213   6.156
   61    HG1  THR   7           1HG      THR   7  13.331  -1.124   7.375
   62   HG21  THR   7          3HG2      THR   7  15.234   0.556   8.355
   63   HG22  THR   7          1HG2      THR   7  13.587   0.532   8.984
   64   HG23  THR   7          2HG2      THR   7  14.306   2.052   8.452
   65    H    ALA   8           H        ALA   8  13.362   2.142   4.458
   66    HA   ALA   8           HA       ALA   8  11.320   1.272   2.672
   67    HB1  ALA   8           1HB      ALA   8  12.871   1.824   0.890
   68    HB2  ALA   8           2HB      ALA   8  14.184   1.971   2.055
   69    HB3  ALA   8           3HB      ALA   8  12.837   3.106   2.096
   70    H    SER   9           H        SER   9  14.086  -0.188   4.135
   71    HA   SER   9           HA       SER   9  14.429  -2.421   2.484
   72    HB2  SER   9           1HB      SER   9  15.983  -1.834   4.312
   73    HB3  SER   9           2HB      SER   9  14.739  -2.232   5.495
   74    HG   SER   9           HG       SER   9  15.590  -4.125   3.576
   75    H    GLU  10           H        GLU  10  12.367  -2.022   5.391
   76    HA   GLU  10           HA       GLU  10  10.926  -4.339   5.280
   77    HB2  GLU  10           1HB      GLU  10  10.359  -1.557   6.148
   78    HB3  GLU  10           2HB      GLU  10   9.022  -2.696   6.073
   79    HG2  GLU  10           1HG      GLU  10  10.038  -2.571   8.284
   80    HG3  GLU  10           2HG      GLU  10  10.132  -4.173   7.573
   81    H    PHE  11           H        PHE  11  10.363  -1.351   3.400
   82    HA   PHE  11           HA       PHE  11   8.007  -2.178   2.142
   83    HB2  PHE  11           1HB      PHE  11   9.005   0.146   2.031
   84    HB3  PHE  11           2HB      PHE  11  10.141  -0.470   0.836
   85    HD1  PHE  11           2HD      PHE  11   9.243  -1.355  -1.341
   86    HD2  PHE  11           1HD      PHE  11   6.818   0.826   1.402
   87    HE1  PHE  11           2HE      PHE  11   7.620  -0.898  -3.131
   88    HE2  PHE  11           1HE      PHE  11   5.185   1.300  -0.415
   89    HZ   PHE  11           HZ       PHE  11   5.606   0.424  -2.665
   90    H    ASP  12           H        ASP  12  11.326  -2.378   0.886
   91    HA   ASP  12           HA       ASP  12  10.792  -3.916  -1.389
   92    HB2  ASP  12           1HB      ASP  12  13.242  -3.588   0.317
   93    HB3  ASP  12           2HB      ASP  12  13.235  -4.741  -1.011
   94    H    SER  13           H        SER  13  11.473  -4.948   1.920
   95    HA   SER  13           HA       SER  13  11.774  -7.684   1.431
   96    HB2  SER  13           1HB      SER  13  12.352  -6.554   3.570
   97    HB3  SER  13           2HB      SER  13  10.633  -6.374   3.913
   98    HG   SER  13           HG       SER  13  10.469  -8.459   4.338
   99    H    ALA  14           H        ALA  14   8.867  -5.796   2.218
  100    HA   ALA  14           HA       ALA  14   7.098  -7.985   2.132
  101    HB1  ALA  14           1HB      ALA  14   6.540  -5.861   3.227
  102    HB2  ALA  14           2HB      ALA  14   5.323  -6.327   2.039
  103    HB3  ALA  14           3HB      ALA  14   6.499  -5.070   1.651
  104    H    ILE  15           H        ILE  15   8.377  -5.804  -0.268
  105    HA   ILE  15           HA       ILE  15   6.594  -6.395  -2.377
  106    HB   ILE  15           HB       ILE  15   9.449  -5.477  -2.567
  107   HG12  ILE  15          1HG1      ILE  15   8.436  -3.765  -1.365
  108   HG13  ILE  15          2HG1      ILE  15   8.255  -3.251  -3.037
  109   HG21  ILE  15          1HG2      ILE  15   9.034  -4.813  -4.760
  110   HG22  ILE  15          2HG2      ILE  15   7.293  -5.009  -4.577
  111   HG23  ILE  15          3HG2      ILE  15   8.334  -6.428  -4.633
  112   HD11  ILE  15          3HD1      ILE  15   6.226  -2.861  -1.757
  113   HD12  ILE  15          1HD1      ILE  15   6.130  -4.579  -1.371
  114   HD13  ILE  15          2HD1      ILE  15   5.954  -4.039  -3.041
  115    H    ALA  16           H        ALA  16   9.619  -7.837  -1.331
  116    HA   ALA  16           HA       ALA  16  10.036  -9.296  -3.749
  117    HB1  ALA  16           1HB      ALA  16  11.389  -9.576  -1.074
  118    HB2  ALA  16           2HB      ALA  16  11.899  -8.519  -2.391
  119    HB3  ALA  16           3HB      ALA  16  11.949 -10.269  -2.596
  120    H    GLN  17           H        GLN  17   7.712  -9.824  -1.615
  121    HA   GLN  17           HA       GLN  17   7.984 -12.651  -1.238
  122    HB2  GLN  17           1HB      GLN  17   5.569 -10.871  -0.906
  123    HB3  GLN  17           2HB      GLN  17   5.772 -12.489  -0.281
  124    HG2  GLN  17           1HG      GLN  17   7.681 -11.647   1.078
  125    HG3  GLN  17           2HG      GLN  17   7.228 -10.021   0.566
  126   HE21  GLN  17          1HE2      GLN  17   5.234  -9.166   1.254
  127   HE22  GLN  17          2HE2      GLN  17   4.409  -9.801   2.644
  128    H    ASP  18           H        ASP  18   6.807 -14.248  -2.318
  129    HA   ASP  18           HA       ASP  18   6.140 -13.627  -5.053
  130    HB2  ASP  18           1HB      ASP  18   6.087 -16.208  -3.479
  131    HB3  ASP  18           2HB      ASP  18   5.629 -16.099  -5.175
  132    H    LYS  19           H        LYS  19   4.458 -12.263  -3.347
  133    HA   LYS  19           HA       LYS  19   1.859 -13.457  -3.960
  134    HB2  LYS  19           1HB      LYS  19   1.024 -12.953  -1.692
  135    HB3  LYS  19           2HB      LYS  19   2.316 -14.144  -1.660
  136    HG2  LYS  19           1HG      LYS  19   3.905 -12.420  -1.004
  137    HG3  LYS  19           2HG      LYS  19   2.625 -11.212  -1.058
  138    HD2  LYS  19           1HD      LYS  19   2.829 -11.752   1.209
  139    HD3  LYS  19           2HD      LYS  19   1.419 -12.655   0.663
  140    HE2  LYS  19           1HE      LYS  19   4.164 -13.877   0.774
  141    HE3  LYS  19           2HE      LYS  19   3.090 -13.864   2.168
  142    HZ1  LYS  19           3HZ      LYS  19   1.421 -14.990   0.673
  143    HZ2  LYS  19           1HZ      LYS  19   2.769 -15.914   1.105
  144    HZ3  LYS  19           2HZ      LYS  19   2.684 -15.223  -0.428
  145    H    LEU  20           H        LEU  20   0.102 -11.730  -3.291
  146    HA   LEU  20           HA       LEU  20   0.868  -9.271  -4.579
  147    HB2  LEU  20           1HB      LEU  20  -1.354 -10.479  -4.865
  148    HB3  LEU  20           2HB      LEU  20  -1.787  -9.881  -3.278
  149    HG   LEU  20           HG       LEU  20  -2.689  -8.585  -5.260
  150   HD11  LEU  20          1HD1      LEU  20  -0.997  -7.047  -3.298
  151   HD12  LEU  20          2HD1      LEU  20  -2.627  -7.651  -3.000
  152   HD13  LEU  20          3HD1      LEU  20  -2.356  -6.418  -4.230
  153   HD21  LEU  20          3HD2      LEU  20  -0.672  -8.656  -6.629
  154   HD22  LEU  20          1HD2      LEU  20   0.173  -7.664  -5.440
  155   HD23  LEU  20          2HD2      LEU  20  -1.193  -6.995  -6.332
  156    H    VAL  21           H        VAL  21   1.645  -7.577  -3.585
  157    HA   VAL  21           HA       VAL  21   1.372  -7.371  -0.672
  158    HB   VAL  21           HB       VAL  21   3.097  -5.529  -2.263
  159   HG11  VAL  21          1HG1      VAL  21   4.527  -5.684  -0.281
  160   HG12  VAL  21          2HG1      VAL  21   3.408  -6.847   0.430
  161   HG13  VAL  21          3HG1      VAL  21   2.885  -5.190   0.127
  162   HG21  VAL  21          3HG2      VAL  21   3.749  -7.541  -3.293
  163   HG22  VAL  21          1HG2      VAL  21   3.694  -8.432  -1.768
  164   HG23  VAL  21          2HG2      VAL  21   4.954  -7.234  -2.043
  165    H    VAL  22           H        VAL  22  -0.096  -5.998   0.119
  166    HA   VAL  22           HA       VAL  22  -0.988  -3.749  -1.552
  167    HB   VAL  22           HB       VAL  22  -2.205  -4.741   1.034
  168   HG11  VAL  22          1HG1      VAL  22  -2.722  -2.420   0.535
  169   HG12  VAL  22          2HG1      VAL  22  -4.156  -3.427   0.329
  170   HG13  VAL  22          3HG1      VAL  22  -3.259  -2.869  -1.084
  171   HG21  VAL  22          3HG2      VAL  22  -3.947  -5.766  -0.357
  172   HG22  VAL  22          1HG2      VAL  22  -2.361  -6.487  -0.635
  173   HG23  VAL  22          2HG2      VAL  22  -3.026  -5.341  -1.802
  174    H    VAL  23           H        VAL  23   0.429  -2.112  -1.234
  175    HA   VAL  23           HA       VAL  23   1.221  -1.567   1.530
  176    HB   VAL  23           HB       VAL  23   2.484  -0.520  -1.004
  177   HG11  VAL  23          1HG1      VAL  23   4.306   0.073   0.679
  178   HG12  VAL  23          2HG1      VAL  23   3.067  -0.143   1.914
  179   HG13  VAL  23          3HG1      VAL  23   2.861   1.077   0.658
  180   HG21  VAL  23          3HG2      VAL  23   2.888  -2.890  -0.754
  181   HG22  VAL  23          1HG2      VAL  23   3.349  -2.657   0.934
  182   HG23  VAL  23          2HG2      VAL  23   4.358  -1.997  -0.357
  183    H    ALA  24           H        ALA  24   0.315  -0.072   2.551
  184    HA   ALA  24           HA       ALA  24  -1.376   1.914   1.191
  185    HB1  ALA  24           1HB      ALA  24  -2.405   2.189   3.350
  186    HB2  ALA  24           2HB      ALA  24  -1.128   1.265   4.134
  187    HB3  ALA  24           3HB      ALA  24  -2.243   0.460   3.036
  188    H    PHE  25           H        PHE  25   0.160   3.532   0.578
  189    HA   PHE  25           HA       PHE  25   1.710   4.689   2.781
  190    HB2  PHE  25           1HB      PHE  25   2.077   4.546  -0.110
  191    HB3  PHE  25           2HB      PHE  25   2.404   6.142   0.567
  192    HD1  PHE  25           2HD      PHE  25   2.978   2.635   1.655
  193    HD2  PHE  25           1HD      PHE  25   4.622   6.494   1.001
  194    HE1  PHE  25           2HE      PHE  25   5.148   1.837   2.474
  195    HE2  PHE  25           1HE      PHE  25   6.799   5.710   1.831
  196    HZ   PHE  25           HZ       PHE  25   7.059   3.376   2.568
  197    H    TYR  26           H        TYR  26   1.105   6.423   3.792
  198    HA   TYR  26           HA       TYR  26  -0.336   8.517   2.415
  199    HB2  TYR  26           1HB      TYR  26  -2.135   8.609   4.118
  200    HB3  TYR  26           2HB      TYR  26  -2.195   7.155   3.133
  201    HD1  TYR  26           1HD      TYR  26  -1.659   4.974   4.104
  202    HD2  TYR  26           2HD      TYR  26  -1.675   8.495   6.490
  203    HE1  TYR  26           1HE      TYR  26  -1.764   3.589   6.124
  204    HE2  TYR  26           2HE      TYR  26  -1.766   7.121   8.526
  205    HH   TYR  26           HH       TYR  26  -2.516   4.856   9.174
  206    H    ALA  27           H        ALA  27  -0.942  10.205   4.377
  207    HA   ALA  27           HA       ALA  27   1.576  10.517   5.862
  208    HB1  ALA  27           1HB      ALA  27   0.137  12.697   4.363
  209    HB2  ALA  27           2HB      ALA  27   1.585  11.866   3.800
  210    HB3  ALA  27           3HB      ALA  27   1.646  12.854   5.261
  211    H    THR  28           H        THR  28   1.402  11.255   7.900
  212    HA   THR  28           HA       THR  28  -1.143  11.263   9.157
  213    HB   THR  28           HB       THR  28   0.231  12.221  11.127
  214    HG1  THR  28           1HG      THR  28   2.502  11.231   9.833
  215   HG21  THR  28          3HG2      THR  28   1.167  10.010  11.597
  216   HG22  THR  28          1HG2      THR  28   0.944   9.552   9.909
  217   HG23  THR  28          2HG2      THR  28  -0.458   9.881  10.927
  218    H    TRP  29           H        TRP  29   0.731  13.770   7.689
  219    HA   TRP  29           HA       TRP  29  -0.755  15.894   8.973
  220    HB2  TRP  29           1HB      TRP  29   0.483  17.386   7.401
  221    HB3  TRP  29           2HB      TRP  29   1.532  16.387   8.396
  222    HD1  TRP  29           HD       TRP  29   3.301  14.968   7.159
  223    HE1  TRP  29           1HE      TRP  29   3.843  14.477   4.694
  224    HE3  TRP  29           3HE      TRP  29  -0.816  17.085   4.977
  225    HZ2  TRP  29           2HZ      TRP  29   2.680  14.921   2.162
  226    HZ3  TRP  29           3HZ      TRP  29  -1.024  17.005   2.533
  227    HH2  TRP  29           HH       TRP  29   0.691  15.949   1.151
  228    H    CYS  30           H        CYS  30  -1.435  13.714   6.612
  229    HA   CYS  30           HA       CYS  30  -2.870  15.505   4.829
  230    HB2  CYS  30           1HB      CYS  30  -1.578  13.605   3.917
  231    HB3  CYS  30           2HB      CYS  30  -2.605  12.486   4.803
  232    HG   CYS  30           HG       CYS  30  -3.327  14.304   2.022
  233    H    GLY  31           H        GLY  31  -5.145  15.098   4.328
  234    HA2  GLY  31           1HA      GLY  31  -6.656  14.527   6.765
  235    HA3  GLY  31           2HA      GLY  31  -7.257  15.366   5.345
  236    HA   PRO  32           HA       PRO  32  -9.128  11.748   3.662
  237    HB2  PRO  32           1HB      PRO  32  -7.387  11.665   1.272
  238    HB3  PRO  32           2HB      PRO  32  -9.136  11.882   1.385
  239    HG2  PRO  32           1HG      PRO  32  -7.559  13.926   0.749
  240    HG3  PRO  32           2HG      PRO  32  -8.958  14.156   1.813
  241    HD2  PRO  32           1HD      PRO  32  -6.057  13.887   2.535
  242    HD3  PRO  32           2HD      PRO  32  -7.264  15.038   3.149
  243    H    CYS  33           H        CYS  33  -5.892  11.527   4.485
  244    HA   CYS  33           HA       CYS  33  -5.141   9.005   3.489
  245    HB2  CYS  33           1HB      CYS  33  -3.521   9.001   5.396
  246    HB3  CYS  33           2HB      CYS  33  -3.475  10.464   4.416
  247    HG   CYS  33           HG       CYS  33  -3.129  11.423   6.914
  248    H    LYS  34           H        LYS  34  -7.161   9.960   6.128
  249    HA   LYS  34           HA       LYS  34  -7.090   7.545   7.585
  250    HB2  LYS  34           1HB      LYS  34  -9.204   8.380   8.628
  251    HB3  LYS  34           2HB      LYS  34  -7.853   9.495   8.711
  252    HG2  LYS  34           1HG      LYS  34  -9.685  10.831   8.202
  253    HG3  LYS  34           2HG      LYS  34  -8.867  10.618   6.657
  254    HD2  LYS  34           1HD      LYS  34 -10.474   8.902   6.026
  255    HD3  LYS  34           2HD      LYS  34 -11.266   9.045   7.596
  256    HE2  LYS  34           1HE      LYS  34 -11.038  11.250   5.549
  257    HE3  LYS  34           2HE      LYS  34 -12.467  10.253   5.814
  258    HZ1  LYS  34           3HZ      LYS  34 -12.711  12.330   6.963
  259    HZ2  LYS  34           1HZ      LYS  34 -11.238  12.121   7.769
  260    HZ3  LYS  34           2HZ      LYS  34 -12.538  11.099   8.105
  261    H    MET  35           H        MET  35  -8.360   8.134   4.510
  262    HA   MET  35           HA       MET  35 -10.521   6.207   4.800
  263    HB2  MET  35           1HB      MET  35 -10.598   8.141   3.144
  264    HB3  MET  35           2HB      MET  35  -9.394   7.249   2.202
  265    HG2  MET  35           1HG      MET  35 -10.910   5.379   1.977
  266    HG3  MET  35           2HG      MET  35 -12.108   6.194   2.976
  267    HE1  MET  35           3HE      MET  35 -13.840   5.581   0.874
  268    HE2  MET  35           1HE      MET  35 -12.432   4.873   0.080
  269    HE3  MET  35           2HE      MET  35 -13.446   6.024  -0.790
  270    H    ILE  36           H        ILE  36  -7.196   6.337   3.869
  271    HA   ILE  36           HA       ILE  36  -7.184   3.770   2.602
  272    HB   ILE  36           HB       ILE  36  -5.226   5.883   3.110
  273   HG12  ILE  36          1HG1      ILE  36  -4.527   5.246   0.847
  274   HG13  ILE  36          2HG1      ILE  36  -5.579   3.839   0.923
  275   HG21  ILE  36          1HG2      ILE  36  -4.311   3.021   3.019
  276   HG22  ILE  36          2HG2      ILE  36  -4.055   4.172   4.330
  277   HG23  ILE  36          3HG2      ILE  36  -3.266   4.418   2.771
  278   HD11  ILE  36          3HD1      ILE  36  -7.502   5.386   1.249
  279   HD12  ILE  36          1HD1      ILE  36  -6.700   5.513  -0.323
  280   HD13  ILE  36          2HD1      ILE  36  -6.397   6.723   0.923
  281    H    ALA  37           H        ALA  37  -6.785   5.011   5.793
  282    HA   ALA  37           HA       ALA  37  -5.575   2.836   7.021
  283    HB1  ALA  37           1HB      ALA  37  -6.986   3.563   9.051
  284    HB2  ALA  37           2HB      ALA  37  -7.541   4.874   8.003
  285    HB3  ALA  37           3HB      ALA  37  -5.828   4.702   8.368
  286    HA   PRO  38           HA       PRO  38  -9.615   0.538   7.717
  287    HB2  PRO  38           1HB      PRO  38 -12.038   1.489   7.157
  288    HB3  PRO  38           2HB      PRO  38 -11.139   2.053   8.574
  289    HG2  PRO  38           1HG      PRO  38 -11.475   3.359   5.903
  290    HG3  PRO  38           2HG      PRO  38 -11.543   4.083   7.519
  291    HD2  PRO  38           1HD      PRO  38  -9.329   4.143   5.879
  292    HD3  PRO  38           2HD      PRO  38  -9.281   4.301   7.644
  293    H    MET  39           H        MET  39  -9.751   2.235   4.566
  294    HA   MET  39           HA       MET  39 -11.416   0.258   3.339
  295    HB2  MET  39           1HB      MET  39 -11.358   2.400   2.269
  296    HB3  MET  39           2HB      MET  39  -9.610   2.425   2.282
  297    HG2  MET  39           1HG      MET  39 -10.028   0.235   0.783
  298    HG3  MET  39           2HG      MET  39 -11.470   1.172   0.391
  299    HE1  MET  39           3HE      MET  39  -7.287   3.050   0.037
  300    HE2  MET  39           1HE      MET  39  -7.418   1.322   0.374
  301    HE3  MET  39           2HE      MET  39  -8.056   2.486   1.525
  302    H    ILE  40           H        ILE  40  -7.973   0.820   3.560
  303    HA   ILE  40           HA       ILE  40  -7.220  -1.356   1.880
  304    HB   ILE  40           HB       ILE  40  -5.985   0.821   3.247
  305   HG12  ILE  40          1HG1      ILE  40  -4.579  -0.980   1.316
  306   HG13  ILE  40          2HG1      ILE  40  -5.954  -0.012   0.790
  307   HG21  ILE  40          1HG2      ILE  40  -5.169  -0.790   4.873
  308   HG22  ILE  40          2HG2      ILE  40  -3.844  -0.192   3.878
  309   HG23  ILE  40          3HG2      ILE  40  -4.516  -1.796   3.579
  310   HD11  ILE  40          3HD1      ILE  40  -3.692   1.257   2.250
  311   HD12  ILE  40          1HD1      ILE  40  -4.851   1.980   1.142
  312   HD13  ILE  40          2HD1      ILE  40  -3.574   0.931   0.522
  313    H    GLU  41           H        GLU  41  -7.480  -0.859   5.380
  314    HA   GLU  41           HA       GLU  41  -6.581  -3.420   6.134
  315    HB2  GLU  41           1HB      GLU  41  -6.904  -1.592   7.747
  316    HB3  GLU  41           2HB      GLU  41  -8.640  -1.644   7.475
  317    HG2  GLU  41           1HG      GLU  41  -8.725  -3.898   8.392
  318    HG3  GLU  41           2HG      GLU  41  -6.980  -3.865   8.646
  319    H    LYS  42           H        LYS  42  -9.677  -2.219   5.024
  320    HA   LYS  42           HA       LYS  42 -11.187  -4.518   5.654
  321    HB2  LYS  42           1HB      LYS  42 -12.287  -2.401   5.361
  322    HB3  LYS  42           2HB      LYS  42 -11.717  -2.271   3.702
  323    HG2  LYS  42           1HG      LYS  42 -13.139  -4.035   2.991
  324    HG3  LYS  42           2HG      LYS  42 -13.526  -4.482   4.653
  325    HD2  LYS  42           1HD      LYS  42 -14.222  -1.814   3.436
  326    HD3  LYS  42           2HD      LYS  42 -15.316  -3.196   3.446
  327    HE2  LYS  42           1HE      LYS  42 -14.143  -1.843   5.874
  328    HE3  LYS  42           2HE      LYS  42 -15.795  -1.667   5.288
  329    HZ1  LYS  42           3HZ      LYS  42 -16.094  -4.070   5.650
  330    HZ2  LYS  42           1HZ      LYS  42 -15.744  -3.235   7.079
  331    HZ3  LYS  42           2HZ      LYS  42 -14.542  -4.159   6.328
  332    H    PHE  43           H        PHE  43  -9.238  -3.648   2.856
  333    HA   PHE  43           HA       PHE  43 -10.174  -5.565   1.049
  334    HB2  PHE  43           1HB      PHE  43  -7.315  -4.620   1.416
  335    HB3  PHE  43           2HB      PHE  43  -7.912  -5.526   0.013
  336    HD1  PHE  43           1HD      PHE  43 -10.567  -4.142  -0.271
  337    HD2  PHE  43           2HD      PHE  43  -6.646  -2.640   0.398
  338    HE1  PHE  43           1HE      PHE  43 -11.198  -2.029  -1.352
  339    HE2  PHE  43           2HE      PHE  43  -7.274  -0.524  -0.681
  340    HZ   PHE  43           HZ       PHE  43  -9.552  -0.217  -1.551
  341    H    SER  44           H        SER  44  -7.387  -5.953   3.321
  342    HA   SER  44           HA       SER  44  -7.368  -8.772   2.780
  343    HB2  SER  44           1HB      SER  44  -5.911  -7.386   5.024
  344    HB3  SER  44           2HB      SER  44  -5.510  -8.905   4.216
  345    HG   SER  44           HG       SER  44  -4.363  -7.757   2.903
  346    H    GLU  45           H        GLU  45  -9.061  -6.736   4.906
  347    HA   GLU  45           HA       GLU  45  -9.753  -8.523   6.964
  348    HB2  GLU  45           1HB      GLU  45 -10.274  -6.084   6.910
  349    HB3  GLU  45           2HB      GLU  45 -11.467  -6.400   5.663
  350    HG2  GLU  45           1HG      GLU  45 -12.722  -7.796   7.246
  351    HG3  GLU  45           2HG      GLU  45 -11.542  -7.397   8.497
  352    H    GLN  46           H        GLN  46 -10.782  -8.178   3.648
  353    HA   GLN  46           HA       GLN  46 -12.777 -10.270   3.881
  354    HB2  GLN  46           1HB      GLN  46 -11.747  -8.853   1.414
  355    HB3  GLN  46           2HB      GLN  46 -13.169  -9.882   1.505
  356    HG2  GLN  46           1HG      GLN  46 -14.304  -8.281   2.887
  357    HG3  GLN  46           2HG      GLN  46 -12.853  -7.285   2.989
  358   HE21  GLN  46          1HE2      GLN  46 -13.866  -8.891   0.065
  359   HE22  GLN  46          2HE2      GLN  46 -14.296  -7.464  -0.806
  360    H    TYR  47           H        TYR  47  -9.715  -9.645   2.208
  361    HA   TYR  47           HA       TYR  47  -9.293 -12.539   2.042
  362    HB2  TYR  47           1HB      TYR  47  -7.985 -11.913  -0.115
  363    HB3  TYR  47           2HB      TYR  47  -9.733 -12.057  -0.154
  364    HD1  TYR  47           1HD      TYR  47  -6.964  -9.573   0.002
  365    HD2  TYR  47           2HD      TYR  47 -11.083 -10.280  -0.809
  366    HE1  TYR  47           1HE      TYR  47  -7.153  -7.321  -0.987
  367    HE2  TYR  47           2HE      TYR  47 -11.289  -8.031  -1.775
  368    HH   TYR  47           HH       TYR  47  -8.626  -6.122  -2.577
  369    HA   PRO  48           HA       PRO  48  -5.664 -10.927   4.317
  370    HB2  PRO  48           1HB      PRO  48  -5.238 -13.182   5.727
  371    HB3  PRO  48           2HB      PRO  48  -6.424 -11.970   6.210
  372    HG2  PRO  48           1HG      PRO  48  -6.850 -14.552   4.749
  373    HG3  PRO  48           2HG      PRO  48  -7.786 -13.857   6.087
  374    HD2  PRO  48           1HD      PRO  48  -8.589 -13.681   3.512
  375    HD3  PRO  48           2HD      PRO  48  -8.932 -12.410   4.701
  376    H    GLN  49           H        GLN  49  -6.161 -13.092   1.897
  377    HA   GLN  49           HA       GLN  49  -3.797 -14.605   1.752
  378    HB2  GLN  49           1HB      GLN  49  -5.615 -15.243   0.383
  379    HB3  GLN  49           2HB      GLN  49  -5.789 -13.624  -0.277
  380    HG2  GLN  49           1HG      GLN  49  -3.371 -14.101  -1.188
  381    HG3  GLN  49           2HG      GLN  49  -3.884 -15.777  -1.002
  382   HE21  GLN  49          1HE2      GLN  49  -4.476 -12.757  -2.628
  383   HE22  GLN  49          2HE2      GLN  49  -5.461 -13.408  -3.895
  384    H    ALA  50           H        ALA  50  -4.465 -11.299   1.081
  385    HA   ALA  50           HA       ALA  50  -1.903 -10.961  -0.308
  386    HB1  ALA  50           1HB      ALA  50  -2.723  -8.717  -0.848
  387    HB2  ALA  50           2HB      ALA  50  -4.196  -9.035   0.068
  388    HB3  ALA  50           3HB      ALA  50  -3.847  -9.967  -1.394
  389    H    ASP  51           H        ASP  51  -0.478  -9.212   0.437
  390    HA   ASP  51           HA       ASP  51  -0.461  -9.340   3.334
  391    HB2  ASP  51           1HB      ASP  51   1.633  -9.110   1.298
  392    HB3  ASP  51           2HB      ASP  51   1.881  -8.087   2.700
  393    H    PHE  52           H        PHE  52  -0.856  -7.774   4.624
  394    HA   PHE  52           HA       PHE  52  -1.571  -5.185   3.494
  395    HB2  PHE  52           1HB      PHE  52  -2.495  -4.966   5.951
  396    HB3  PHE  52           2HB      PHE  52  -3.372  -5.897   4.749
  397    HD1  PHE  52           2HD      PHE  52  -1.160  -6.128   7.697
  398    HD2  PHE  52           1HD      PHE  52  -3.665  -8.243   4.988
  399    HE1  PHE  52           2HE      PHE  52  -1.100  -8.088   9.179
  400    HE2  PHE  52           1HE      PHE  52  -3.610 -10.208   6.466
  401    HZ   PHE  52           HZ       PHE  52  -2.325 -10.132   8.565
  402    H    TYR  53           H        TYR  53  -0.076  -3.638   3.558
  403    HA   TYR  53           HA       TYR  53   1.331  -3.205   6.084
  404    HB2  TYR  53           1HB      TYR  53   2.689  -3.306   3.380
  405    HB3  TYR  53           2HB      TYR  53   3.430  -2.670   4.840
  406    HD1  TYR  53           2HD      TYR  53   3.917  -4.220   6.737
  407    HD2  TYR  53           1HD      TYR  53   2.643  -5.634   2.933
  408    HE1  TYR  53           2HE      TYR  53   4.762  -6.459   7.295
  409    HE2  TYR  53           1HE      TYR  53   3.490  -7.881   3.474
  410    HH   TYR  53           HH       TYR  53   5.058  -8.952   4.951
  411    H    LYS  54           H        LYS  54   1.973  -1.068   6.460
  412    HA   LYS  54           HA       LYS  54   1.145   0.950   4.542
  413    HB2  LYS  54           1HB      LYS  54  -0.472   1.979   5.936
  414    HB3  LYS  54           2HB      LYS  54  -0.848   0.260   5.906
  415    HG2  LYS  54           1HG      LYS  54   0.232   0.008   8.102
  416    HG3  LYS  54           2HG      LYS  54   0.499   1.753   8.143
  417    HD2  LYS  54           1HD      LYS  54  -1.950   2.082   7.900
  418    HD3  LYS  54           2HD      LYS  54  -2.160   0.335   8.004
  419    HE2  LYS  54           1HE      LYS  54  -2.600   1.268  10.158
  420    HE3  LYS  54           2HE      LYS  54  -1.066   0.405  10.239
  421    HZ1  LYS  54           3HZ      LYS  54   0.109   2.478  10.095
  422    HZ2  LYS  54           1HZ      LYS  54  -1.015   2.582  11.352
  423    HZ3  LYS  54           2HZ      LYS  54  -1.324   3.342   9.869
  424    H    LEU  55           H        LEU  55   1.811   3.142   5.194
  425    HA   LEU  55           HA       LEU  55   3.643   3.416   7.393
  426    HB2  LEU  55           1HB      LEU  55   5.072   2.261   5.826
  427    HB3  LEU  55           2HB      LEU  55   4.617   3.353   4.536
  428    HG   LEU  55           HG       LEU  55   6.030   4.452   6.943
  429   HD11  LEU  55          1HD1      LEU  55   7.267   2.933   4.650
  430   HD12  LEU  55          2HD1      LEU  55   7.433   2.602   6.375
  431   HD13  LEU  55          3HD1      LEU  55   8.163   4.047   5.679
  432   HD21  LEU  55          3HD2      LEU  55   5.029   5.847   5.092
  433   HD22  LEU  55          1HD2      LEU  55   6.250   5.152   4.027
  434   HD23  LEU  55          2HD2      LEU  55   6.743   6.117   5.421
  435    H    ASP  56           H        ASP  56   4.198   5.575   7.788
  436    HA   ASP  56           HA       ASP  56   2.528   7.547   6.409
  437    HB2  ASP  56           1HB      ASP  56   2.180   7.588   8.755
  438    HB3  ASP  56           2HB      ASP  56   3.905   7.516   9.089
  439    H    VAL  57           H        VAL  57   3.395   8.851   4.963
  440    HA   VAL  57           HA       VAL  57   6.132   8.725   4.260
  441    HB   VAL  57           HB       VAL  57   5.620  10.207   2.505
  442   HG11  VAL  57          1HG1      VAL  57   3.607   9.300   1.534
  443   HG12  VAL  57          2HG1      VAL  57   3.023   8.805   3.120
  444   HG13  VAL  57          3HG1      VAL  57   4.444   8.026   2.419
  445   HG21  VAL  57          3HG2      VAL  57   4.730  12.086   3.640
  446   HG22  VAL  57          1HG2      VAL  57   3.352  11.161   4.233
  447   HG23  VAL  57          2HG2      VAL  57   3.473  11.557   2.524
  448    H    ASP  58           H        ASP  58   4.393  10.721   6.476
  449    HA   ASP  58           HA       ASP  58   6.148  12.957   6.479
  450    HB2  ASP  58           1HB      ASP  58   3.930  13.145   7.453
  451    HB3  ASP  58           2HB      ASP  58   4.303  11.887   8.626
  452    H    GLU  59           H        GLU  59   6.026   9.904   8.207
  453    HA   GLU  59           HA       GLU  59   8.337  10.512   9.804
  454    HB2  GLU  59           1HB      GLU  59   6.301   8.667   9.987
  455    HB3  GLU  59           2HB      GLU  59   7.671   7.679   9.503
  456    HG2  GLU  59           1HG      GLU  59   7.533   9.490  11.907
  457    HG3  GLU  59           2HG      GLU  59   7.464   7.730  11.912
  458    H    LEU  60           H        LEU  60   7.681   8.607   6.876
  459    HA   LEU  60           HA       LEU  60  10.592   8.417   6.477
  460    HB2  LEU  60           1HB      LEU  60   8.574   6.218   6.079
  461    HB3  LEU  60           2HB      LEU  60  10.253   6.128   5.591
  462    HG   LEU  60           HG       LEU  60   9.327   6.492   8.440
  463   HD11  LEU  60          1HD1      LEU  60  10.274   4.029   6.987
  464   HD12  LEU  60          2HD1      LEU  60   8.664   4.314   7.648
  465   HD13  LEU  60          3HD1      LEU  60  10.046   4.154   8.731
  466   HD21  LEU  60          3HD2      LEU  60  11.651   5.941   8.984
  467   HD22  LEU  60          1HD2      LEU  60  11.535   7.414   8.023
  468   HD23  LEU  60          2HD2      LEU  60  12.041   5.904   7.266
  469    H    GLY  61           H        GLY  61  10.140  10.301   5.124
  470    HA2  GLY  61           1HA      GLY  61   8.589  10.079   2.749
  471    HA3  GLY  61           2HA      GLY  61   9.782  11.318   3.097
  472    H    ASP  62           H        ASP  62  11.905   9.306   3.525
  473    HA   ASP  62           HA       ASP  62  12.886   9.170   0.874
  474    HB2  ASP  62           1HB      ASP  62  14.769   7.947   1.783
  475    HB3  ASP  62           2HB      ASP  62  14.352   9.248   2.889
  476    H    VAL  63           H        VAL  63  11.102   6.969   2.852
  477    HA   VAL  63           HA       VAL  63  11.379   4.720   1.122
  478    HB   VAL  63           HB       VAL  63   9.067   5.280   2.975
  479   HG11  VAL  63          1HG1      VAL  63  10.202   2.733   1.821
  480   HG12  VAL  63          2HG1      VAL  63   8.661   3.480   1.402
  481   HG13  VAL  63          3HG1      VAL  63   8.910   2.811   3.016
  482   HG21  VAL  63          3HG2      VAL  63  11.301   5.430   4.100
  483   HG22  VAL  63          1HG2      VAL  63  11.592   3.760   3.616
  484   HG23  VAL  63          2HG2      VAL  63  10.262   4.141   4.711
  485    H    ALA  64           H        ALA  64   8.786   7.144   1.563
  486    HA   ALA  64           HA       ALA  64   7.205   6.465  -0.612
  487    HB1  ALA  64           1HB      ALA  64   6.346   8.737  -0.514
  488    HB2  ALA  64           2HB      ALA  64   7.734   9.248   0.446
  489    HB3  ALA  64           3HB      ALA  64   6.574   8.100   1.115
  490    H    GLN  65           H        GLN  65  10.348   7.956  -0.656
  491    HA   GLN  65           HA       GLN  65  10.054   8.781  -3.419
  492    HB2  GLN  65           1HB      GLN  65  12.518   8.636  -1.669
  493    HB3  GLN  65           2HB      GLN  65  12.471   9.318  -3.288
  494    HG2  GLN  65           1HG      GLN  65  11.023  10.341  -0.859
  495    HG3  GLN  65           2HG      GLN  65  12.415  11.079  -1.653
  496   HE21  GLN  65          1HE2      GLN  65   9.820  12.220  -1.138
  497   HE22  GLN  65          2HE2      GLN  65   9.155  12.660  -2.671
  498    H    LYS  66           H        LYS  66  11.345   6.076  -1.627
  499    HA   LYS  66           HA       LYS  66  12.749   4.884  -3.752
  500    HB2  LYS  66           1HB      LYS  66  13.503   3.909  -1.862
  501    HB3  LYS  66           2HB      LYS  66  12.020   4.250  -0.986
  502    HG2  LYS  66           1HG      LYS  66  12.208   1.928  -1.012
  503    HG3  LYS  66           2HG      LYS  66  11.002   2.319  -2.236
  504    HD2  LYS  66           1HD      LYS  66  12.804   2.164  -3.961
  505    HD3  LYS  66           2HD      LYS  66  13.893   1.584  -2.698
  506    HE2  LYS  66           1HE      LYS  66  12.380  -0.301  -2.281
  507    HE3  LYS  66           2HE      LYS  66  11.316   0.276  -3.561
  508    HZ1  LYS  66           3HZ      LYS  66  14.153  -0.424  -4.038
  509    HZ2  LYS  66           1HZ      LYS  66  12.932  -0.199  -5.187
  510    HZ3  LYS  66           2HZ      LYS  66  12.904  -1.554  -4.167
  511    H    ASN  67           H        ASN  67   9.436   4.757  -2.645
  512    HA   ASN  67           HA       ASN  67   8.796   2.546  -4.466
  513    HB2  ASN  67           1HB      ASN  67   6.494   2.917  -3.269
  514    HB3  ASN  67           2HB      ASN  67   7.789   2.118  -2.403
  515   HD21  ASN  67          1HD2      ASN  67   7.434   2.729  -0.374
  516   HD22  ASN  67          2HD2      ASN  67   7.343   4.371   0.133
  517    H    GLU  68           H        GLU  68   8.679   5.913  -4.214
  518    HA   GLU  68           HA       GLU  68   8.217   7.420  -5.815
  519    HB2  GLU  68           1HB      GLU  68   7.078   5.069  -7.300
  520    HB3  GLU  68           2HB      GLU  68   7.148   6.715  -7.946
  521    HG2  GLU  68           1HG      GLU  68   9.624   6.669  -7.619
  522    HG3  GLU  68           2HG      GLU  68   9.476   4.965  -7.193
  523    H    VAL  69           H        VAL  69   6.242   6.287  -3.715
  524    HA   VAL  69           HA       VAL  69   3.787   7.362  -4.790
  525    HB   VAL  69           HB       VAL  69   3.073   5.835  -3.279
  526   HG11  VAL  69          1HG1      VAL  69   4.166   5.207  -1.202
  527   HG12  VAL  69          2HG1      VAL  69   5.391   6.456  -1.446
  528   HG13  VAL  69          3HG1      VAL  69   5.286   5.084  -2.561
  529   HG21  VAL  69          3HG2      VAL  69   2.315   6.837  -1.224
  530   HG22  VAL  69          1HG2      VAL  69   2.184   8.006  -2.536
  531   HG23  VAL  69          2HG2      VAL  69   3.507   8.128  -1.375
  532    H    SER  70           H        SER  70   3.594   9.416  -5.118
  533    HA   SER  70           HA       SER  70   5.030  11.297  -3.370
  534    HB2  SER  70           1HB      SER  70   4.077  11.730  -6.209
  535    HB3  SER  70           2HB      SER  70   5.098  12.814  -5.263
  536    HG   SER  70           HG       SER  70   6.425  10.678  -5.131
  537    H    ALA  71           H        ALA  71   1.954  10.302  -4.483
  538    HA   ALA  71           HA       ALA  71   0.687  12.699  -3.356
  539    HB1  ALA  71           1HB      ALA  71  -0.509  10.474  -5.011
  540    HB2  ALA  71           2HB      ALA  71  -0.057  12.073  -5.600
  541    HB3  ALA  71           3HB      ALA  71  -1.365  11.901  -4.431
  542    H    MET  72           H        MET  72  -0.905  12.457  -1.708
  543    HA   MET  72           HA       MET  72  -1.026   9.796  -0.482
  544    HB2  MET  72           1HB      MET  72  -0.492  12.375   1.012
  545    HB3  MET  72           2HB      MET  72  -0.858  10.836   1.777
  546    HG2  MET  72           1HG      MET  72   1.438  10.933   1.920
  547    HG3  MET  72           2HG      MET  72   1.193   9.964   0.470
  548    HE1  MET  72           3HE      MET  72   3.498  10.305  -0.656
  549    HE2  MET  72           1HE      MET  72   4.002  11.038   0.867
  550    HE3  MET  72           2HE      MET  72   4.363  11.841  -0.662
  551    HA   PRO  73           HA       PRO  73  -2.048   8.695   0.808
  552    HB2  PRO  73           1HB      PRO  73  -4.157   7.036   0.837
  553    HB3  PRO  73           2HB      PRO  73  -3.840   8.180   2.140
  554    HG2  PRO  73           1HG      PRO  73  -5.840   8.314  -0.066
  555    HG3  PRO  73           2HG      PRO  73  -5.982   8.870   1.619
  556    HD2  PRO  73           1HD      PRO  73  -5.417  10.483  -0.597
  557    HD3  PRO  73           2HD      PRO  73  -5.133  10.922   1.096
  558    H    THR  74           H        THR  74  -1.418   6.786  -0.226
  559    HA   THR  74           HA       THR  74  -2.371   6.299  -2.964
  560    HB   THR  74           HB       THR  74   0.447   6.905  -2.109
  561    HG1  THR  74           1HG      THR  74  -0.281   8.625  -3.120
  562   HG21  THR  74          3HG2      THR  74   1.209   6.043  -4.343
  563   HG22  THR  74          1HG2      THR  74  -0.347   5.220  -4.487
  564   HG23  THR  74          2HG2      THR  74   0.765   4.799  -3.177
  565    H    LEU  75           H        LEU  75  -2.345   4.228  -3.597
  566    HA   LEU  75           HA       LEU  75  -1.472   2.206  -1.638
  567    HB2  LEU  75           1HB      LEU  75  -3.409   1.950  -3.929
  568    HB3  LEU  75           2HB      LEU  75  -3.033   0.709  -2.753
  569    HG   LEU  75           HG       LEU  75  -3.933   2.637  -1.107
  570   HD11  LEU  75          1HD1      LEU  75  -5.892   3.701  -2.072
  571   HD12  LEU  75          2HD1      LEU  75  -5.568   2.955  -3.636
  572   HD13  LEU  75          3HD1      LEU  75  -4.456   4.164  -2.986
  573   HD21  LEU  75          3HD2      LEU  75  -4.673   0.393  -1.056
  574   HD22  LEU  75          1HD2      LEU  75  -5.464   0.548  -2.628
  575   HD23  LEU  75          2HD2      LEU  75  -6.104   1.412  -1.231
  576    H    LEU  76           H        LEU  76   0.297   1.029  -2.220
  577    HA   LEU  76           HA       LEU  76   0.833   0.796  -5.104
  578    HB2  LEU  76           1HB      LEU  76   2.525   1.647  -2.961
  579    HB3  LEU  76           2HB      LEU  76   3.173   0.169  -3.644
  580    HG   LEU  76           HG       LEU  76   2.514   2.659  -5.223
  581   HD11  LEU  76          1HD1      LEU  76   5.205   1.546  -4.431
  582   HD12  LEU  76          2HD1      LEU  76   4.437   2.964  -3.719
  583   HD13  LEU  76          3HD1      LEU  76   4.918   2.986  -5.425
  584   HD21  LEU  76          3HD2      LEU  76   3.832   0.067  -6.022
  585   HD22  LEU  76          1HD2      LEU  76   3.724   1.506  -7.035
  586   HD23  LEU  76          2HD2      LEU  76   2.259   0.658  -6.550
  587    H    LEU  77           H        LEU  77   0.324  -1.114  -5.850
  588    HA   LEU  77           HA       LEU  77   0.461  -3.493  -4.138
  589    HB2  LEU  77           1HB      LEU  77  -0.827  -2.903  -6.795
  590    HB3  LEU  77           2HB      LEU  77  -0.594  -4.548  -6.253
  591    HG   LEU  77           HG       LEU  77  -2.219  -4.351  -4.559
  592   HD11  LEU  77          1HD1      LEU  77  -3.225  -2.250  -3.849
  593   HD12  LEU  77          2HD1      LEU  77  -2.200  -1.357  -4.971
  594   HD13  LEU  77          3HD1      LEU  77  -1.480  -2.203  -3.603
  595   HD21  LEU  77          3HD2      LEU  77  -4.164  -3.693  -5.741
  596   HD22  LEU  77          1HD2      LEU  77  -3.031  -4.355  -6.918
  597   HD23  LEU  77          2HD2      LEU  77  -3.246  -2.606  -6.780
  598    H    PHE  78           H        PHE  78   1.948  -5.082  -4.494
  599    HA   PHE  78           HA       PHE  78   3.622  -4.872  -6.904
  600    HB2  PHE  78           1HB      PHE  78   4.507  -5.057  -4.043
  601    HB3  PHE  78           2HB      PHE  78   5.529  -5.661  -5.340
  602    HD1  PHE  78           2HD      PHE  78   3.944  -2.645  -3.935
  603    HD2  PHE  78           1HD      PHE  78   6.754  -4.191  -6.725
  604    HE1  PHE  78           2HE      PHE  78   4.851  -0.391  -4.279
  605    HE2  PHE  78           1HE      PHE  78   7.665  -1.934  -7.069
  606    HZ   PHE  78           HZ       PHE  78   6.711  -0.028  -5.843
  607    H    LYS  79           H        LYS  79   4.439  -6.852  -7.741
  608    HA   LYS  79           HA       LYS  79   3.756  -9.275  -6.187
  609    HB2  LYS  79           1HB      LYS  79   3.267  -8.615  -9.028
  610    HB3  LYS  79           2HB      LYS  79   3.879 -10.227  -8.702
  611    HG2  LYS  79           1HG      LYS  79   1.982 -10.609  -7.179
  612    HG3  LYS  79           2HG      LYS  79   1.374  -8.997  -7.564
  613    HD2  LYS  79           1HD      LYS  79   0.156 -10.376  -8.991
  614    HD3  LYS  79           2HD      LYS  79   1.463  -9.791 -10.016
  615    HE2  LYS  79           1HE      LYS  79   1.261 -12.102 -10.446
  616    HE3  LYS  79           2HE      LYS  79   2.702 -11.907  -9.449
  617    HZ1  LYS  79           3HZ      LYS  79   1.490 -12.628  -7.538
  618    HZ2  LYS  79           1HZ      LYS  79   1.275 -13.771  -8.764
  619    HZ3  LYS  79           2HZ      LYS  79   0.030 -12.679  -8.399
  620    H    ASN  80           H        ASN  80   5.723  -9.840  -5.366
  621    HA   ASN  80           HA       ASN  80   7.781 -10.802  -5.365
  622    HB2  ASN  80           1HB      ASN  80   6.640 -12.339  -6.894
  623    HB3  ASN  80           2HB      ASN  80   7.091 -11.325  -8.252
  624   HD21  ASN  80          1HD2      ASN  80   8.135 -12.974  -9.263
  625   HD22  ASN  80          2HD2      ASN  80   9.667 -13.583  -8.731
  626    H    GLY  81           H        GLY  81   8.033  -8.157  -5.420
  627    HA2  GLY  81           1HA      GLY  81   9.916  -6.788  -5.543
  628    HA3  GLY  81           2HA      GLY  81  10.620  -7.905  -6.706
  629    H    LYS  82           H        LYS  82   7.674  -7.381  -7.986
  630    HA   LYS  82           HA       LYS  82   8.506  -4.881  -9.311
  631    HB2  LYS  82           1HB      LYS  82   7.571  -5.657 -11.390
  632    HB3  LYS  82           2HB      LYS  82   8.666  -6.900 -10.803
  633    HG2  LYS  82           1HG      LYS  82   6.815  -8.223 -10.013
  634    HG3  LYS  82           2HG      LYS  82   5.678  -6.951 -10.458
  635    HD2  LYS  82           1HD      LYS  82   6.293  -7.239 -12.814
  636    HD3  LYS  82           2HD      LYS  82   7.421  -8.520 -12.356
  637    HE2  LYS  82           1HE      LYS  82   5.597  -9.859 -11.491
  638    HE3  LYS  82           2HE      LYS  82   4.450  -8.565 -11.832
  639    HZ1  LYS  82           3HZ      LYS  82   4.380 -10.274 -13.525
  640    HZ2  LYS  82           1HZ      LYS  82   6.024 -10.059 -13.856
  641    HZ3  LYS  82           2HZ      LYS  82   4.925  -8.817 -14.184
  642    H    GLU  83           H        GLU  83   6.643  -3.601 -10.096
  643    HA   GLU  83           HA       GLU  83   4.598  -3.412  -8.142
  644    HB2  GLU  83           1HB      GLU  83   5.540  -1.542  -9.583
  645    HB3  GLU  83           2HB      GLU  83   4.607  -2.200 -10.916
  646    HG2  GLU  83           1HG      GLU  83   2.539  -1.737  -9.776
  647    HG3  GLU  83           2HG      GLU  83   3.417  -1.240  -8.325
  648    H    VAL  84           H        VAL  84   2.222  -3.348  -8.928
  649    HA   VAL  84           HA       VAL  84   1.649  -4.793 -11.355
  650    HB   VAL  84           HB       VAL  84  -0.322  -5.938 -10.037
  651   HG11  VAL  84          1HG1      VAL  84   1.369  -7.054 -11.444
  652   HG12  VAL  84          2HG1      VAL  84   0.948  -7.986 -10.008
  653   HG13  VAL  84          3HG1      VAL  84   2.464  -7.086 -10.056
  654   HG21  VAL  84          3HG2      VAL  84   1.895  -5.885  -8.007
  655   HG22  VAL  84          1HG2      VAL  84   0.378  -6.775  -7.878
  656   HG23  VAL  84          2HG2      VAL  84   0.370  -5.010  -7.871
  657    H    ALA  85           H        ALA  85   0.699  -2.772  -8.703
  658    HA   ALA  85           HA       ALA  85  -0.847  -1.174 -10.487
  659    HB1  ALA  85           1HB      ALA  85  -2.602  -2.689 -10.014
  660    HB2  ALA  85           2HB      ALA  85  -2.914  -1.242  -9.053
  661    HB3  ALA  85           3HB      ALA  85  -2.228  -2.678  -8.295
  662    H    LYS  86           H        LYS  86  -1.496   0.840  -9.581
  663    HA   LYS  86           HA       LYS  86  -0.512   1.585  -6.970
  664    HB2  LYS  86           1HB      LYS  86   1.552   1.704  -8.237
  665    HB3  LYS  86           2HB      LYS  86   0.765   2.639  -9.498
  666    HG2  LYS  86           1HG      LYS  86   0.543   4.529  -8.066
  667    HG3  LYS  86           2HG      LYS  86   1.081   3.600  -6.668
  668    HD2  LYS  86           1HD      LYS  86   2.892   4.995  -7.425
  669    HD3  LYS  86           2HD      LYS  86   3.288   3.313  -7.758
  670    HE2  LYS  86           1HE      LYS  86   2.069   5.111  -9.838
  671    HE3  LYS  86           2HE      LYS  86   3.808   5.038  -9.569
  672    HZ1  LYS  86           3HZ      LYS  86   3.552   2.546  -9.929
  673    HZ2  LYS  86           1HZ      LYS  86   3.386   3.543 -11.290
  674    HZ3  LYS  86           2HZ      LYS  86   2.017   2.900 -10.547
  675    H    VAL  87           H        VAL  87  -2.094   2.829  -6.210
  676    HA   VAL  87           HA       VAL  87  -3.554   4.554  -8.105
  677    HB   VAL  87           HB       VAL  87  -4.868   2.996  -5.876
  678   HG11  VAL  87          1HG1      VAL  87  -6.026   4.573  -8.169
  679   HG12  VAL  87          2HG1      VAL  87  -5.999   5.066  -6.477
  680   HG13  VAL  87          3HG1      VAL  87  -6.948   3.666  -6.972
  681   HG21  VAL  87          3HG2      VAL  87  -4.075   1.435  -7.563
  682   HG22  VAL  87          1HG2      VAL  87  -4.840   2.392  -8.831
  683   HG23  VAL  87          2HG2      VAL  87  -5.832   1.572  -7.628
  684    H    VAL  88           H        VAL  88  -4.019   6.570  -7.382
  685    HA   VAL  88           HA       VAL  88  -2.949   7.263  -4.740
  686    HB   VAL  88           HB       VAL  88  -2.878   9.589  -5.607
  687   HG11  VAL  88          1HG1      VAL  88  -0.921   8.131  -5.773
  688   HG12  VAL  88          2HG1      VAL  88  -1.008   9.243  -7.138
  689   HG13  VAL  88          3HG1      VAL  88  -1.480   7.557  -7.344
  690   HG21  VAL  88          3HG2      VAL  88  -3.192   9.971  -8.014
  691   HG22  VAL  88          1HG2      VAL  88  -4.686   9.452  -7.233
  692   HG23  VAL  88          2HG2      VAL  88  -3.752   8.310  -8.197
  693    H    GLY  89           H        GLY  89  -5.464   6.109  -4.620
  694    HA2  GLY  89           1HA      GLY  89  -7.018   8.034  -3.323
  695    HA3  GLY  89           2HA      GLY  89  -7.625   7.866  -4.963
  696    H    ALA  90           H        ALA  90  -8.121   6.910  -1.931
  697    HA   ALA  90           HA       ALA  90  -8.606   4.186  -1.972
  698    HB1  ALA  90           1HB      ALA  90  -8.706   5.862  -0.057
  699    HB2  ALA  90           2HB      ALA  90  -9.871   4.525  -0.041
  700    HB3  ALA  90           3HB      ALA  90 -10.373   6.139  -0.561
  701    H    ASN  91           H        ASN  91  -9.647   3.267  -3.640
  702    HA   ASN  91           HA       ASN  91 -12.347   4.275  -4.242
  703    HB2  ASN  91           1HB      ASN  91 -10.204   3.823  -5.979
  704    HB3  ASN  91           2HB      ASN  91 -11.263   2.433  -6.207
  705   HD21  ASN  91          1HD2      ASN  91 -13.651   4.004  -5.493
  706   HD22  ASN  91          2HD2      ASN  91 -13.994   4.975  -6.880
  707    HA   PRO  92           HA       PRO  92 -13.041   0.756  -1.408
  708    HB2  PRO  92           1HB      PRO  92 -15.695   1.336  -2.685
  709    HB3  PRO  92           2HB      PRO  92 -15.332   0.890  -1.012
  710    HG2  PRO  92           1HG      PRO  92 -15.716   3.450  -1.749
  711    HG3  PRO  92           2HG      PRO  92 -14.576   2.996  -0.471
  712    HD2  PRO  92           1HD      PRO  92 -14.029   4.077  -3.130
  713    HD3  PRO  92           2HD      PRO  92 -12.938   3.922  -1.743
  714    H    ALA  93           H        ALA  93 -15.242   0.479  -4.204
  715    HA   ALA  93           HA       ALA  93 -14.928  -2.357  -4.154
  716    HB1  ALA  93           1HB      ALA  93 -17.052  -1.261  -4.735
  717    HB2  ALA  93           2HB      ALA  93 -16.517  -2.398  -5.971
  718    HB3  ALA  93           3HB      ALA  93 -16.315  -0.664  -6.221
  719    H    ALA  94           H        ALA  94 -13.797   0.204  -6.290
  720    HA   ALA  94           HA       ALA  94 -12.878  -1.491  -8.356
  721    HB1  ALA  94           1HB      ALA  94 -13.319   0.932  -8.624
  722    HB2  ALA  94           2HB      ALA  94 -11.730   0.447  -9.212
  723    HB3  ALA  94           3HB      ALA  94 -11.880   1.267  -7.661
  724    H    ILE  95           H        ILE  95 -11.428  -0.435  -5.346
  725    HA   ILE  95           HA       ILE  95  -8.848  -1.447  -6.196
  726    HB   ILE  95           HB       ILE  95  -9.609  -0.362  -3.489
  727   HG12  ILE  95          1HG1      ILE  95  -9.826   1.363  -5.186
  728   HG13  ILE  95          2HG1      ILE  95  -8.378   1.662  -4.232
  729   HG21  ILE  95          1HG2      ILE  95  -7.208  -0.194  -3.123
  730   HG22  ILE  95          2HG2      ILE  95  -6.904  -0.890  -4.714
  731   HG23  ILE  95          3HG2      ILE  95  -7.671  -1.863  -3.458
  732   HD11  ILE  95          3HD1      ILE  95  -8.461   0.413  -6.968
  733   HD12  ILE  95          1HD1      ILE  95  -7.009   0.713  -6.014
  734   HD13  ILE  95          2HD1      ILE  95  -7.984   2.065  -6.586
  735    H    LYS  96           H        LYS  96 -11.502  -2.439  -4.045
  736    HA   LYS  96           HA       LYS  96 -10.386  -4.796  -3.042
  737    HB2  LYS  96           1HB      LYS  96 -13.191  -4.552  -4.172
  738    HB3  LYS  96           2HB      LYS  96 -12.618  -5.787  -3.063
  739    HG2  LYS  96           1HG      LYS  96 -12.388  -4.167  -1.305
  740    HG3  LYS  96           2HG      LYS  96 -12.825  -2.860  -2.412
  741    HD2  LYS  96           1HD      LYS  96 -15.002  -4.042  -2.798
  742    HD3  LYS  96           2HD      LYS  96 -14.559  -5.152  -1.503
  743    HE2  LYS  96           1HE      LYS  96 -14.786  -2.164  -1.192
  744    HE3  LYS  96           2HE      LYS  96 -16.059  -3.311  -0.782
  745    HZ1  LYS  96           3HZ      LYS  96 -14.528  -4.345   0.805
  746    HZ2  LYS  96           1HZ      LYS  96 -14.825  -2.718   1.170
  747    HZ3  LYS  96           2HZ      LYS  96 -13.364  -3.166   0.448
  748    H    GLN  97           H        GLN  97 -11.895  -4.083  -6.124
  749    HA   GLN  97           HA       GLN  97 -11.511  -6.594  -7.338
  750    HB2  GLN  97           1HB      GLN  97 -13.110  -4.985  -8.207
  751    HB3  GLN  97           2HB      GLN  97 -11.832  -3.818  -8.516
  752    HG2  GLN  97           1HG      GLN  97 -12.451  -4.777 -10.589
  753    HG3  GLN  97           2HG      GLN  97 -10.874  -5.434 -10.163
  754   HE21  GLN  97          1HE2      GLN  97 -12.916  -6.471 -11.961
  755   HE22  GLN  97          2HE2      GLN  97 -13.303  -8.054 -11.383
  756    H    ALA  98           H        ALA  98  -9.431  -3.801  -6.960
  757    HA   ALA  98           HA       ALA  98  -7.547  -4.515  -8.942
  758    HB1  ALA  98           1HB      ALA  98  -7.687  -2.253  -8.027
  759    HB2  ALA  98           2HB      ALA  98  -6.065  -2.925  -7.874
  760    HB3  ALA  98           3HB      ALA  98  -7.125  -2.856  -6.467
  761    H    ILE  99           H        ILE  99  -7.450  -4.835  -5.410
  762    HA   ILE  99           HA       ILE  99  -5.041  -6.189  -5.219
  763    HB   ILE  99           HB       ILE  99  -7.301  -6.909  -3.360
  764   HG12  ILE  99          1HG1      ILE  99  -7.609  -4.564  -3.466
  765   HG13  ILE  99          2HG1      ILE  99  -6.625  -4.854  -2.032
  766   HG21  ILE  99          1HG2      ILE  99  -5.413  -6.805  -1.733
  767   HG22  ILE  99          2HG2      ILE  99  -4.337  -6.488  -3.097
  768   HG23  ILE  99          3HG2      ILE  99  -5.215  -8.013  -3.004
  769   HD11  ILE  99          3HD1      ILE  99  -5.734  -2.974  -3.126
  770   HD12  ILE  99          1HD1      ILE  99  -5.774  -3.790  -4.693
  771   HD13  ILE  99          2HD1      ILE  99  -4.630  -4.313  -3.448
  772    H    ALA 100           H        ALA 100  -8.266  -7.407  -5.939
  773    HA   ALA 100           HA       ALA 100  -7.501 -10.181  -5.751
  774    HB1  ALA 100           1HB      ALA 100  -9.738 -10.654  -6.552
  775    HB2  ALA 100           2HB      ALA 100  -9.971  -8.958  -6.973
  776    HB3  ALA 100           3HB      ALA 100  -9.794  -9.430  -5.283
  777    H    ALA 101           H        ALA 101  -7.674  -7.763  -8.256
  778    HA   ALA 101           HA       ALA 101  -7.482  -9.565 -10.470
  779    HB1  ALA 101           1HB      ALA 101  -6.820  -6.620 -10.355
  780    HB2  ALA 101           2HB      ALA 101  -8.424  -7.291 -10.668
  781    HB3  ALA 101           3HB      ALA 101  -7.111  -7.580 -11.810
  782    H    ASN 102           H        ASN 102  -5.213  -7.662  -8.577
  783    HA   ASN 102           HA       ASN 102  -2.992  -8.354 -10.284
  784    HB2  ASN 102           1HB      ASN 102  -3.008  -6.903  -7.640
  785    HB3  ASN 102           2HB      ASN 102  -1.641  -7.015  -8.737
  786   HD21  ASN 102          1HD2      ASN 102  -4.541  -5.428  -7.968
  787   HD22  ASN 102          2HD2      ASN 102  -4.573  -4.305  -9.284
  788    H    ALA 103           H        ALA 103  -4.531  -9.720  -7.578
  789    HA   ALA 103           HA       ALA 103  -2.433 -11.004  -6.269
  790    HB1  ALA 103           1HB      ALA 103  -4.100 -12.550  -5.420
  791    HB2  ALA 103           2HB      ALA 103  -5.241 -12.022  -6.656
  792    HB3  ALA 103           3HB      ALA 103  -4.721 -10.899  -5.399
  Start of MODEL   18
    1    H1   MET   1           1H       MET   1  -6.323  -6.466  11.639
    2    H2   MET   1           2H       MET   1  -4.861  -7.184  11.180
    3    H3   MET   1           3H       MET   1  -5.946  -6.651   9.999
    4    HA   MET   1           HA       MET   1  -5.631  -4.374  10.666
    5    HB2  MET   1           1HB      MET   1  -5.169  -4.814  13.040
    6    HB3  MET   1           2HB      MET   1  -3.626  -5.537  12.609
    7    HG2  MET   1           1HG      MET   1  -2.780  -3.445  11.831
    8    HG3  MET   1           2HG      MET   1  -4.362  -2.686  12.007
    9    HE1  MET   1           3HE      MET   1  -4.846  -2.628  15.870
   10    HE2  MET   1           1HE      MET   1  -5.302  -3.974  14.827
   11    HE3  MET   1           2HE      MET   1  -5.563  -2.317  14.289
   12    H    VAL   2           H        VAL   2  -4.289  -3.233   9.382
   13    HA   VAL   2           HA       VAL   2  -2.454  -4.715   7.736
   14    HB   VAL   2           HB       VAL   2  -3.316  -1.823   7.719
   15   HG11  VAL   2          1HG1      VAL   2  -2.309  -1.777   5.439
   16   HG12  VAL   2          2HG1      VAL   2  -1.569  -3.339   5.786
   17   HG13  VAL   2          3HG1      VAL   2  -1.127  -1.926   6.739
   18   HG21  VAL   2          3HG2      VAL   2  -4.075  -4.191   6.030
   19   HG22  VAL   2          1HG2      VAL   2  -4.565  -2.530   5.712
   20   HG23  VAL   2          2HG2      VAL   2  -5.096  -3.339   7.185
   21    H    THR   3           H        THR   3  -0.330  -4.786   7.914
   22    HA   THR   3           HA       THR   3   0.817  -3.995  10.408
   23    HB   THR   3           HB       THR   3   2.232  -5.207   8.029
   24    HG1  THR   3           1HG      THR   3   1.332  -7.082   8.535
   25   HG21  THR   3          3HG2      THR   3   3.693  -6.191   9.740
   26   HG22  THR   3          1HG2      THR   3   2.785  -5.350  10.997
   27   HG23  THR   3          2HG2      THR   3   3.715  -4.430   9.815
   28    H    GLN   4           H        GLN   4   2.548  -2.646  10.812
   29    HA   GLN   4           HA       GLN   4   2.680  -0.377   8.976
   30    HB2  GLN   4           1HB      GLN   4   1.959  -0.045  11.322
   31    HB3  GLN   4           2HB      GLN   4   3.530  -0.612  11.865
   32    HG2  GLN   4           1HG      GLN   4   3.349   1.835  11.893
   33    HG3  GLN   4           2HG      GLN   4   4.631   1.255  10.831
   34   HE21  GLN   4          1HE2      GLN   4   1.222   1.168  10.028
   35   HE22  GLN   4          2HE2      GLN   4   1.319   2.327   8.757
   36    H    PHE   5           H        PHE   5   4.425  -0.038   7.764
   37    HA   PHE   5           HA       PHE   5   6.901  -1.464   8.118
   38    HB2  PHE   5           1HB      PHE   5   6.014   0.768   6.305
   39    HB3  PHE   5           2HB      PHE   5   7.697   0.273   6.378
   40    HD1  PHE   5           2HD      PHE   5   7.059  -2.743   6.719
   41    HD2  PHE   5           1HD      PHE   5   5.674   0.257   4.036
   42    HE1  PHE   5           2HE      PHE   5   6.638  -4.465   5.015
   43    HE2  PHE   5           1HE      PHE   5   5.250  -1.461   2.331
   44    HZ   PHE   5           HZ       PHE   5   5.733  -3.822   2.817
   45    H    LYS   6           H        LYS   6   9.010  -0.173   8.161
   46    HA   LYS   6           HA       LYS   6   8.758   2.227   9.801
   47    HB2  LYS   6           1HB      LYS   6  10.675   1.490  11.191
   48    HB3  LYS   6           2HB      LYS   6   9.245   0.489  11.384
   49    HG2  LYS   6           1HG      LYS   6  10.222  -1.194   9.916
   50    HG3  LYS   6           2HG      LYS   6  11.659  -0.189   9.721
   51    HD2  LYS   6           1HD      LYS   6  12.111  -0.348  12.105
   52    HD3  LYS   6           2HD      LYS   6  10.644  -1.299  12.334
   53    HE2  LYS   6           1HE      LYS   6  11.576  -3.028  10.836
   54    HE3  LYS   6           2HE      LYS   6  13.062  -2.087  10.716
   55    HZ1  LYS   6           3HZ      LYS   6  13.234  -3.860  12.353
   56    HZ2  LYS   6           1HZ      LYS   6  11.936  -3.208  13.224
   57    HZ3  LYS   6           2HZ      LYS   6  13.382  -2.341  13.087
   58    H    THR   7           H        THR   7  10.430   0.469   7.319
   59    HA   THR   7           HA       THR   7  11.561   2.967   6.439
   60    HB   THR   7           HB       THR   7  13.802   1.344   6.136
   61    HG1  THR   7           1HG      THR   7  12.926  -0.033   7.810
   62   HG21  THR   7          3HG2      THR   7  13.787   3.752   6.529
   63   HG22  THR   7          1HG2      THR   7  14.845   2.937   7.682
   64   HG23  THR   7          2HG2      THR   7  13.245   3.485   8.186
   65    H    ALA   8           H        ALA   8  13.050   2.385   4.341
   66    HA   ALA   8           HA       ALA   8  11.138   1.309   2.527
   67    HB1  ALA   8           1HB      ALA   8  12.577   3.115   1.820
   68    HB2  ALA   8           2HB      ALA   8  12.829   1.704   0.797
   69    HB3  ALA   8           3HB      ALA   8  14.002   2.102   2.049
   70    H    SER   9           H        SER   9  13.997   0.077   4.094
   71    HA   SER   9           HA       SER   9  14.465  -2.235   2.645
   72    HB2  SER   9           1HB      SER   9  14.560  -1.971   5.660
   73    HB3  SER   9           2HB      SER   9  15.464  -3.119   4.672
   74    HG   SER   9           HG       SER   9  16.031  -0.778   3.676
   75    H    GLU  10           H        GLU  10  12.247  -1.754   5.381
   76    HA   GLU  10           HA       GLU  10  10.953  -4.183   5.408
   77    HB2  GLU  10           1HB      GLU  10  10.135  -1.383   6.053
   78    HB3  GLU  10           2HB      GLU  10   8.969  -2.688   6.175
   79    HG2  GLU  10           1HG      GLU  10  10.065  -2.167   8.295
   80    HG3  GLU  10           2HG      GLU  10  10.331  -3.824   7.770
   81    H    PHE  11           H        PHE  11  10.195  -1.302   3.468
   82    HA   PHE  11           HA       PHE  11   7.873  -2.245   2.238
   83    HB2  PHE  11           1HB      PHE  11   8.696   0.106   2.134
   84    HB3  PHE  11           2HB      PHE  11   9.973  -0.412   1.040
   85    HD1  PHE  11           1HD      PHE  11   9.305  -1.354  -1.222
   86    HD2  PHE  11           2HD      PHE  11   6.576   0.688   1.332
   87    HE1  PHE  11           1HE      PHE  11   7.826  -0.915  -3.145
   88    HE2  PHE  11           2HE      PHE  11   5.094   1.137  -0.601
   89    HZ   PHE  11           HZ       PHE  11   5.731   0.317  -2.824
   90    H    ASP  12           H        ASP  12  11.166  -2.244   0.977
   91    HA   ASP  12           HA       ASP  12  10.626  -3.633  -1.397
   92    HB2  ASP  12           1HB      ASP  12  12.671  -2.270  -0.867
   93    HB3  ASP  12           2HB      ASP  12  13.241  -3.612   0.120
   94    H    SER  13           H        SER  13  11.535  -4.817   1.814
   95    HA   SER  13           HA       SER  13  12.038  -7.487   1.109
   96    HB2  SER  13           1HB      SER  13  10.965  -6.374   3.711
   97    HB3  SER  13           2HB      SER  13  11.617  -7.998   3.492
   98    HG   SER  13           HG       SER  13  12.922  -5.537   3.610
   99    H    ALA  14           H        ALA  14   9.032  -5.903   2.177
  100    HA   ALA  14           HA       ALA  14   7.437  -8.214   2.016
  101    HB1  ALA  14           1HB      ALA  14   6.565  -5.334   1.761
  102    HB2  ALA  14           2HB      ALA  14   6.732  -6.225   3.274
  103    HB3  ALA  14           3HB      ALA  14   5.516  -6.716   2.094
  104    H    ILE  15           H        ILE  15   8.419  -5.803  -0.296
  105    HA   ILE  15           HA       ILE  15   6.585  -6.409  -2.350
  106    HB   ILE  15           HB       ILE  15   9.364  -5.296  -2.601
  107   HG12  ILE  15          1HG1      ILE  15   8.260  -3.747  -1.258
  108   HG13  ILE  15          2HG1      ILE  15   8.030  -3.135  -2.893
  109   HG21  ILE  15          1HG2      ILE  15   7.133  -4.843  -4.523
  110   HG22  ILE  15          2HG2      ILE  15   8.204  -6.231  -4.666
  111   HG23  ILE  15          3HG2      ILE  15   8.865  -4.595  -4.746
  112   HD11  ILE  15          3HD1      ILE  15   6.013  -4.679  -1.282
  113   HD12  ILE  15          1HD1      ILE  15   5.781  -4.088  -2.927
  114   HD13  ILE  15          2HD1      ILE  15   5.992  -2.945  -1.601
  115    H    ALA  16           H        ALA  16   9.756  -7.675  -1.525
  116    HA   ALA  16           HA       ALA  16  10.088  -9.083  -4.002
  117    HB1  ALA  16           1HB      ALA  16  11.648  -9.281  -1.432
  118    HB2  ALA  16           2HB      ALA  16  12.008  -8.207  -2.783
  119    HB3  ALA  16           3HB      ALA  16  12.133  -9.954  -2.988
  120    H    GLN  17           H        GLN  17   8.078  -9.644  -1.585
  121    HA   GLN  17           HA       GLN  17   8.451 -12.447  -1.127
  122    HB2  GLN  17           1HB      GLN  17   7.405 -10.844   0.486
  123    HB3  GLN  17           2HB      GLN  17   6.035 -10.712  -0.604
  124    HG2  GLN  17           1HG      GLN  17   5.513 -13.041  -0.291
  125    HG3  GLN  17           2HG      GLN  17   6.947 -13.254   0.709
  126   HE21  GLN  17          1HE2      GLN  17   5.103 -10.322   0.947
  127   HE22  GLN  17          2HE2      GLN  17   4.358 -10.680   2.467
  128    H    ASP  18           H        ASP  18   7.196 -14.138  -1.967
  129    HA   ASP  18           HA       ASP  18   6.428 -13.699  -4.712
  130    HB2  ASP  18           1HB      ASP  18   6.799 -16.138  -3.006
  131    HB3  ASP  18           2HB      ASP  18   6.004 -16.258  -4.571
  132    H    LYS  19           H        LYS  19   4.611 -12.302  -3.501
  133    HA   LYS  19           HA       LYS  19   2.201 -13.524  -4.329
  134    HB2  LYS  19           1HB      LYS  19   1.015 -13.368  -2.108
  135    HB3  LYS  19           2HB      LYS  19   2.169 -14.684  -2.259
  136    HG2  LYS  19           1HG      LYS  19   3.811 -13.050  -1.119
  137    HG3  LYS  19           2HG      LYS  19   2.347 -12.191  -0.632
  138    HD2  LYS  19           1HD      LYS  19   3.016 -15.081  -0.058
  139    HD3  LYS  19           2HD      LYS  19   3.008 -13.755   1.105
  140    HE2  LYS  19           1HE      LYS  19   0.579 -14.637  -0.448
  141    HE3  LYS  19           2HE      LYS  19   0.981 -15.235   1.160
  142    HZ1  LYS  19           3HZ      LYS  19   0.545 -13.216   2.117
  143    HZ2  LYS  19           1HZ      LYS  19  -0.619 -13.237   0.890
  144    HZ3  LYS  19           2HZ      LYS  19   0.810 -12.332   0.700
  145    H    LEU  20           H        LEU  20   0.272 -11.994  -3.487
  146    HA   LEU  20           HA       LEU  20   0.989  -9.500  -4.683
  147    HB2  LEU  20           1HB      LEU  20  -1.183 -10.789  -5.007
  148    HB3  LEU  20           2HB      LEU  20  -1.670 -10.182  -3.437
  149    HG   LEU  20           HG       LEU  20  -2.557  -8.945  -5.468
  150   HD11  LEU  20          1HD1      LEU  20  -0.987  -7.333  -3.469
  151   HD12  LEU  20          2HD1      LEU  20  -2.597  -8.002  -3.210
  152   HD13  LEU  20          3HD1      LEU  20  -2.344  -6.766  -4.442
  153   HD21  LEU  20          3HD2      LEU  20  -1.086  -7.307  -6.498
  154   HD22  LEU  20          1HD2      LEU  20  -0.492  -8.947  -6.767
  155   HD23  LEU  20          2HD2      LEU  20   0.273  -7.917  -5.556
  156    H    VAL  21           H        VAL  21   1.875  -7.910  -3.655
  157    HA   VAL  21           HA       VAL  21   1.382  -7.531  -0.786
  158    HB   VAL  21           HB       VAL  21   3.328  -5.842  -2.271
  159   HG11  VAL  21          1HG1      VAL  21   3.387  -7.179   0.426
  160   HG12  VAL  21          2HG1      VAL  21   2.989  -5.493   0.096
  161   HG13  VAL  21          3HG1      VAL  21   4.621  -6.090  -0.205
  162   HG21  VAL  21          3HG2      VAL  21   3.761  -8.770  -1.732
  163   HG22  VAL  21          1HG2      VAL  21   5.077  -7.623  -1.993
  164   HG23  VAL  21          2HG2      VAL  21   3.895  -7.908  -3.269
  165    H    VAL  22           H        VAL  22   0.264  -5.785  -0.051
  166    HA   VAL  22           HA       VAL  22  -0.259  -3.602  -1.967
  167    HB   VAL  22           HB       VAL  22  -2.106  -4.434   0.274
  168   HG11  VAL  22          1HG1      VAL  22  -3.696  -2.918  -0.828
  169   HG12  VAL  22          2HG1      VAL  22  -2.448  -2.473  -1.990
  170   HG13  VAL  22          3HG1      VAL  22  -2.243  -2.077  -0.284
  171   HG21  VAL  22          3HG2      VAL  22  -2.361  -4.954  -2.682
  172   HG22  VAL  22          1HG2      VAL  22  -3.601  -5.281  -1.471
  173   HG23  VAL  22          2HG2      VAL  22  -2.075  -6.165  -1.431
  174    H    VAL  23           H        VAL  23   0.792  -1.832  -1.371
  175    HA   VAL  23           HA       VAL  23   1.322  -1.485   1.499
  176    HB   VAL  23           HB       VAL  23   2.802  -0.161  -0.770
  177   HG11  VAL  23          1HG1      VAL  23   3.268  -0.278   2.209
  178   HG12  VAL  23          2HG1      VAL  23   2.878   1.148   1.247
  179   HG13  VAL  23          3HG1      VAL  23   4.435   0.346   1.046
  180   HG21  VAL  23          3HG2      VAL  23   4.635  -1.722  -0.157
  181   HG22  VAL  23          1HG2      VAL  23   3.224  -2.539  -0.832
  182   HG23  VAL  23          2HG2      VAL  23   3.509  -2.561   0.909
  183    H    ALA  24           H        ALA  24   0.636   0.173   2.544
  184    HA   ALA  24           HA       ALA  24  -1.251   1.961   1.168
  185    HB1  ALA  24           1HB      ALA  24  -0.972   1.243   4.098
  186    HB2  ALA  24           2HB      ALA  24  -2.092   0.498   2.963
  187    HB3  ALA  24           3HB      ALA  24  -2.266   2.203   3.376
  188    H    PHE  25           H        PHE  25   0.135   3.631   0.523
  189    HA   PHE  25           HA       PHE  25   1.782   5.041   2.435
  190    HB2  PHE  25           1HB      PHE  25   0.923   5.989  -0.283
  191    HB3  PHE  25           2HB      PHE  25   2.354   6.469   0.612
  192    HD1  PHE  25           2HD      PHE  25   3.997   4.537   1.182
  193    HD2  PHE  25           1HD      PHE  25   1.102   4.467  -1.915
  194    HE1  PHE  25           2HE      PHE  25   5.301   2.828   0.008
  195    HE2  PHE  25           1HE      PHE  25   2.385   2.768  -3.102
  196    HZ   PHE  25           HZ       PHE  25   4.492   1.933  -2.149
  197    H    TYR  26           H        TYR  26   1.222   6.746   3.616
  198    HA   TYR  26           HA       TYR  26  -0.536   8.733   2.575
  199    HB2  TYR  26           1HB      TYR  26  -2.074   8.746   4.545
  200    HB3  TYR  26           2HB      TYR  26  -2.279   7.368   3.475
  201    HD1  TYR  26           2HD      TYR  26  -1.681   5.135   4.210
  202    HD2  TYR  26           1HD      TYR  26  -1.237   8.459   6.815
  203    HE1  TYR  26           2HE      TYR  26  -1.474   3.598   6.103
  204    HE2  TYR  26           1HE      TYR  26  -1.024   6.933   8.733
  205    HH   TYR  26           HH       TYR  26  -0.400   3.694   8.442
  206    H    ALA  27           H        ALA  27  -0.877  10.433   4.527
  207    HA   ALA  27           HA       ALA  27   1.732  10.655   5.876
  208    HB1  ALA  27           1HB      ALA  27   0.234  12.914   4.549
  209    HB2  ALA  27           2HB      ALA  27   1.643  12.095   3.875
  210    HB3  ALA  27           3HB      ALA  27   1.793  13.023   5.369
  211    H    THR  28           H        THR  28   1.600  11.141   8.007
  212    HA   THR  28           HA       THR  28  -0.896  10.919   9.290
  213    HB   THR  28           HB       THR  28   0.462  11.554  11.363
  214    HG1  THR  28           1HG      THR  28   2.832  11.205  10.754
  215   HG21  THR  28          3HG2      THR  28   1.623   9.393  11.383
  216   HG22  THR  28          1HG2      THR  28   1.389   9.251   9.643
  217   HG23  THR  28          2HG2      THR  28  -0.004   9.237  10.724
  218    H    TRP  29           H        TRP  29   0.782  13.664   8.093
  219    HA   TRP  29           HA       TRP  29  -0.680  15.527   9.769
  220    HB2  TRP  29           1HB      TRP  29   0.518  17.270   8.467
  221    HB3  TRP  29           2HB      TRP  29   1.607  16.114   9.217
  222    HD1  TRP  29           HD       TRP  29   3.281  14.886   7.661
  223    HE1  TRP  29           1HE      TRP  29   3.724  14.884   5.123
  224    HE3  TRP  29           3HE      TRP  29  -0.843  17.480   6.112
  225    HZ2  TRP  29           2HZ      TRP  29   2.475  15.845   2.777
  226    HZ3  TRP  29           3HZ      TRP  29  -1.155  17.886   3.716
  227    HH2  TRP  29           HH       TRP  29   0.476  17.092   2.079
  228    H    CYS  30           H        CYS  30  -1.285  13.779   7.014
  229    HA   CYS  30           HA       CYS  30  -2.908  15.841   5.705
  230    HB2  CYS  30           1HB      CYS  30  -1.308  14.572   4.325
  231    HB3  CYS  30           2HB      CYS  30  -2.098  13.071   4.783
  232    HG   CYS  30           HG       CYS  30  -3.622  15.561   2.998
  233    H    GLY  31           H        GLY  31  -5.100  15.432   5.183
  234    HA2  GLY  31           1HA      GLY  31  -6.455  14.114   7.371
  235    HA3  GLY  31           2HA      GLY  31  -7.182  15.158   6.166
  236    HA   PRO  32           HA       PRO  32  -8.816  11.871   3.714
  237    HB2  PRO  32           1HB      PRO  32  -6.740  11.993   1.593
  238    HB3  PRO  32           2HB      PRO  32  -8.495  12.145   1.464
  239    HG2  PRO  32           1HG      PRO  32  -6.938  14.286   1.247
  240    HG3  PRO  32           2HG      PRO  32  -8.479  14.373   2.122
  241    HD2  PRO  32           1HD      PRO  32  -5.694  14.185   3.204
  242    HD3  PRO  32           2HD      PRO  32  -7.061  15.160   3.777
  243    H    CYS  33           H        CYS  33  -5.681  11.489   4.848
  244    HA   CYS  33           HA       CYS  33  -4.961   8.954   3.860
  245    HB2  CYS  33           1HB      CYS  33  -4.346  10.218   6.531
  246    HB3  CYS  33           2HB      CYS  33  -3.490   8.852   5.823
  247    HG   CYS  33           HG       CYS  33  -2.313  11.619   5.702
  248    H    LYS  34           H        LYS  34  -7.257   9.973   6.224
  249    HA   LYS  34           HA       LYS  34  -7.545   7.545   7.637
  250    HB2  LYS  34           1HB      LYS  34  -9.527   9.772   7.152
  251    HB3  LYS  34           2HB      LYS  34  -9.778   8.441   8.272
  252    HG2  LYS  34           1HG      LYS  34  -7.835   9.163   9.570
  253    HG3  LYS  34           2HG      LYS  34  -7.587  10.501   8.445
  254    HD2  LYS  34           1HD      LYS  34  -8.749  11.297  10.411
  255    HD3  LYS  34           2HD      LYS  34  -9.828  11.357   9.018
  256    HE2  LYS  34           1HE      LYS  34 -10.809   9.199   9.741
  257    HE3  LYS  34           2HE      LYS  34  -9.790   9.252  11.178
  258    HZ1  LYS  34           3HZ      LYS  34 -11.977  10.069  11.683
  259    HZ2  LYS  34           1HZ      LYS  34 -11.893  11.212  10.439
  260    HZ3  LYS  34           2HZ      LYS  34 -10.876  11.347  11.782
  261    H    MET  35           H        MET  35  -8.228   8.296   4.420
  262    HA   MET  35           HA       MET  35 -10.493   6.540   4.112
  263    HB2  MET  35           1HB      MET  35  -9.367   8.515   2.567
  264    HB3  MET  35           2HB      MET  35  -8.832   7.052   1.741
  265    HG2  MET  35           1HG      MET  35 -11.648   7.961   2.279
  266    HG3  MET  35           2HG      MET  35 -10.857   7.731   0.724
  267    HE1  MET  35           3HE      MET  35 -13.468   4.909   0.460
  268    HE2  MET  35           1HE      MET  35 -12.561   6.120  -0.446
  269    HE3  MET  35           2HE      MET  35 -13.603   6.613   0.891
  270    H    ILE  36           H        ILE  36  -7.007   6.362   3.844
  271    HA   ILE  36           HA       ILE  36  -6.968   3.761   2.652
  272    HB   ILE  36           HB       ILE  36  -5.013   5.764   3.460
  273   HG12  ILE  36          1HG1      ILE  36  -3.944   5.134   1.446
  274   HG13  ILE  36          2HG1      ILE  36  -4.717   3.553   1.443
  275   HG21  ILE  36          1HG2      ILE  36  -3.137   4.068   3.575
  276   HG22  ILE  36          2HG2      ILE  36  -4.381   2.870   3.928
  277   HG23  ILE  36          3HG2      ILE  36  -4.142   4.239   5.012
  278   HD11  ILE  36          3HD1      ILE  36  -6.780   4.438   0.821
  279   HD12  ILE  36          1HD1      ILE  36  -5.599   5.263  -0.194
  280   HD13  ILE  36          2HD1      ILE  36  -6.296   6.089   1.207
  281    H    ALA  37           H        ALA  37  -6.990   5.056   5.869
  282    HA   ALA  37           HA       ALA  37  -6.199   2.872   7.337
  283    HB1  ALA  37           1HB      ALA  37  -6.634   4.861   8.500
  284    HB2  ALA  37           2HB      ALA  37  -7.821   3.700   9.097
  285    HB3  ALA  37           3HB      ALA  37  -8.296   4.935   7.933
  286    HA   PRO  38           HA       PRO  38 -10.338   0.708   7.425
  287    HB2  PRO  38           1HB      PRO  38 -12.635   1.688   6.501
  288    HB3  PRO  38           2HB      PRO  38 -11.936   2.279   8.015
  289    HG2  PRO  38           1HG      PRO  38 -11.881   3.514   5.292
  290    HG3  PRO  38           2HG      PRO  38 -12.129   4.286   6.868
  291    HD2  PRO  38           1HD      PRO  38  -9.723   4.219   5.502
  292    HD3  PRO  38           2HD      PRO  38  -9.898   4.480   7.245
  293    H    MET  39           H        MET  39 -10.032   2.323   4.251
  294    HA   MET  39           HA       MET  39 -11.544   0.322   2.863
  295    HB2  MET  39           1HB      MET  39 -11.406   2.518   1.895
  296    HB3  MET  39           2HB      MET  39  -9.659   2.516   1.984
  297    HG2  MET  39           1HG      MET  39 -11.099   0.548   0.259
  298    HG3  MET  39           2HG      MET  39 -10.807   2.198  -0.290
  299    HE1  MET  39           3HE      MET  39  -8.287   3.226   0.336
  300    HE2  MET  39           1HE      MET  39  -6.822   2.253   0.186
  301    HE3  MET  39           2HE      MET  39  -7.792   2.153   1.657
  302    H    ILE  40           H        ILE  40  -8.163   0.857   3.546
  303    HA   ILE  40           HA       ILE  40  -7.308  -1.375   1.963
  304    HB   ILE  40           HB       ILE  40  -6.066   0.771   3.512
  305   HG12  ILE  40          1HG1      ILE  40  -5.146  -0.755   1.084
  306   HG13  ILE  40          2HG1      ILE  40  -6.241   0.622   1.044
  307   HG21  ILE  40          1HG2      ILE  40  -4.717  -1.918   3.359
  308   HG22  ILE  40          2HG2      ILE  40  -5.078  -0.969   4.802
  309   HG23  ILE  40          3HG2      ILE  40  -3.861  -0.405   3.658
  310   HD11  ILE  40          3HD1      ILE  40  -4.285   1.782   2.355
  311   HD12  ILE  40          1HD1      ILE  40  -4.268   1.642   0.595
  312   HD13  ILE  40          2HD1      ILE  40  -3.335   0.519   1.576
  313    H    GLU  41           H        GLU  41  -7.951  -0.738   5.382
  314    HA   GLU  41           HA       GLU  41  -7.118  -3.318   6.247
  315    HB2  GLU  41           1HB      GLU  41  -7.521  -1.417   7.797
  316    HB3  GLU  41           2HB      GLU  41  -9.242  -1.498   7.437
  317    HG2  GLU  41           1HG      GLU  41  -9.319  -3.759   8.375
  318    HG3  GLU  41           2HG      GLU  41  -7.600  -3.653   8.751
  319    H    LYS  42           H        LYS  42  -9.804  -2.138   4.496
  320    HA   LYS  42           HA       LYS  42 -11.649  -4.211   5.181
  321    HB2  LYS  42           1HB      LYS  42 -12.249  -1.856   4.516
  322    HB3  LYS  42           2HB      LYS  42 -11.819  -2.272   2.867
  323    HG2  LYS  42           1HG      LYS  42 -14.183  -2.439   3.075
  324    HG3  LYS  42           2HG      LYS  42 -13.551  -4.085   2.977
  325    HD2  LYS  42           1HD      LYS  42 -13.774  -4.381   5.344
  326    HD3  LYS  42           2HD      LYS  42 -14.180  -2.680   5.567
  327    HE2  LYS  42           1HE      LYS  42 -16.239  -3.008   4.288
  328    HE3  LYS  42           2HE      LYS  42 -15.828  -4.707   4.064
  329    HZ1  LYS  42           3HZ      LYS  42 -15.962  -5.033   6.441
  330    HZ2  LYS  42           1HZ      LYS  42 -17.409  -4.369   5.876
  331    HZ3  LYS  42           2HZ      LYS  42 -16.293  -3.395   6.689
  332    H    PHE  43           H        PHE  43  -9.435  -3.581   2.458
  333    HA   PHE  43           HA       PHE  43 -10.446  -5.596   0.779
  334    HB2  PHE  43           1HB      PHE  43  -8.547  -5.366  -0.584
  335    HB3  PHE  43           2HB      PHE  43  -8.728  -3.781   0.155
  336    HD1  PHE  43           1HD      PHE  43  -6.844  -6.978   0.722
  337    HD2  PHE  43           2HD      PHE  43  -6.849  -2.733   0.875
  338    HE1  PHE  43           1HE      PHE  43  -4.468  -7.004   1.343
  339    HE2  PHE  43           2HE      PHE  43  -4.480  -2.752   1.525
  340    HZ   PHE  43           HZ       PHE  43  -3.286  -4.889   1.761
  341    H    SER  44           H        SER  44  -7.881  -5.793   3.298
  342    HA   SER  44           HA       SER  44  -7.612  -8.627   2.737
  343    HB2  SER  44           1HB      SER  44  -5.856  -8.595   4.391
  344    HB3  SER  44           2HB      SER  44  -5.628  -7.288   3.240
  345    HG   SER  44           HG       SER  44  -5.739  -5.928   4.824
  346    H    GLU  45           H        GLU  45  -9.467  -6.617   4.785
  347    HA   GLU  45           HA       GLU  45 -10.012  -8.336   6.915
  348    HB2  GLU  45           1HB      GLU  45 -10.803  -5.934   6.586
  349    HB3  GLU  45           2HB      GLU  45 -12.095  -6.607   5.601
  350    HG2  GLU  45           1HG      GLU  45 -12.965  -6.290   7.779
  351    HG3  GLU  45           2HG      GLU  45 -12.724  -8.024   7.563
  352    H    GLN  46           H        GLN  46 -11.190  -8.230   3.612
  353    HA   GLN  46           HA       GLN  46 -12.896 -10.526   4.045
  354    HB2  GLN  46           1HB      GLN  46 -12.159  -9.054   1.516
  355    HB3  GLN  46           2HB      GLN  46 -13.313 -10.375   1.609
  356    HG2  GLN  46           1HG      GLN  46 -14.675  -9.017   3.163
  357    HG3  GLN  46           2HG      GLN  46 -13.552  -7.680   2.916
  358   HE21  GLN  46          1HE2      GLN  46 -14.466  -9.920   0.399
  359   HE22  GLN  46          2HE2      GLN  46 -15.373  -8.790  -0.542
  360    H    TYR  47           H        TYR  47  -9.894  -9.757   2.302
  361    HA   TYR  47           HA       TYR  47  -9.330 -12.632   2.256
  362    HB2  TYR  47           1HB      TYR  47  -8.113 -12.139   0.053
  363    HB3  TYR  47           2HB      TYR  47  -9.866 -12.236   0.047
  364    HD1  TYR  47           1HD      TYR  47  -7.048  -9.785   0.107
  365    HD2  TYR  47           2HD      TYR  47 -11.152 -10.505  -0.780
  366    HE1  TYR  47           1HE      TYR  47  -7.188  -7.599  -1.032
  367    HE2  TYR  47           2HE      TYR  47 -11.303  -8.313  -1.883
  368    HH   TYR  47           HH       TYR  47  -8.635  -6.513  -2.760
  369    HA   PRO  48           HA       PRO  48  -5.772 -10.713   4.358
  370    HB2  PRO  48           1HB      PRO  48  -5.243 -12.788   5.982
  371    HB3  PRO  48           2HB      PRO  48  -6.516 -11.618   6.337
  372    HG2  PRO  48           1HG      PRO  48  -6.744 -14.353   5.141
  373    HG3  PRO  48           2HG      PRO  48  -7.757 -13.584   6.377
  374    HD2  PRO  48           1HD      PRO  48  -8.464 -13.733   3.749
  375    HD3  PRO  48           2HD      PRO  48  -8.987 -12.419   4.821
  376    H    GLN  49           H        GLN  49  -6.168 -13.178   2.173
  377    HA   GLN  49           HA       GLN  49  -3.668 -14.418   2.209
  378    HB2  GLN  49           1HB      GLN  49  -4.173 -14.958  -0.234
  379    HB3  GLN  49           2HB      GLN  49  -5.206 -15.627   1.015
  380    HG2  GLN  49           1HG      GLN  49  -6.648 -14.915  -0.638
  381    HG3  GLN  49           2HG      GLN  49  -6.688 -13.669   0.598
  382   HE21  GLN  49          1HE2      GLN  49  -6.108 -11.618   0.097
  383   HE22  GLN  49          2HE2      GLN  49  -5.632 -11.114  -1.486
  384    H    ALA  50           H        ALA  50  -4.427 -11.281   1.430
  385    HA   ALA  50           HA       ALA  50  -2.053 -10.961  -0.278
  386    HB1  ALA  50           1HB      ALA  50  -4.106  -9.897  -1.082
  387    HB2  ALA  50           2HB      ALA  50  -2.883  -8.691  -0.673
  388    HB3  ALA  50           3HB      ALA  50  -4.227  -8.991   0.427
  389    H    ASP  51           H        ASP  51  -0.496  -9.279   0.321
  390    HA   ASP  51           HA       ASP  51  -0.214  -9.303   3.210
  391    HB2  ASP  51           1HB      ASP  51   1.757  -8.471   1.076
  392    HB3  ASP  51           2HB      ASP  51   2.076  -8.449   2.801
  393    H    PHE  52           H        PHE  52  -0.702  -7.739   4.429
  394    HA   PHE  52           HA       PHE  52  -1.450  -5.175   3.248
  395    HB2  PHE  52           1HB      PHE  52  -2.477  -5.029   5.700
  396    HB3  PHE  52           2HB      PHE  52  -3.312  -5.861   4.400
  397    HD1  PHE  52           1HD      PHE  52  -1.225  -6.331   7.408
  398    HD2  PHE  52           2HD      PHE  52  -3.684  -8.198   4.485
  399    HE1  PHE  52           1HE      PHE  52  -1.264  -8.387   8.758
  400    HE2  PHE  52           2HE      PHE  52  -3.729 -10.257   5.828
  401    HZ   PHE  52           HZ       PHE  52  -2.516 -10.353   7.969
  402    H    TYR  53           H        TYR  53   0.041  -3.618   3.403
  403    HA   TYR  53           HA       TYR  53   1.283  -3.214   6.020
  404    HB2  TYR  53           1HB      TYR  53   2.820  -3.253   3.401
  405    HB3  TYR  53           2HB      TYR  53   3.454  -2.669   4.935
  406    HD1  TYR  53           1HD      TYR  53   3.681  -4.321   6.845
  407    HD2  TYR  53           2HD      TYR  53   2.876  -5.523   2.847
  408    HE1  TYR  53           1HE      TYR  53   4.455  -6.593   7.378
  409    HE2  TYR  53           2HE      TYR  53   3.650  -7.797   3.366
  410    HH   TYR  53           HH       TYR  53   4.169  -8.873   6.558
  411    H    LYS  54           H        LYS  54   1.640  -1.165   6.595
  412    HA   LYS  54           HA       LYS  54   0.675   0.965   4.792
  413    HB2  LYS  54           1HB      LYS  54   0.089   0.307   7.623
  414    HB3  LYS  54           2HB      LYS  54   0.153   2.007   7.199
  415    HG2  LYS  54           1HG      LYS  54  -1.671   1.727   5.675
  416    HG3  LYS  54           2HG      LYS  54  -1.636  -0.023   5.884
  417    HD2  LYS  54           1HD      LYS  54  -2.235   0.255   8.241
  418    HD3  LYS  54           2HD      LYS  54  -2.259   2.006   8.028
  419    HE2  LYS  54           1HE      LYS  54  -4.077   1.786   6.407
  420    HE3  LYS  54           2HE      LYS  54  -4.044   0.034   6.603
  421    HZ1  LYS  54           3HZ      LYS  54  -5.804   1.027   7.924
  422    HZ2  LYS  54           1HZ      LYS  54  -4.683   2.004   8.733
  423    HZ3  LYS  54           2HZ      LYS  54  -4.642   0.329   8.932
  424    H    LEU  55           H        LEU  55   1.700   3.036   5.042
  425    HA   LEU  55           HA       LEU  55   3.745   3.384   7.030
  426    HB2  LEU  55           1HB      LEU  55   4.999   2.148   5.360
  427    HB3  LEU  55           2HB      LEU  55   4.448   3.226   4.096
  428    HG   LEU  55           HG       LEU  55   5.999   4.403   6.353
  429   HD11  LEU  55          1HD1      LEU  55   7.181   2.783   4.102
  430   HD12  LEU  55          2HD1      LEU  55   7.314   2.451   5.830
  431   HD13  LEU  55          3HD1      LEU  55   8.095   3.875   5.144
  432   HD21  LEU  55          3HD2      LEU  55   4.921   5.643   4.408
  433   HD22  LEU  55          1HD2      LEU  55   6.177   4.923   3.400
  434   HD23  LEU  55          2HD2      LEU  55   6.621   5.989   4.738
  435    H    ASP  56           H        ASP  56   4.108   5.555   7.440
  436    HA   ASP  56           HA       ASP  56   2.570   7.425   5.811
  437    HB2  ASP  56           1HB      ASP  56   2.726   8.941   7.719
  438    HB3  ASP  56           2HB      ASP  56   1.939   7.436   8.152
  439    H    VAL  57           H        VAL  57   3.497   8.980   4.685
  440    HA   VAL  57           HA       VAL  57   6.285   8.865   4.172
  441    HB   VAL  57           HB       VAL  57   5.913  10.425   2.484
  442   HG11  VAL  57          1HG1      VAL  57   3.933   9.722   1.352
  443   HG12  VAL  57          2HG1      VAL  57   3.156   9.275   2.871
  444   HG13  VAL  57          3HG1      VAL  57   4.533   8.341   2.273
  445   HG21  VAL  57          3HG2      VAL  57   4.076  12.046   2.463
  446   HG22  VAL  57          1HG2      VAL  57   5.077  12.233   3.901
  447   HG23  VAL  57          2HG2      VAL  57   3.513  11.429   4.015
  448    H    ASP  58           H        ASP  58   4.454  10.527   6.500
  449    HA   ASP  58           HA       ASP  58   6.037  12.860   6.799
  450    HB2  ASP  58           1HB      ASP  58   3.815  12.821   7.730
  451    HB3  ASP  58           2HB      ASP  58   4.204  11.419   8.723
  452    H    GLU  59           H        GLU  59   6.043   9.677   8.316
  453    HA   GLU  59           HA       GLU  59   8.442  10.252   9.820
  454    HB2  GLU  59           1HB      GLU  59   6.517   8.662  10.470
  455    HB3  GLU  59           2HB      GLU  59   7.241   7.535   9.331
  456    HG2  GLU  59           1HG      GLU  59   8.020   6.972  11.499
  457    HG3  GLU  59           2HG      GLU  59   9.365   7.710  10.631
  458    H    LEU  60           H        LEU  60   7.481   8.397   6.953
  459    HA   LEU  60           HA       LEU  60  10.350   8.015   6.358
  460    HB2  LEU  60           1HB      LEU  60   8.047   6.136   5.994
  461    HB3  LEU  60           2HB      LEU  60   9.506   5.968   5.045
  462    HG   LEU  60           HG       LEU  60   9.762   4.447   6.791
  463   HD11  LEU  60          1HD1      LEU  60  11.741   5.855   6.449
  464   HD12  LEU  60          2HD1      LEU  60  11.620   5.251   8.100
  465   HD13  LEU  60          3HD1      LEU  60  11.190   6.922   7.741
  466   HD21  LEU  60          3HD2      LEU  60   8.876   6.577   8.723
  467   HD22  LEU  60          1HD2      LEU  60   9.357   4.932   9.136
  468   HD23  LEU  60          2HD2      LEU  60   7.908   5.211   8.172
  469    H    GLY  61           H        GLY  61  10.194  10.049   5.198
  470    HA2  GLY  61           1HA      GLY  61   8.543  10.239   2.857
  471    HA3  GLY  61           2HA      GLY  61   9.825  11.346   3.323
  472    H    ASP  62           H        ASP  62  11.918   9.422   3.486
  473    HA   ASP  62           HA       ASP  62  12.774   9.363   0.793
  474    HB2  ASP  62           1HB      ASP  62  14.371   9.443   2.637
  475    HB3  ASP  62           2HB      ASP  62  13.825   7.870   3.197
  476    H    VAL  63           H        VAL  63  11.216   7.067   2.845
  477    HA   VAL  63           HA       VAL  63  11.448   4.801   1.187
  478    HB   VAL  63           HB       VAL  63   9.257   5.506   3.126
  479   HG11  VAL  63          1HG1      VAL  63   9.973   2.939   1.733
  480   HG12  VAL  63          2HG1      VAL  63   8.422   3.779   1.757
  481   HG13  VAL  63          3HG1      VAL  63   9.013   2.978   3.210
  482   HG21  VAL  63          3HG2      VAL  63  11.699   3.786   3.527
  483   HG22  VAL  63          1HG2      VAL  63  10.475   4.178   4.734
  484   HG23  VAL  63          2HG2      VAL  63  11.530   5.445   4.106
  485    H    ALA  64           H        ALA  64   8.783   7.153   1.565
  486    HA   ALA  64           HA       ALA  64   7.108   6.274  -0.423
  487    HB1  ALA  64           1HB      ALA  64   6.277   8.552  -0.569
  488    HB2  ALA  64           2HB      ALA  64   7.716   9.146   0.260
  489    HB3  ALA  64           3HB      ALA  64   6.574   8.106   1.111
  490    H    GLN  65           H        GLN  65  10.025   8.222  -0.726
  491    HA   GLN  65           HA       GLN  65   9.702   8.756  -3.517
  492    HB2  GLN  65           1HB      GLN  65  12.199   8.825  -1.809
  493    HB3  GLN  65           2HB      GLN  65  12.055   9.498  -3.426
  494    HG2  GLN  65           1HG      GLN  65  10.492  10.387  -1.012
  495    HG3  GLN  65           2HG      GLN  65  11.893  11.213  -1.693
  496   HE21  GLN  65          1HE2      GLN  65  11.159  10.747  -4.439
  497   HE22  GLN  65          2HE2      GLN  65   9.809  11.774  -4.780
  498    H    LYS  66           H        LYS  66  11.270   6.241  -1.653
  499    HA   LYS  66           HA       LYS  66  12.619   4.915  -3.691
  500    HB2  LYS  66           1HB      LYS  66  13.260   4.010  -1.717
  501    HB3  LYS  66           2HB      LYS  66  11.740   4.434  -0.939
  502    HG2  LYS  66           1HG      LYS  66  11.787   2.143  -0.802
  503    HG3  LYS  66           2HG      LYS  66  10.765   2.454  -2.197
  504    HD2  LYS  66           1HD      LYS  66  12.614   1.964  -3.698
  505    HD3  LYS  66           2HD      LYS  66  13.693   1.732  -2.319
  506    HE2  LYS  66           1HE      LYS  66  12.278  -0.135  -1.557
  507    HE3  LYS  66           2HE      LYS  66  11.255   0.079  -2.975
  508    HZ1  LYS  66           3HZ      LYS  66  14.144  -0.588  -3.058
  509    HZ2  LYS  66           1HZ      LYS  66  13.107  -0.471  -4.386
  510    HZ3  LYS  66           2HZ      LYS  66  12.892  -1.708  -3.251
  511    H    ASN  67           H        ASN  67   9.245   5.123  -2.930
  512    HA   ASN  67           HA       ASN  67   8.619   2.630  -4.329
  513    HB2  ASN  67           1HB      ASN  67   6.725   4.381  -2.787
  514    HB3  ASN  67           2HB      ASN  67   6.552   2.686  -3.198
  515   HD21  ASN  67          1HD2      ASN  67   6.723   4.386  -0.681
  516   HD22  ASN  67          2HD2      ASN  67   7.756   3.476   0.332
  517    H    GLU  68           H        GLU  68   8.686   5.955  -4.747
  518    HA   GLU  68           HA       GLU  68   8.125   7.255  -6.506
  519    HB2  GLU  68           1HB      GLU  68   8.286   5.248  -7.943
  520    HB3  GLU  68           2HB      GLU  68   6.600   4.874  -7.589
  521    HG2  GLU  68           1HG      GLU  68   6.880   5.916  -9.785
  522    HG3  GLU  68           2HG      GLU  68   5.904   6.916  -8.710
  523    H    VAL  69           H        VAL  69   6.615   6.798  -4.007
  524    HA   VAL  69           HA       VAL  69   3.996   7.763  -4.903
  525    HB   VAL  69           HB       VAL  69   3.479   5.973  -3.535
  526   HG11  VAL  69          1HG1      VAL  69   4.956   6.560  -1.099
  527   HG12  VAL  69          2HG1      VAL  69   6.010   6.191  -2.464
  528   HG13  VAL  69          3HG1      VAL  69   4.764   5.031  -1.969
  529   HG21  VAL  69          3HG2      VAL  69   2.548   6.917  -1.464
  530   HG22  VAL  69          1HG2      VAL  69   2.228   7.925  -2.875
  531   HG23  VAL  69          2HG2      VAL  69   3.490   8.384  -1.731
  532    H    SER  70           H        SER  70   3.695   9.829  -4.874
  533    HA   SER  70           HA       SER  70   4.821  11.421  -2.676
  534    HB2  SER  70           1HB      SER  70   4.664  12.256  -5.584
  535    HB3  SER  70           2HB      SER  70   5.245  13.259  -4.255
  536    HG   SER  70           HG       SER  70   7.081  12.199  -4.240
  537    H    ALA  71           H        ALA  71   2.118  10.191  -3.655
  538    HA   ALA  71           HA       ALA  71   0.518  12.648  -3.366
  539    HB1  ALA  71           1HB      ALA  71  -1.282  11.484  -4.542
  540    HB2  ALA  71           2HB      ALA  71  -0.262  10.055  -4.698
  541    HB3  ALA  71           3HB      ALA  71   0.182  11.548  -5.524
  542    H    MET  72           H        MET  72  -1.436  12.474  -2.080
  543    HA   MET  72           HA       MET  72  -1.238  10.371  -0.025
  544    HB2  MET  72           1HB      MET  72  -1.955  13.239   0.574
  545    HB3  MET  72           2HB      MET  72  -1.574  11.963   1.721
  546    HG2  MET  72           1HG      MET  72   0.350  13.231  -0.212
  547    HG3  MET  72           2HG      MET  72   0.245  13.562   1.516
  548    HE1  MET  72           3HE      MET  72   2.700  12.402  -0.552
  549    HE2  MET  72           1HE      MET  72   3.589  11.473   0.655
  550    HE3  MET  72           2HE      MET  72   2.982  13.081   1.053
  551    HA   PRO  73           HA       PRO  73  -2.097   8.939   0.622
  552    HB2  PRO  73           1HB      PRO  73  -3.954   6.915   0.624
  553    HB3  PRO  73           2HB      PRO  73  -3.677   8.024   1.965
  554    HG2  PRO  73           1HG      PRO  73  -5.982   7.815   0.251
  555    HG3  PRO  73           2HG      PRO  73  -5.761   8.847   1.674
  556    HD2  PRO  73           1HD      PRO  73  -5.554   9.512  -1.175
  557    HD3  PRO  73           2HD      PRO  73  -5.713  10.590   0.224
  558    H    THR  74           H        THR  74  -1.625   6.616  -0.213
  559    HA   THR  74           HA       THR  74  -2.232   6.234  -3.046
  560    HB   THR  74           HB       THR  74   0.570   6.691  -1.994
  561    HG1  THR  74           1HG      THR  74  -0.199   8.611  -2.627
  562   HG21  THR  74          3HG2      THR  74  -0.143   4.847  -3.991
  563   HG22  THR  74          1HG2      THR  74   1.472   5.475  -3.614
  564   HG23  THR  74          2HG2      THR  74   0.472   6.271  -4.837
  565    H    LEU  75           H        LEU  75  -2.010   4.139  -3.737
  566    HA   LEU  75           HA       LEU  75  -1.148   2.149  -1.730
  567    HB2  LEU  75           1HB      LEU  75  -3.172   1.827  -3.940
  568    HB3  LEU  75           2HB      LEU  75  -2.732   0.609  -2.759
  569    HG   LEU  75           HG       LEU  75  -3.602   2.514  -1.095
  570   HD11  LEU  75          1HD1      LEU  75  -5.277   2.903  -3.576
  571   HD12  LEU  75          2HD1      LEU  75  -4.139   4.081  -2.920
  572   HD13  LEU  75          3HD1      LEU  75  -5.564   3.617  -1.990
  573   HD21  LEU  75          3HD2      LEU  75  -5.194   0.469  -2.611
  574   HD22  LEU  75          1HD2      LEU  75  -5.788   1.318  -1.183
  575   HD23  LEU  75          2HD2      LEU  75  -4.370   0.278  -1.061
  576    H    LEU  76           H        LEU  76   0.357   0.658  -2.430
  577    HA   LEU  76           HA       LEU  76   0.792   0.459  -5.331
  578    HB2  LEU  76           1HB      LEU  76   2.726   1.033  -3.240
  579    HB3  LEU  76           2HB      LEU  76   3.164  -0.377  -4.176
  580    HG   LEU  76           HG       LEU  76   2.477   2.262  -5.459
  581   HD11  LEU  76          1HD1      LEU  76   5.224   1.188  -4.809
  582   HD12  LEU  76          2HD1      LEU  76   4.443   2.550  -4.008
  583   HD13  LEU  76          3HD1      LEU  76   4.866   2.660  -5.723
  584   HD21  LEU  76          3HD2      LEU  76   2.238   0.320  -6.886
  585   HD22  LEU  76          1HD2      LEU  76   3.858  -0.229  -6.454
  586   HD23  LEU  76          2HD2      LEU  76   3.647   1.261  -7.378
  587    H    LEU  77           H        LEU  77   0.286  -1.420  -6.089
  588    HA   LEU  77           HA       LEU  77   0.332  -3.791  -4.358
  589    HB2  LEU  77           1HB      LEU  77  -0.906  -3.202  -7.047
  590    HB3  LEU  77           2HB      LEU  77  -0.746  -4.839  -6.453
  591    HG   LEU  77           HG       LEU  77  -2.371  -4.519  -4.774
  592   HD11  LEU  77          1HD1      LEU  77  -2.262  -1.548  -5.317
  593   HD12  LEU  77          2HD1      LEU  77  -1.556  -2.352  -3.914
  594   HD13  LEU  77          3HD1      LEU  77  -3.305  -2.362  -4.150
  595   HD21  LEU  77          3HD2      LEU  77  -4.289  -3.788  -5.997
  596   HD22  LEU  77          1HD2      LEU  77  -3.196  -4.616  -7.107
  597   HD23  LEU  77          2HD2      LEU  77  -3.288  -2.851  -7.103
  598    H    PHE  78           H        PHE  78   1.901  -5.294  -4.613
  599    HA   PHE  78           HA       PHE  78   3.609  -5.053  -6.998
  600    HB2  PHE  78           1HB      PHE  78   4.391  -5.156  -4.113
  601    HB3  PHE  78           2HB      PHE  78   5.470  -5.821  -5.337
  602    HD1  PHE  78           1HD      PHE  78   6.446  -4.354  -7.047
  603    HD2  PHE  78           2HD      PHE  78   4.106  -2.817  -3.852
  604    HE1  PHE  78           1HE      PHE  78   7.356  -2.113  -7.467
  605    HE2  PHE  78           2HE      PHE  78   5.014  -0.582  -4.270
  606    HZ   PHE  78           HZ       PHE  78   6.640  -0.217  -6.075
  607    H    LYS  79           H        LYS  79   4.384  -6.950  -7.904
  608    HA   LYS  79           HA       LYS  79   3.852  -9.438  -6.406
  609    HB2  LYS  79           1HB      LYS  79   3.434  -8.693  -9.231
  610    HB3  LYS  79           2HB      LYS  79   4.133 -10.278  -8.963
  611    HG2  LYS  79           1HG      LYS  79   1.589  -9.329  -7.672
  612    HG3  LYS  79           2HG      LYS  79   1.650 -10.241  -9.180
  613    HD2  LYS  79           1HD      LYS  79   2.845 -12.051  -7.984
  614    HD3  LYS  79           2HD      LYS  79   2.641 -11.152  -6.480
  615    HE2  LYS  79           1HE      LYS  79   0.938 -12.886  -6.707
  616    HE3  LYS  79           2HE      LYS  79   0.218 -11.276  -6.721
  617    HZ1  LYS  79           3HZ      LYS  79   0.010 -11.395  -9.101
  618    HZ2  LYS  79           1HZ      LYS  79  -0.729 -12.753  -8.413
  619    HZ3  LYS  79           2HZ      LYS  79   0.793 -12.892  -9.146
  620    H    ASN  80           H        ASN  80   5.729 -10.042  -5.531
  621    HA   ASN  80           HA       ASN  80   7.905 -10.535  -5.216
  622    HB2  ASN  80           1HB      ASN  80   8.942 -11.880  -7.128
  623    HB3  ASN  80           2HB      ASN  80   7.490 -12.509  -6.363
  624   HD21  ASN  80          1HD2      ASN  80   5.597 -12.616  -7.537
  625   HD22  ASN  80          2HD2      ASN  80   5.554 -12.400  -9.250
  626    H    GLY  81           H        GLY  81   8.029  -7.985  -5.470
  627    HA2  GLY  81           1HA      GLY  81   9.749  -6.432  -5.662
  628    HA3  GLY  81           2HA      GLY  81  10.657  -7.613  -6.600
  629    H    LYS  82           H        LYS  82   7.614  -7.348  -7.878
  630    HA   LYS  82           HA       LYS  82   8.398  -5.187  -9.724
  631    HB2  LYS  82           1HB      LYS  82   6.745  -7.617 -10.451
  632    HB3  LYS  82           2HB      LYS  82   7.395  -6.403 -11.544
  633    HG2  LYS  82           1HG      LYS  82   9.035  -8.365  -9.946
  634    HG3  LYS  82           2HG      LYS  82   8.620  -8.523 -11.654
  635    HD2  LYS  82           1HD      LYS  82   9.810  -6.438 -12.139
  636    HD3  LYS  82           2HD      LYS  82  10.228  -6.279 -10.433
  637    HE2  LYS  82           1HE      LYS  82  12.097  -7.189 -11.677
  638    HE3  LYS  82           2HE      LYS  82  11.466  -8.393 -10.553
  639    HZ1  LYS  82           3HZ      LYS  82  10.870  -8.266 -13.460
  640    HZ2  LYS  82           1HZ      LYS  82  10.286  -9.431 -12.384
  641    HZ3  LYS  82           2HZ      LYS  82  11.940  -9.349 -12.724
  642    H    GLU  83           H        GLU  83   6.539  -3.926 -10.464
  643    HA   GLU  83           HA       GLU  83   4.537  -3.652  -8.464
  644    HB2  GLU  83           1HB      GLU  83   5.466  -1.838 -10.017
  645    HB3  GLU  83           2HB      GLU  83   4.424  -2.513 -11.261
  646    HG2  GLU  83           1HG      GLU  83   2.460  -1.985  -9.999
  647    HG3  GLU  83           2HG      GLU  83   3.437  -1.501  -8.608
  648    H    VAL  84           H        VAL  84   2.149  -3.620  -9.190
  649    HA   VAL  84           HA       VAL  84   1.529  -5.166 -11.547
  650    HB   VAL  84           HB       VAL  84  -0.427  -6.224 -10.112
  651   HG11  VAL  84          1HG1      VAL  84   0.827  -8.290 -10.048
  652   HG12  VAL  84          2HG1      VAL  84   2.346  -7.401 -10.195
  653   HG13  VAL  84          3HG1      VAL  84   1.196  -7.418 -11.537
  654   HG21  VAL  84          3HG2      VAL  84   0.340  -6.977  -7.953
  655   HG22  VAL  84          1HG2      VAL  84   0.384  -5.216  -8.017
  656   HG23  VAL  84          2HG2      VAL  84   1.877  -6.142  -8.180
  657    H    ALA  85           H        ALA  85   0.558  -3.091  -8.921
  658    HA   ALA  85           HA       ALA  85  -0.893  -1.452 -10.744
  659    HB1  ALA  85           1HB      ALA  85  -2.392  -3.032  -8.686
  660    HB2  ALA  85           2HB      ALA  85  -2.715  -2.897 -10.413
  661    HB3  ALA  85           3HB      ALA  85  -3.019  -1.525  -9.348
  662    H    LYS  86           H        LYS  86  -1.379   0.606  -9.912
  663    HA   LYS  86           HA       LYS  86  -0.583   1.204  -7.169
  664    HB2  LYS  86           1HB      LYS  86   1.477   1.494  -8.436
  665    HB3  LYS  86           2HB      LYS  86   0.645   2.510  -9.605
  666    HG2  LYS  86           1HG      LYS  86   0.282   4.210  -7.914
  667    HG3  LYS  86           2HG      LYS  86   1.036   3.184  -6.695
  668    HD2  LYS  86           1HD      LYS  86   2.605   4.868  -7.476
  669    HD3  LYS  86           2HD      LYS  86   3.145   3.259  -7.951
  670    HE2  LYS  86           1HE      LYS  86   3.438   4.847  -9.773
  671    HE3  LYS  86           2HE      LYS  86   2.249   3.619 -10.197
  672    HZ1  LYS  86           3HZ      LYS  86   0.493   5.208  -9.628
  673    HZ2  LYS  86           1HZ      LYS  86   1.488   5.792 -10.861
  674    HZ3  LYS  86           2HZ      LYS  86   1.659   6.384  -9.289
  675    H    VAL  87           H        VAL  87  -1.883   2.734  -6.280
  676    HA   VAL  87           HA       VAL  87  -3.582   4.294  -8.102
  677    HB   VAL  87           HB       VAL  87  -4.659   2.814  -5.699
  678   HG11  VAL  87          1HG1      VAL  87  -5.830   4.894  -6.152
  679   HG12  VAL  87          2HG1      VAL  87  -6.848   3.516  -6.570
  680   HG13  VAL  87          3HG1      VAL  87  -6.038   4.429  -7.840
  681   HG21  VAL  87          3HG2      VAL  87  -4.103   1.244  -7.483
  682   HG22  VAL  87          1HG2      VAL  87  -5.024   2.211  -8.635
  683   HG23  VAL  87          2HG2      VAL  87  -5.852   1.398  -7.306
  684    H    VAL  88           H        VAL  88  -3.669   6.367  -7.563
  685    HA   VAL  88           HA       VAL  88  -2.543   7.149  -4.982
  686    HB   VAL  88           HB       VAL  88  -2.517   9.466  -5.992
  687   HG11  VAL  88          1HG1      VAL  88  -0.558   9.005  -7.402
  688   HG12  VAL  88          2HG1      VAL  88  -0.979   7.293  -7.415
  689   HG13  VAL  88          3HG1      VAL  88  -0.520   8.076  -5.903
  690   HG21  VAL  88          3HG2      VAL  88  -3.217   7.938  -8.501
  691   HG22  VAL  88          1HG2      VAL  88  -2.679   9.615  -8.442
  692   HG23  VAL  88          2HG2      VAL  88  -4.214   9.157  -7.708
  693    H    GLY  89           H        GLY  89  -4.858   6.150  -4.381
  694    HA2  GLY  89           1HA      GLY  89  -6.250   8.042  -3.009
  695    HA3  GLY  89           2HA      GLY  89  -7.037   8.003  -4.582
  696    H    ALA  90           H        ALA  90  -7.790   7.111  -1.759
  697    HA   ALA  90           HA       ALA  90  -8.100   4.297  -1.864
  698    HB1  ALA  90           1HB      ALA  90  -9.630   6.336  -0.279
  699    HB2  ALA  90           2HB      ALA  90  -8.129   5.561   0.213
  700    HB3  ALA  90           3HB      ALA  90  -9.600   4.599   0.021
  701    H    ASN  91           H        ASN  91  -9.222   3.389  -3.427
  702    HA   ASN  91           HA       ASN  91 -11.876   4.495  -4.056
  703    HB2  ASN  91           1HB      ASN  91  -9.821   4.164  -5.794
  704    HB3  ASN  91           2HB      ASN  91 -10.599   2.594  -5.931
  705   HD21  ASN  91          1HD2      ASN  91 -13.218   3.911  -5.261
  706   HD22  ASN  91          2HD2      ASN  91 -13.720   4.628  -6.751
  707    HA   PRO  92           HA       PRO  92 -12.720   1.008  -1.186
  708    HB2  PRO  92           1HB      PRO  92 -15.309   1.608  -2.578
  709    HB3  PRO  92           2HB      PRO  92 -15.024   1.179  -0.886
  710    HG2  PRO  92           1HG      PRO  92 -15.323   3.741  -1.696
  711    HG3  PRO  92           2HG      PRO  92 -14.291   3.281  -0.333
  712    HD2  PRO  92           1HD      PRO  92 -13.517   4.355  -2.922
  713    HD3  PRO  92           2HD      PRO  92 -12.519   4.102  -1.487
  714    H    ALA  93           H        ALA  93 -14.744   0.772  -4.123
  715    HA   ALA  93           HA       ALA  93 -14.502  -2.079  -4.016
  716    HB1  ALA  93           1HB      ALA  93 -16.581  -0.942  -4.710
  717    HB2  ALA  93           2HB      ALA  93 -16.011  -2.120  -5.893
  718    HB3  ALA  93           3HB      ALA  93 -15.763  -0.397  -6.174
  719    H    ALA  94           H        ALA  94 -13.282   0.438  -6.182
  720    HA   ALA  94           HA       ALA  94 -12.219  -1.279  -8.130
  721    HB1  ALA  94           1HB      ALA  94 -11.169   1.443  -7.372
  722    HB2  ALA  94           2HB      ALA  94 -12.550   1.161  -8.429
  723    HB3  ALA  94           3HB      ALA  94 -10.945   0.610  -8.908
  724    H    ILE  95           H        ILE  95 -10.918  -0.178  -5.060
  725    HA   ILE  95           HA       ILE  95  -8.269  -1.157  -5.574
  726    HB   ILE  95           HB       ILE  95  -9.617  -0.404  -2.983
  727   HG12  ILE  95          1HG1      ILE  95  -9.217   1.488  -4.482
  728   HG13  ILE  95          2HG1      ILE  95  -8.138   1.567  -3.093
  729   HG21  ILE  95          1HG2      ILE  95  -6.746  -1.150  -3.502
  730   HG22  ILE  95          2HG2      ILE  95  -7.914  -2.074  -2.560
  731   HG23  ILE  95          3HG2      ILE  95  -7.370  -0.496  -1.987
  732   HD11  ILE  95          3HD1      ILE  95  -6.347   0.601  -4.492
  733   HD12  ILE  95          1HD1      ILE  95  -6.933   2.160  -5.069
  734   HD13  ILE  95          2HD1      ILE  95  -7.438   0.677  -5.876
  735    H    LYS  96           H        LYS  96 -11.027  -2.294  -3.660
  736    HA   LYS  96           HA       LYS  96  -9.757  -4.684  -2.837
  737    HB2  LYS  96           1HB      LYS  96 -12.698  -3.988  -2.969
  738    HB3  LYS  96           2HB      LYS  96 -12.012  -5.376  -2.114
  739    HG2  LYS  96           1HG      LYS  96 -10.935  -4.029  -0.537
  740    HG3  LYS  96           2HG      LYS  96 -11.160  -2.570  -1.498
  741    HD2  LYS  96           1HD      LYS  96 -12.654  -2.798   0.517
  742    HD3  LYS  96           2HD      LYS  96 -13.476  -2.500  -1.013
  743    HE2  LYS  96           1HE      LYS  96 -14.564  -4.217   0.421
  744    HE3  LYS  96           2HE      LYS  96 -14.126  -4.788  -1.184
  745    HZ1  LYS  96           3HZ      LYS  96 -12.536  -5.270   1.274
  746    HZ2  LYS  96           1HZ      LYS  96 -12.218  -5.887  -0.272
  747    HZ3  LYS  96           2HZ      LYS  96 -13.599  -6.382   0.568
  748    H    GLN  97           H        GLN  97 -11.534  -3.788  -5.688
  749    HA   GLN  97           HA       GLN  97 -11.654  -6.460  -6.736
  750    HB2  GLN  97           1HB      GLN  97 -13.205  -4.735  -7.526
  751    HB3  GLN  97           2HB      GLN  97 -11.864  -3.771  -8.127
  752    HG2  GLN  97           1HG      GLN  97 -12.957  -4.911  -9.947
  753    HG3  GLN  97           2HG      GLN  97 -11.326  -5.544  -9.732
  754   HE21  GLN  97          1HE2      GLN  97 -11.791  -7.473 -10.747
  755   HE22  GLN  97          2HE2      GLN  97 -12.798  -8.687 -10.041
  756    H    ALA  98           H        ALA  98  -9.347  -3.837  -6.749
  757    HA   ALA  98           HA       ALA  98  -7.722  -4.758  -8.867
  758    HB1  ALA  98           1HB      ALA  98  -7.600  -2.469  -8.025
  759    HB2  ALA  98           2HB      ALA  98  -6.027  -3.260  -8.009
  760    HB3  ALA  98           3HB      ALA  98  -6.932  -3.068  -6.507
  761    H    ILE  99           H        ILE  99  -7.369  -5.045  -5.356
  762    HA   ILE  99           HA       ILE  99  -5.047  -6.545  -5.292
  763    HB   ILE  99           HB       ILE  99  -7.247  -7.191  -3.358
  764   HG12  ILE  99          1HG1      ILE  99  -7.491  -4.836  -3.405
  765   HG13  ILE  99          2HG1      ILE  99  -6.467  -5.180  -2.016
  766   HG21  ILE  99          1HG2      ILE  99  -5.147  -8.347  -3.123
  767   HG22  ILE  99          2HG2      ILE  99  -5.330  -7.208  -1.787
  768   HG23  ILE  99          3HG2      ILE  99  -4.269  -6.821  -3.144
  769   HD11  ILE  99          3HD1      ILE  99  -5.641  -4.126  -4.691
  770   HD12  ILE  99          1HD1      ILE  99  -4.504  -4.645  -3.442
  771   HD13  ILE  99          2HD1      ILE  99  -5.592  -3.290  -3.134
  772    H    ALA 100           H        ALA 100  -8.379  -7.557  -5.812
  773    HA   ALA 100           HA       ALA 100  -7.859 -10.369  -5.652
  774    HB1  ALA 100           1HB      ALA 100 -10.074  -9.422  -5.196
  775    HB2  ALA 100           2HB      ALA 100 -10.134 -10.631  -6.480
  776    HB3  ALA 100           3HB      ALA 100 -10.200  -8.915  -6.881
  777    H    ALA 101           H        ALA 101  -7.682  -7.976  -8.146
  778    HA   ALA 101           HA       ALA 101  -7.660  -9.853 -10.330
  779    HB1  ALA 101           1HB      ALA 101  -6.942  -6.925 -10.298
  780    HB2  ALA 101           2HB      ALA 101  -8.557  -7.579 -10.589
  781    HB3  ALA 101           3HB      ALA 101  -7.252  -7.917 -11.726
  782    H    ASN 102           H        ASN 102  -5.309  -7.977  -8.502
  783    HA   ASN 102           HA       ASN 102  -3.129  -8.728 -10.247
  784    HB2  ASN 102           1HB      ASN 102  -3.095  -7.213  -7.640
  785    HB3  ASN 102           2HB      ASN 102  -1.737  -7.376  -8.740
  786   HD21  ASN 102          1HD2      ASN 102  -4.627  -5.739  -8.018
  787   HD22  ASN 102          2HD2      ASN 102  -4.640  -4.645  -9.356
  788    H    ALA 103           H        ALA 103  -4.665 -10.107  -7.592
  789    HA   ALA 103           HA       ALA 103  -2.412 -11.477  -6.477
  790    HB1  ALA 103           1HB      ALA 103  -4.416 -11.039  -5.145
  791    HB2  ALA 103           2HB      ALA 103  -4.063 -12.764  -5.224
  792    HB3  ALA 103           3HB      ALA 103  -5.356 -12.082  -6.212
  Start of MODEL   19
    1    H1   MET   1           1H       MET   1  -5.303  -7.279  10.375
    2    H2   MET   1           2H       MET   1  -6.215  -6.511   9.180
    3    H3   MET   1           3H       MET   1  -6.785  -6.572  10.767
    4    HA   MET   1           HA       MET   1  -5.911  -4.391  10.227
    5    HB2  MET   1           1HB      MET   1  -5.789  -5.163  12.540
    6    HB3  MET   1           2HB      MET   1  -4.260  -5.966  12.214
    7    HG2  MET   1           1HG      MET   1  -3.151  -3.888  11.880
    8    HG3  MET   1           2HG      MET   1  -4.676  -3.005  11.926
    9    HE1  MET   1           3HE      MET   1  -6.165  -2.735  14.044
   10    HE2  MET   1           1HE      MET   1  -5.758  -3.349  15.646
   11    HE3  MET   1           2HE      MET   1  -6.183  -4.471  14.354
   12    H    VAL   2           H        VAL   2  -4.320  -3.141   9.341
   13    HA   VAL   2           HA       VAL   2  -2.426  -4.605   7.689
   14    HB   VAL   2           HB       VAL   2  -3.356  -1.736   7.666
   15   HG11  VAL   2          1HG1      VAL   2  -1.039  -1.829   6.920
   16   HG12  VAL   2          2HG1      VAL   2  -2.117  -1.510   5.561
   17   HG13  VAL   2          3HG1      VAL   2  -1.441  -3.123   5.793
   18   HG21  VAL   2          3HG2      VAL   2  -3.734  -3.759   5.502
   19   HG22  VAL   2          1HG2      VAL   2  -4.681  -2.323   5.863
   20   HG23  VAL   2          2HG2      VAL   2  -4.807  -3.743   6.900
   21    H    THR   3           H        THR   3  -0.281  -4.532   7.874
   22    HA   THR   3           HA       THR   3   0.766  -3.727  10.434
   23    HB   THR   3           HB       THR   3   2.238  -4.967   8.102
   24    HG1  THR   3           1HG      THR   3   0.584  -6.104  10.112
   25   HG21  THR   3          3HG2      THR   3   2.775  -5.017  11.075
   26   HG22  THR   3          1HG2      THR   3   3.694  -4.117   9.870
   27   HG23  THR   3          2HG2      THR   3   3.704  -5.880   9.851
   28    H    GLN   4           H        GLN   4   2.374  -2.311  10.871
   29    HA   GLN   4           HA       GLN   4   2.652  -0.092   9.005
   30    HB2  GLN   4           1HB      GLN   4   1.975   0.259  11.362
   31    HB3  GLN   4           2HB      GLN   4   3.513  -0.405  11.888
   32    HG2  GLN   4           1HG      GLN   4   3.848   1.875  12.044
   33    HG3  GLN   4           2HG      GLN   4   4.583   1.463  10.498
   34   HE21  GLN   4          1HE2      GLN   4   1.820   1.176   9.336
   35   HE22  GLN   4          2HE2      GLN   4   1.329   2.786   9.023
   36    H    PHE   5           H        PHE   5   4.475   0.311   7.886
   37    HA   PHE   5           HA       PHE   5   6.811  -1.354   8.198
   38    HB2  PHE   5           1HB      PHE   5   6.102   0.941   6.409
   39    HB3  PHE   5           2HB      PHE   5   7.759   0.370   6.514
   40    HD1  PHE   5           2HD      PHE   5   6.880  -2.622   6.845
   41    HD2  PHE   5           1HD      PHE   5   5.879   0.465   4.096
   42    HE1  PHE   5           2HE      PHE   5   6.409  -4.312   5.126
   43    HE2  PHE   5           1HE      PHE   5   5.405  -1.222   2.373
   44    HZ   PHE   5           HZ       PHE   5   5.672  -3.610   2.886
   45    H    LYS   6           H        LYS   6   8.991  -0.323   8.309
   46    HA   LYS   6           HA       LYS   6   8.961   1.927  10.190
   47    HB2  LYS   6           1HB      LYS   6  11.089  -0.203  10.142
   48    HB3  LYS   6           2HB      LYS   6  10.783   0.989  11.396
   49    HG2  LYS   6           1HG      LYS   6   8.968  -1.304  10.692
   50    HG3  LYS   6           2HG      LYS   6  10.098  -1.276  12.043
   51    HD2  LYS   6           1HD      LYS   6   7.788   0.632  11.662
   52    HD3  LYS   6           2HD      LYS   6   7.781  -0.771  12.730
   53    HE2  LYS   6           1HE      LYS   6   9.603   1.624  12.946
   54    HE3  LYS   6           2HE      LYS   6   8.217   1.275  13.975
   55    HZ1  LYS   6           3HZ      LYS   6   9.346  -0.757  14.698
   56    HZ2  LYS   6           1HZ      LYS   6  10.237   0.631  15.071
   57    HZ3  LYS   6           2HZ      LYS   6  10.696  -0.341  13.769
   58    H    THR   7           H        THR   7  10.737   0.280   7.612
   59    HA   THR   7           HA       THR   7  11.762   2.882   6.750
   60    HB   THR   7           HB       THR   7  14.026   1.969   6.306
   61    HG1  THR   7           1HG      THR   7  13.003  -0.266   7.757
   62   HG21  THR   7          3HG2      THR   7  13.207   1.864   9.211
   63   HG22  THR   7          1HG2      THR   7  13.665   3.309   8.310
   64   HG23  THR   7          2HG2      THR   7  14.857   2.045   8.611
   65    H    ALA   8           H        ALA   8  13.115   2.427   4.576
   66    HA   ALA   8           HA       ALA   8  11.264   1.373   2.719
   67    HB1  ALA   8           1HB      ALA   8  13.026   1.721   1.047
   68    HB2  ALA   8           2HB      ALA   8  14.167   2.072   2.344
   69    HB3  ALA   8           3HB      ALA   8  12.784   3.130   2.073
   70    H    SER   9           H        SER   9  13.971  -0.020   4.420
   71    HA   SER   9           HA       SER   9  14.375  -2.326   2.904
   72    HB2  SER   9           1HB      SER   9  15.741  -1.589   4.897
   73    HB3  SER   9           2HB      SER   9  14.443  -2.189   5.928
   74    HG   SER   9           HG       SER   9  16.343  -3.571   4.459
   75    H    GLU  10           H        GLU  10  12.172  -1.808   5.672
   76    HA   GLU  10           HA       GLU  10  10.733  -4.127   5.633
   77    HB2  GLU  10           1HB      GLU  10  10.050  -1.284   6.238
   78    HB3  GLU  10           2HB      GLU  10   8.785  -2.496   6.265
   79    HG2  GLU  10           1HG      GLU  10   9.620  -2.161   8.459
   80    HG3  GLU  10           2HG      GLU  10  10.074  -3.770   7.917
   81    H    PHE  11           H        PHE  11  10.220  -1.241   3.613
   82    HA   PHE  11           HA       PHE  11   7.865  -2.091   2.363
   83    HB2  PHE  11           1HB      PHE  11   8.796   0.232   2.272
   84    HB3  PHE  11           2HB      PHE  11  10.023  -0.344   1.155
   85    HD1  PHE  11           2HD      PHE  11   9.289  -1.220  -1.098
   86    HD2  PHE  11           1HD      PHE  11   6.659   0.878   1.510
   87    HE1  PHE  11           2HE      PHE  11   7.784  -0.754  -2.987
   88    HE2  PHE  11           1HE      PHE  11   5.145   1.364  -0.402
   89    HZ   PHE  11           HZ       PHE  11   5.725   0.531  -2.634
   90    H    ASP  12           H        ASP  12  11.189  -2.259   1.170
   91    HA   ASP  12           HA       ASP  12  10.572  -3.665  -1.202
   92    HB2  ASP  12           1HB      ASP  12  12.625  -2.345  -0.908
   93    HB3  ASP  12           2HB      ASP  12  13.197  -3.494   0.296
   94    H    SER  13           H        SER  13  11.510  -4.783   2.022
   95    HA   SER  13           HA       SER  13  11.948  -7.477   1.306
   96    HB2  SER  13           1HB      SER  13  11.165  -6.255   3.960
   97    HB3  SER  13           2HB      SER  13  11.650  -7.938   3.745
   98    HG   SER  13           HG       SER  13  13.296  -5.834   2.826
   99    H    ALA  14           H        ALA  14   9.030  -5.694   2.121
  100    HA   ALA  14           HA       ALA  14   7.375  -8.012   2.165
  101    HB1  ALA  14           1HB      ALA  14   6.726  -5.946   3.329
  102    HB2  ALA  14           2HB      ALA  14   5.499  -6.460   2.169
  103    HB3  ALA  14           3HB      ALA  14   6.588  -5.128   1.772
  104    H    ILE  15           H        ILE  15   8.421  -5.676  -0.199
  105    HA   ILE  15           HA       ILE  15   6.648  -6.281  -2.286
  106    HB   ILE  15           HB       ILE  15   9.492  -5.333  -2.512
  107   HG12  ILE  15          1HG1      ILE  15   8.462  -3.671  -1.239
  108   HG13  ILE  15          2HG1      ILE  15   8.292  -3.110  -2.899
  109   HG21  ILE  15          1HG2      ILE  15   9.102  -4.738  -4.690
  110   HG22  ILE  15          2HG2      ILE  15   7.353  -4.723  -4.479
  111   HG23  ILE  15          3HG2      ILE  15   8.213  -6.259  -4.562
  112   HD11  ILE  15          3HD1      ILE  15   6.157  -4.492  -1.293
  113   HD12  ILE  15          1HD1      ILE  15   5.996  -3.892  -2.943
  114   HD13  ILE  15          2HD1      ILE  15   6.255  -2.762  -1.617
  115    H    ALA  16           H        ALA  16   9.712  -7.712  -1.335
  116    HA   ALA  16           HA       ALA  16  10.113  -9.136  -3.768
  117    HB1  ALA  16           1HB      ALA  16  11.994 -10.175  -2.618
  118    HB2  ALA  16           2HB      ALA  16  11.423  -9.514  -1.084
  119    HB3  ALA  16           3HB      ALA  16  11.970  -8.429  -2.363
  120    H    GLN  17           H        GLN  17   7.832  -9.650  -1.559
  121    HA   GLN  17           HA       GLN  17   7.958 -12.486  -1.276
  122    HB2  GLN  17           1HB      GLN  17   5.826 -10.421  -0.772
  123    HB3  GLN  17           2HB      GLN  17   5.613 -12.126  -0.441
  124    HG2  GLN  17           1HG      GLN  17   7.449 -12.091   1.133
  125    HG3  GLN  17           2HG      GLN  17   7.749 -10.396   0.764
  126   HE21  GLN  17          1HE2      GLN  17   4.925  -9.702   0.665
  127   HE22  GLN  17          2HE2      GLN  17   4.357  -9.729   2.296
  128    H    ASP  18           H        ASP  18   6.777 -14.023  -2.419
  129    HA   ASP  18           HA       ASP  18   6.253 -13.246  -5.156
  130    HB2  ASP  18           1HB      ASP  18   7.530 -15.326  -4.436
  131    HB3  ASP  18           2HB      ASP  18   5.973 -16.011  -3.985
  132    H    LYS  19           H        LYS  19   4.406 -12.321  -3.129
  133    HA   LYS  19           HA       LYS  19   1.979 -13.294  -4.423
  134    HB2  LYS  19           1HB      LYS  19   0.774 -13.051  -2.191
  135    HB3  LYS  19           2HB      LYS  19   1.780 -14.474  -2.399
  136    HG2  LYS  19           1HG      LYS  19   3.097 -12.157  -1.151
  137    HG3  LYS  19           2HG      LYS  19   1.803 -12.911  -0.215
  138    HD2  LYS  19           1HD      LYS  19   2.950 -15.122  -0.660
  139    HD3  LYS  19           2HD      LYS  19   4.316 -14.189  -1.273
  140    HE2  LYS  19           1HE      LYS  19   4.572 -13.094   0.870
  141    HE3  LYS  19           2HE      LYS  19   3.133 -13.901   1.484
  142    HZ1  LYS  19           3HZ      LYS  19   4.255 -16.019   1.253
  143    HZ2  LYS  19           1HZ      LYS  19   5.152 -14.984   2.242
  144    HZ3  LYS  19           2HZ      LYS  19   5.636 -15.260   0.645
  145    H    LEU  20           H        LEU  20   0.098 -11.695  -3.491
  146    HA   LEU  20           HA       LEU  20   0.907  -9.213  -4.668
  147    HB2  LEU  20           1HB      LEU  20  -1.337 -10.444  -4.914
  148    HB3  LEU  20           2HB      LEU  20  -1.748  -9.746  -3.361
  149    HG   LEU  20           HG       LEU  20  -2.652  -8.509  -5.339
  150   HD11  LEU  20          1HD1      LEU  20  -2.129  -6.303  -4.533
  151   HD12  LEU  20          2HD1      LEU  20  -0.708  -6.914  -3.688
  152   HD13  LEU  20          3HD1      LEU  20  -2.319  -7.400  -3.165
  153   HD21  LEU  20          3HD2      LEU  20  -1.172  -7.174  -6.681
  154   HD22  LEU  20          1HD2      LEU  20  -0.710  -8.872  -6.798
  155   HD23  LEU  20          2HD2      LEU  20   0.228  -7.766  -5.789
  156    H    VAL  21           H        VAL  21   1.846  -7.650  -3.627
  157    HA   VAL  21           HA       VAL  21   1.412  -7.328  -0.738
  158    HB   VAL  21           HB       VAL  21   3.411  -5.697  -2.222
  159   HG11  VAL  21          1HG1      VAL  21   3.418  -7.039   0.475
  160   HG12  VAL  21          2HG1      VAL  21   3.099  -5.336   0.145
  161   HG13  VAL  21          3HG1      VAL  21   4.702  -6.008  -0.156
  162   HG21  VAL  21          3HG2      VAL  21   3.868  -7.812  -3.217
  163   HG22  VAL  21          1HG2      VAL  21   3.772  -8.633  -1.656
  164   HG23  VAL  21          2HG2      VAL  21   5.101  -7.522  -1.988
  165    H    VAL  22           H        VAL  22  -0.054  -5.813  -0.175
  166    HA   VAL  22           HA       VAL  22  -0.402  -3.505  -1.974
  167    HB   VAL  22           HB       VAL  22  -2.231  -4.245   0.303
  168   HG11  VAL  22          1HG1      VAL  22  -3.831  -2.829  -0.892
  169   HG12  VAL  22          2HG1      VAL  22  -2.617  -2.505  -2.128
  170   HG13  VAL  22          3HG1      VAL  22  -2.363  -1.943  -0.477
  171   HG21  VAL  22          3HG2      VAL  22  -3.731  -5.239  -1.365
  172   HG22  VAL  22          1HG2      VAL  22  -2.211  -6.122  -1.223
  173   HG23  VAL  22          2HG2      VAL  22  -2.478  -5.038  -2.590
  174    H    VAL  23           H        VAL  23   0.784  -1.822  -1.366
  175    HA   VAL  23           HA       VAL  23   1.239  -1.488   1.512
  176    HB   VAL  23           HB       VAL  23   2.842  -0.229  -0.708
  177   HG11  VAL  23          1HG1      VAL  23   3.352  -0.485   2.256
  178   HG12  VAL  23          2HG1      VAL  23   2.816   0.979   1.435
  179   HG13  VAL  23          3HG1      VAL  23   4.404   0.302   1.079
  180   HG21  VAL  23          3HG2      VAL  23   3.134  -2.628  -0.774
  181   HG22  VAL  23          1HG2      VAL  23   3.376  -2.671   0.973
  182   HG23  VAL  23          2HG2      VAL  23   4.570  -1.888  -0.064
  183    H    ALA  24           H        ALA  24   0.307   0.002   2.507
  184    HA   ALA  24           HA       ALA  24  -1.328   1.972   1.105
  185    HB1  ALA  24           1HB      ALA  24  -2.064   0.474   3.058
  186    HB2  ALA  24           2HB      ALA  24  -2.502   2.179   3.119
  187    HB3  ALA  24           3HB      ALA  24  -1.152   1.581   4.079
  188    H    PHE  25           H        PHE  25   0.121   3.620   0.457
  189    HA   PHE  25           HA       PHE  25   1.748   4.798   2.576
  190    HB2  PHE  25           1HB      PHE  25   1.962   4.670  -0.315
  191    HB3  PHE  25           2HB      PHE  25   2.258   6.290   0.320
  192    HD1  PHE  25           2HD      PHE  25   3.024   2.817   1.379
  193    HD2  PHE  25           1HD      PHE  25   4.472   6.747   0.697
  194    HE1  PHE  25           2HE      PHE  25   5.253   2.114   2.129
  195    HE2  PHE  25           1HE      PHE  25   6.706   6.058   1.454
  196    HZ   PHE  25           HZ       PHE  25   7.095   3.738   2.170
  197    H    TYR  26           H        TYR  26   1.228   6.466   3.660
  198    HA   TYR  26           HA       TYR  26  -0.298   8.650   2.542
  199    HB2  TYR  26           1HB      TYR  26  -1.979   8.605   4.372
  200    HB3  TYR  26           2HB      TYR  26  -2.112   7.213   3.304
  201    HD1  TYR  26           2HD      TYR  26  -1.053   8.327   6.665
  202    HD2  TYR  26           1HD      TYR  26  -1.724   4.994   4.115
  203    HE1  TYR  26           2HE      TYR  26  -0.885   6.818   8.600
  204    HE2  TYR  26           1HE      TYR  26  -1.569   3.479   6.031
  205    HH   TYR  26           HH       TYR  26  -1.565   4.600   9.272
  206    H    ALA  27           H        ALA  27  -0.380  10.477   4.166
  207    HA   ALA  27           HA       ALA  27   1.858  10.252   6.067
  208    HB1  ALA  27           1HB      ALA  27   2.338  11.768   4.185
  209    HB2  ALA  27           2HB      ALA  27   2.319  12.598   5.738
  210    HB3  ALA  27           3HB      ALA  27   0.946  12.746   4.643
  211    H    THR  28           H        THR  28   1.578  11.006   8.104
  212    HA   THR  28           HA       THR  28  -1.046  10.904   9.129
  213    HB   THR  28           HB       THR  28   0.138  11.754  11.271
  214    HG1  THR  28           1HG      THR  28   2.530  10.901  10.109
  215   HG21  THR  28          3HG2      THR  28   0.982   9.190   9.914
  216   HG22  THR  28          1HG2      THR  28  -0.466   9.425  10.892
  217   HG23  THR  28          2HG2      THR  28   1.127   9.529  11.639
  218    H    TRP  29           H        TRP  29   0.792  13.590   7.951
  219    HA   TRP  29           HA       TRP  29  -0.783  15.555   9.352
  220    HB2  TRP  29           1HB      TRP  29   0.391  17.224   8.024
  221    HB3  TRP  29           2HB      TRP  29   1.539  16.070   8.682
  222    HD1  TRP  29           HD       TRP  29   3.082  14.829   6.989
  223    HE1  TRP  29           1HE      TRP  29   3.364  14.890   4.429
  224    HE3  TRP  29           3HE      TRP  29  -1.081  17.537   5.767
  225    HZ2  TRP  29           2HZ      TRP  29   2.003  15.940   2.195
  226    HZ3  TRP  29           3HZ      TRP  29  -1.521  18.019   3.402
  227    HH2  TRP  29           HH       TRP  29  -0.008  17.243   1.648
  228    H    CYS  30           H        CYS  30  -1.177  13.624   6.614
  229    HA   CYS  30           HA       CYS  30  -2.812  15.475   5.106
  230    HB2  CYS  30           1HB      CYS  30  -1.286  13.820   4.028
  231    HB3  CYS  30           2HB      CYS  30  -2.289  12.524   4.664
  232    HG   CYS  30           HG       CYS  30  -3.457  14.907   2.507
  233    H    GLY  31           H        GLY  31  -5.013  15.368   4.868
  234    HA2  GLY  31           1HA      GLY  31  -6.481  14.279   7.073
  235    HA3  GLY  31           2HA      GLY  31  -7.146  15.180   5.723
  236    HA   PRO  32           HA       PRO  32  -8.665  11.546   3.728
  237    HB2  PRO  32           1HB      PRO  32  -7.334  11.190   1.365
  238    HB3  PRO  32           2HB      PRO  32  -8.591  12.404   1.621
  239    HG2  PRO  32           1HG      PRO  32  -5.616  12.712   1.688
  240    HG3  PRO  32           2HG      PRO  32  -6.838  13.777   0.966
  241    HD2  PRO  32           1HD      PRO  32  -5.704  14.331   3.338
  242    HD3  PRO  32           2HD      PRO  32  -7.404  14.718   3.002
  243    H    CYS  33           H        CYS  33  -5.573  11.392   4.924
  244    HA   CYS  33           HA       CYS  33  -4.674   8.877   3.991
  245    HB2  CYS  33           1HB      CYS  33  -3.192   8.858   5.896
  246    HB3  CYS  33           2HB      CYS  33  -3.273  10.509   5.291
  247    HG   CYS  33           HG       CYS  33  -4.185  11.626   7.440
  248    H    LYS  34           H        LYS  34  -6.997   9.878   6.341
  249    HA   LYS  34           HA       LYS  34  -7.261   7.431   7.735
  250    HB2  LYS  34           1HB      LYS  34  -9.164   9.750   7.421
  251    HB3  LYS  34           2HB      LYS  34  -9.424   8.401   8.513
  252    HG2  LYS  34           1HG      LYS  34  -7.042  10.235   8.640
  253    HG3  LYS  34           2HG      LYS  34  -8.510  10.444   9.596
  254    HD2  LYS  34           1HD      LYS  34  -6.737   8.001   9.651
  255    HD3  LYS  34           2HD      LYS  34  -6.704   9.303  10.840
  256    HE2  LYS  34           1HE      LYS  34  -9.059   8.833  11.388
  257    HE3  LYS  34           2HE      LYS  34  -9.048   7.499  10.237
  258    HZ1  LYS  34           3HZ      LYS  34  -7.329   7.696  12.649
  259    HZ2  LYS  34           1HZ      LYS  34  -7.358   6.406  11.557
  260    HZ3  LYS  34           2HZ      LYS  34  -8.714   6.738  12.509
  261    H    MET  35           H        MET  35  -8.114   8.250   4.562
  262    HA   MET  35           HA       MET  35 -10.471   6.567   4.433
  263    HB2  MET  35           1HB      MET  35  -9.496   8.558   2.827
  264    HB3  MET  35           2HB      MET  35  -8.989   7.121   1.939
  265    HG2  MET  35           1HG      MET  35 -11.786   7.960   2.681
  266    HG3  MET  35           2HG      MET  35 -11.094   7.788   1.071
  267    HE1  MET  35           3HE      MET  35 -13.812   6.490   1.254
  268    HE2  MET  35           1HE      MET  35 -13.489   4.861   0.657
  269    HE3  MET  35           2HE      MET  35 -12.692   6.246  -0.088
  270    H    ILE  36           H        ILE  36  -7.041   6.374   3.869
  271    HA   ILE  36           HA       ILE  36  -7.093   3.798   2.640
  272    HB   ILE  36           HB       ILE  36  -5.097   5.800   3.326
  273   HG12  ILE  36          1HG1      ILE  36  -4.136   5.127   1.239
  274   HG13  ILE  36          2HG1      ILE  36  -5.024   3.609   1.260
  275   HG21  ILE  36          1HG2      ILE  36  -3.209   4.090   3.262
  276   HG22  ILE  36          2HG2      ILE  36  -4.427   2.916   3.762
  277   HG23  ILE  36          3HG2      ILE  36  -4.069   4.306   4.784
  278   HD11  ILE  36          3HD1      ILE  36  -7.081   4.708   0.905
  279   HD12  ILE  36          1HD1      ILE  36  -5.937   5.330  -0.283
  280   HD13  ILE  36          2HD1      ILE  36  -6.355   6.298   1.138
  281    H    ALA  37           H        ALA  37  -6.906   5.028   5.871
  282    HA   ALA  37           HA       ALA  37  -5.944   2.827   7.222
  283    HB1  ALA  37           1HB      ALA  37  -6.293   4.828   8.425
  284    HB2  ALA  37           2HB      ALA  37  -7.349   3.614   9.149
  285    HB3  ALA  37           3HB      ALA  37  -8.016   4.833   8.066
  286    HA   PRO  38           HA       PRO  38 -10.043   0.624   7.637
  287    HB2  PRO  38           1HB      PRO  38 -12.413   1.595   6.915
  288    HB3  PRO  38           2HB      PRO  38 -11.597   2.192   8.365
  289    HG2  PRO  38           1HG      PRO  38 -11.747   3.422   5.642
  290    HG3  PRO  38           2HG      PRO  38 -11.928   4.194   7.228
  291    HD2  PRO  38           1HD      PRO  38  -9.598   4.200   5.755
  292    HD3  PRO  38           2HD      PRO  38  -9.679   4.400   7.513
  293    H    MET  39           H        MET  39  -9.898   2.294   4.491
  294    HA   MET  39           HA       MET  39 -11.508   0.333   3.156
  295    HB2  MET  39           1HB      MET  39 -11.438   2.535   2.224
  296    HB3  MET  39           2HB      MET  39  -9.686   2.545   2.206
  297    HG2  MET  39           1HG      MET  39 -11.243   0.617   0.531
  298    HG3  MET  39           2HG      MET  39 -10.947   2.269  -0.004
  299    HE1  MET  39           3HE      MET  39  -8.361   3.228   0.458
  300    HE2  MET  39           1HE      MET  39  -6.936   2.210   0.239
  301    HE3  MET  39           2HE      MET  39  -7.841   2.136   1.753
  302    H    ILE  40           H        ILE  40  -8.139   0.781   3.811
  303    HA   ILE  40           HA       ILE  40  -7.346  -1.356   2.057
  304    HB   ILE  40           HB       ILE  40  -6.053   0.773   3.544
  305   HG12  ILE  40          1HG1      ILE  40  -5.166  -0.779   1.123
  306   HG13  ILE  40          2HG1      ILE  40  -6.330   0.539   1.077
  307   HG21  ILE  40          1HG2      ILE  40  -4.746  -1.929   3.469
  308   HG22  ILE  40          2HG2      ILE  40  -4.944  -0.832   4.837
  309   HG23  ILE  40          3HG2      ILE  40  -3.818  -0.432   3.544
  310   HD11  ILE  40          3HD1      ILE  40  -4.286   1.480   0.473
  311   HD12  ILE  40          1HD1      ILE  40  -3.425   0.648   1.763
  312   HD13  ILE  40          2HD1      ILE  40  -4.536   1.956   2.149
  313    H    GLU  41           H        GLU  41  -7.742  -0.844   5.542
  314    HA   GLU  41           HA       GLU  41  -6.948  -3.497   6.185
  315    HB2  GLU  41           1HB      GLU  41  -8.743  -1.550   7.664
  316    HB3  GLU  41           2HB      GLU  41  -8.225  -3.107   8.320
  317    HG2  GLU  41           1HG      GLU  41  -5.845  -2.309   7.893
  318    HG3  GLU  41           2HG      GLU  41  -6.545  -0.712   7.650
  319    H    LYS  42           H        LYS  42  -9.703  -2.149   4.715
  320    HA   LYS  42           HA       LYS  42 -11.518  -4.272   5.278
  321    HB2  LYS  42           1HB      LYS  42 -12.272  -1.985   4.724
  322    HB3  LYS  42           2HB      LYS  42 -11.639  -2.181   3.096
  323    HG2  LYS  42           1HG      LYS  42 -13.998  -2.533   3.038
  324    HG3  LYS  42           2HG      LYS  42 -13.207  -4.092   2.790
  325    HD2  LYS  42           1HD      LYS  42 -13.521  -4.566   5.213
  326    HD3  LYS  42           2HD      LYS  42 -14.443  -3.068   5.344
  327    HE2  LYS  42           1HE      LYS  42 -16.032  -3.934   3.675
  328    HE3  LYS  42           2HE      LYS  42 -15.126  -5.445   3.617
  329    HZ1  LYS  42           3HZ      LYS  42 -16.650  -4.337   5.902
  330    HZ2  LYS  42           1HZ      LYS  42 -15.563  -5.628   6.064
  331    HZ3  LYS  42           2HZ      LYS  42 -16.928  -5.782   5.072
  332    H    PHE  43           H        PHE  43  -9.308  -3.528   2.557
  333    HA   PHE  43           HA       PHE  43 -10.370  -5.435   0.807
  334    HB2  PHE  43           1HB      PHE  43  -8.448  -5.260  -0.559
  335    HB3  PHE  43           2HB      PHE  43  -8.637  -3.678   0.181
  336    HD1  PHE  43           1HD      PHE  43  -6.770  -6.881   0.763
  337    HD2  PHE  43           2HD      PHE  43  -6.749  -2.638   0.916
  338    HE1  PHE  43           1HE      PHE  43  -4.406  -6.925   1.425
  339    HE2  PHE  43           2HE      PHE  43  -4.389  -2.676   1.604
  340    HZ   PHE  43           HZ       PHE  43  -3.217  -4.820   1.864
  341    H    SER  44           H        SER  44  -7.818  -5.871   3.294
  342    HA   SER  44           HA       SER  44  -7.614  -8.667   2.579
  343    HB2  SER  44           1HB      SER  44  -5.915  -8.779   4.309
  344    HB3  SER  44           2HB      SER  44  -5.611  -7.428   3.225
  345    HG   SER  44           HG       SER  44  -6.061  -7.403   5.897
  346    H    GLU  45           H        GLU  45  -9.440  -6.730   4.759
  347    HA   GLU  45           HA       GLU  45 -10.202  -8.688   6.620
  348    HB2  GLU  45           1HB      GLU  45 -10.807  -6.259   6.724
  349    HB3  GLU  45           2HB      GLU  45 -11.951  -6.529   5.418
  350    HG2  GLU  45           1HG      GLU  45 -13.185  -8.094   6.829
  351    HG3  GLU  45           2HG      GLU  45 -12.042  -7.805   8.139
  352    H    GLN  46           H        GLN  46 -11.028  -8.129   3.291
  353    HA   GLN  46           HA       GLN  46 -13.038 -10.204   3.237
  354    HB2  GLN  46           1HB      GLN  46 -11.775  -8.595   1.008
  355    HB3  GLN  46           2HB      GLN  46 -13.117  -9.711   0.810
  356    HG2  GLN  46           1HG      GLN  46 -13.352  -7.441   2.728
  357    HG3  GLN  46           2HG      GLN  46 -13.542  -7.155   1.000
  358   HE21  GLN  46          1HE2      GLN  46 -14.532 -10.134   2.563
  359   HE22  GLN  46          2HE2      GLN  46 -16.228  -9.884   2.374
  360    H    TYR  47           H        TYR  47  -9.737  -9.650   2.107
  361    HA   TYR  47           HA       TYR  47  -9.386 -12.535   1.906
  362    HB2  TYR  47           1HB      TYR  47  -7.987 -12.049  -0.199
  363    HB3  TYR  47           2HB      TYR  47  -9.739 -12.073  -0.321
  364    HD1  TYR  47           2HD      TYR  47  -6.824  -9.767  -0.077
  365    HD2  TYR  47           1HD      TYR  47 -10.928 -10.242  -1.107
  366    HE1  TYR  47           2HE      TYR  47  -6.825  -7.532  -1.130
  367    HE2  TYR  47           1HE      TYR  47 -10.935  -8.006  -2.131
  368    HH   TYR  47           HH       TYR  47  -9.497  -5.847  -1.757
  369    HA   PRO  48           HA       PRO  48  -5.867 -10.861   4.296
  370    HB2  PRO  48           1HB      PRO  48  -5.508 -13.076   5.793
  371    HB3  PRO  48           2HB      PRO  48  -6.707 -11.844   6.190
  372    HG2  PRO  48           1HG      PRO  48  -7.089 -14.471   4.801
  373    HG3  PRO  48           2HG      PRO  48  -8.079 -13.722   6.068
  374    HD2  PRO  48           1HD      PRO  48  -8.759 -13.637   3.447
  375    HD3  PRO  48           2HD      PRO  48  -9.157 -12.328   4.579
  376    H    GLN  49           H        GLN  49  -6.291 -13.061   1.917
  377    HA   GLN  49           HA       GLN  49  -3.957 -14.622   1.885
  378    HB2  GLN  49           1HB      GLN  49  -5.860 -15.167   0.500
  379    HB3  GLN  49           2HB      GLN  49  -5.745 -13.626  -0.336
  380    HG2  GLN  49           1HG      GLN  49  -3.277 -14.690  -0.773
  381    HG3  GLN  49           2HG      GLN  49  -4.304 -16.123  -0.787
  382   HE21  GLN  49          1HE2      GLN  49  -5.182 -12.866  -1.802
  383   HE22  GLN  49          2HE2      GLN  49  -5.433 -13.266  -3.461
  384    H    ALA  50           H        ALA  50  -4.494 -11.297   1.169
  385    HA   ALA  50           HA       ALA  50  -1.980 -11.125  -0.342
  386    HB1  ALA  50           1HB      ALA  50  -2.714  -8.890  -0.963
  387    HB2  ALA  50           2HB      ALA  50  -4.130  -9.054   0.075
  388    HB3  ALA  50           3HB      ALA  50  -3.957 -10.086  -1.349
  389    H    ASP  51           H        ASP  51  -0.523  -9.288   0.232
  390    HA   ASP  51           HA       ASP  51  -0.286  -9.336   3.121
  391    HB2  ASP  51           1HB      ASP  51   1.683  -8.684   0.952
  392    HB3  ASP  51           2HB      ASP  51   1.986  -8.234   2.618
  393    H    PHE  52           H        PHE  52  -0.629  -7.757   4.396
  394    HA   PHE  52           HA       PHE  52  -1.471  -5.205   3.234
  395    HB2  PHE  52           1HB      PHE  52  -2.449  -5.085   5.718
  396    HB3  PHE  52           2HB      PHE  52  -3.313  -5.885   4.415
  397    HD1  PHE  52           1HD      PHE  52  -1.183  -6.425   7.381
  398    HD2  PHE  52           2HD      PHE  52  -3.694  -8.224   4.455
  399    HE1  PHE  52           1HE      PHE  52  -1.210  -8.506   8.689
  400    HE2  PHE  52           2HE      PHE  52  -3.725 -10.310   5.757
  401    HZ   PHE  52           HZ       PHE  52  -2.483 -10.453   7.878
  402    H    TYR  53           H        TYR  53  -0.010  -3.639   3.372
  403    HA   TYR  53           HA       TYR  53   1.302  -3.199   5.940
  404    HB2  TYR  53           1HB      TYR  53   2.791  -3.304   3.304
  405    HB3  TYR  53           2HB      TYR  53   3.465  -2.730   4.822
  406    HD1  TYR  53           1HD      TYR  53   3.637  -4.382   6.748
  407    HD2  TYR  53           2HD      TYR  53   2.861  -5.573   2.740
  408    HE1  TYR  53           1HE      TYR  53   4.379  -6.660   7.290
  409    HE2  TYR  53           2HE      TYR  53   3.603  -7.860   3.265
  410    HH   TYR  53           HH       TYR  53   3.999  -8.971   6.418
  411    H    LYS  54           H        LYS  54   2.011  -1.079   6.286
  412    HA   LYS  54           HA       LYS  54   1.172   0.952   4.385
  413    HB2  LYS  54           1HB      LYS  54  -0.395   1.985   5.903
  414    HB3  LYS  54           2HB      LYS  54  -0.843   0.299   5.657
  415    HG2  LYS  54           1HG      LYS  54   0.177  -0.277   7.805
  416    HG3  LYS  54           2HG      LYS  54   0.562   1.426   8.063
  417    HD2  LYS  54           1HD      LYS  54  -1.819   1.981   7.965
  418    HD3  LYS  54           2HD      LYS  54  -2.207   0.278   7.708
  419    HE2  LYS  54           1HE      LYS  54  -1.239  -0.270   9.881
  420    HE3  LYS  54           2HE      LYS  54  -0.836   1.427  10.134
  421    HZ1  LYS  54           3HZ      LYS  54  -3.221   1.934  10.004
  422    HZ2  LYS  54           1HZ      LYS  54  -2.854   0.897  11.287
  423    HZ3  LYS  54           2HZ      LYS  54  -3.562   0.285   9.880
  424    H    LEU  55           H        LEU  55   1.838   3.157   5.105
  425    HA   LEU  55           HA       LEU  55   3.766   3.281   7.256
  426    HB2  LEU  55           1HB      LEU  55   5.128   2.265   5.563
  427    HB3  LEU  55           2HB      LEU  55   4.579   3.401   4.355
  428    HG   LEU  55           HG       LEU  55   6.047   4.494   6.707
  429   HD11  LEU  55          1HD1      LEU  55   8.189   4.063   5.574
  430   HD12  LEU  55          2HD1      LEU  55   7.350   3.050   4.399
  431   HD13  LEU  55          3HD1      LEU  55   7.407   2.573   6.096
  432   HD21  LEU  55          3HD2      LEU  55   6.166   5.125   3.765
  433   HD22  LEU  55          1HD2      LEU  55   6.758   6.113   5.099
  434   HD23  LEU  55          2HD2      LEU  55   5.023   5.867   4.885
  435    H    ASP  56           H        ASP  56   4.418   5.409   7.759
  436    HA   ASP  56           HA       ASP  56   2.656   7.490   6.692
  437    HB2  ASP  56           1HB      ASP  56   2.698   7.310   9.107
  438    HB3  ASP  56           2HB      ASP  56   4.453   7.431   9.125
  439    H    VAL  57           H        VAL  57   3.370   8.636   5.070
  440    HA   VAL  57           HA       VAL  57   6.023   8.686   4.113
  441    HB   VAL  57           HB       VAL  57   3.837  10.697   3.536
  442   HG11  VAL  57          1HG1      VAL  57   6.005  11.426   2.745
  443   HG12  VAL  57          2HG1      VAL  57   4.987  10.970   1.380
  444   HG13  VAL  57          3HG1      VAL  57   6.257   9.881   1.937
  445   HG21  VAL  57          3HG2      VAL  57   2.948   8.514   3.143
  446   HG22  VAL  57          1HG2      VAL  57   4.400   8.026   2.268
  447   HG23  VAL  57          2HG2      VAL  57   3.326   9.246   1.584
  448    H    ASP  58           H        ASP  58   4.358  10.656   6.458
  449    HA   ASP  58           HA       ASP  58   5.996  12.965   6.248
  450    HB2  ASP  58           1HB      ASP  58   3.765  12.944   7.350
  451    HB3  ASP  58           2HB      ASP  58   4.457  12.003   8.667
  452    H    GLU  59           H        GLU  59   6.242   9.963   8.000
  453    HA   GLU  59           HA       GLU  59   8.645  10.825   9.396
  454    HB2  GLU  59           1HB      GLU  59   7.119   8.220   9.379
  455    HB3  GLU  59           2HB      GLU  59   8.593   8.480  10.302
  456    HG2  GLU  59           1HG      GLU  59   6.103  10.126  10.620
  457    HG3  GLU  59           2HG      GLU  59   6.487   8.713  11.601
  458    H    LEU  60           H        LEU  60   7.705   8.595   6.814
  459    HA   LEU  60           HA       LEU  60  10.566   8.151   6.279
  460    HB2  LEU  60           1HB      LEU  60   8.241   6.281   6.163
  461    HB3  LEU  60           2HB      LEU  60   9.636   5.993   5.152
  462    HG   LEU  60           HG       LEU  60   9.902   4.636   7.061
  463   HD11  LEU  60          1HD1      LEU  60  11.925   5.836   6.346
  464   HD12  LEU  60          2HD1      LEU  60  11.938   5.427   8.061
  465   HD13  LEU  60          3HD1      LEU  60  11.590   7.078   7.553
  466   HD21  LEU  60          3HD2      LEU  60   9.326   7.067   8.743
  467   HD22  LEU  60          1HD2      LEU  60   9.812   5.487   9.359
  468   HD23  LEU  60          2HD2      LEU  60   8.271   5.671   8.518
  469    H    GLY  61           H        GLY  61  10.081  10.232   5.059
  470    HA2  GLY  61           1HA      GLY  61   8.578  10.150   2.657
  471    HA3  GLY  61           2HA      GLY  61   9.805  11.339   3.067
  472    H    ASP  62           H        ASP  62  11.906   9.315   3.407
  473    HA   ASP  62           HA       ASP  62  12.810   9.224   0.708
  474    HB2  ASP  62           1HB      ASP  62  14.780   8.134   1.552
  475    HB3  ASP  62           2HB      ASP  62  14.320   9.377   2.710
  476    H    VAL  63           H        VAL  63  11.007   7.074   2.682
  477    HA   VAL  63           HA       VAL  63  11.396   4.770   1.029
  478    HB   VAL  63           HB       VAL  63   9.041   5.324   2.829
  479   HG11  VAL  63          1HG1      VAL  63  10.226   2.753   1.783
  480   HG12  VAL  63          2HG1      VAL  63   8.734   3.499   1.221
  481   HG13  VAL  63          3HG1      VAL  63   8.844   2.882   2.871
  482   HG21  VAL  63          3HG2      VAL  63  11.184   5.526   4.037
  483   HG22  VAL  63          1HG2      VAL  63  11.621   3.909   3.491
  484   HG23  VAL  63          2HG2      VAL  63  10.242   4.132   4.565
  485    H    ALA  64           H        ALA  64   8.723   7.126   1.374
  486    HA   ALA  64           HA       ALA  64   7.232   6.451  -0.846
  487    HB1  ALA  64           1HB      ALA  64   6.453   8.763  -0.824
  488    HB2  ALA  64           2HB      ALA  64   7.816   9.230   0.194
  489    HB3  ALA  64           3HB      ALA  64   6.587   8.128   0.815
  490    H    GLN  65           H        GLN  65  10.390   7.928  -0.813
  491    HA   GLN  65           HA       GLN  65  10.223   8.645  -3.620
  492    HB2  GLN  65           1HB      GLN  65  12.626   8.567  -1.784
  493    HB3  GLN  65           2HB      GLN  65  12.573   9.297  -3.384
  494    HG2  GLN  65           1HG      GLN  65  10.890  10.886  -2.587
  495    HG3  GLN  65           2HG      GLN  65  10.991  10.172  -0.981
  496   HE21  GLN  65          1HE2      GLN  65  13.904   9.787  -1.220
  497   HE22  GLN  65          2HE2      GLN  65  14.590  11.360  -1.001
  498    H    LYS  66           H        LYS  66  11.320   6.014  -1.669
  499    HA   LYS  66           HA       LYS  66  12.881   4.717  -3.632
  500    HB2  LYS  66           1HB      LYS  66  13.406   3.355  -1.923
  501    HB3  LYS  66           2HB      LYS  66  12.401   4.382  -0.920
  502    HG2  LYS  66           1HG      LYS  66  11.572   2.321  -0.403
  503    HG3  LYS  66           2HG      LYS  66  10.480   2.800  -1.700
  504    HD2  LYS  66           1HD      LYS  66  11.181   0.495  -1.997
  505    HD3  LYS  66           2HD      LYS  66  11.828   1.500  -3.294
  506    HE2  LYS  66           1HE      LYS  66  13.991   1.566  -2.202
  507    HE3  LYS  66           2HE      LYS  66  13.352   0.660  -0.832
  508    HZ1  LYS  66           3HZ      LYS  66  12.925  -1.194  -2.353
  509    HZ2  LYS  66           1HZ      LYS  66  14.567  -0.789  -2.286
  510    HZ3  LYS  66           2HZ      LYS  66  13.632  -0.320  -3.617
  511    H    ASN  67           H        ASN  67   9.485   4.869  -3.001
  512    HA   ASN  67           HA       ASN  67   8.971   2.487  -4.664
  513    HB2  ASN  67           1HB      ASN  67   6.616   2.881  -3.537
  514    HB3  ASN  67           2HB      ASN  67   7.893   2.073  -2.655
  515   HD21  ASN  67          1HD2      ASN  67   7.572   2.699  -0.628
  516   HD22  ASN  67          2HD2      ASN  67   7.507   4.344  -0.135
  517    H    GLU  68           H        GLU  68   8.747   5.872  -4.608
  518    HA   GLU  68           HA       GLU  68   8.164   7.282  -6.285
  519    HB2  GLU  68           1HB      GLU  68   8.550   5.350  -7.806
  520    HB3  GLU  68           2HB      GLU  68   6.841   4.949  -7.657
  521    HG2  GLU  68           1HG      GLU  68   7.317   6.159  -9.725
  522    HG3  GLU  68           2HG      GLU  68   6.255   7.089  -8.668
  523    H    VAL  69           H        VAL  69   6.521   6.477  -3.953
  524    HA   VAL  69           HA       VAL  69   3.992   7.569  -4.979
  525    HB   VAL  69           HB       VAL  69   3.264   5.780  -3.742
  526   HG11  VAL  69          1HG1      VAL  69   5.377   6.316  -1.648
  527   HG12  VAL  69          2HG1      VAL  69   5.415   5.027  -2.861
  528   HG13  VAL  69          3HG1      VAL  69   4.171   5.025  -1.607
  529   HG21  VAL  69          3HG2      VAL  69   3.434   7.947  -1.658
  530   HG22  VAL  69          1HG2      VAL  69   2.307   6.593  -1.666
  531   HG23  VAL  69          2HG2      VAL  69   2.207   7.828  -2.920
  532    H    SER  70           H        SER  70   4.038   9.690  -5.029
  533    HA   SER  70           HA       SER  70   5.197  11.125  -2.737
  534    HB2  SER  70           1HB      SER  70   4.691  12.184  -5.528
  535    HB3  SER  70           2HB      SER  70   5.546  13.011  -4.225
  536    HG   SER  70           HG       SER  70   6.757  10.721  -4.477
  537    H    ALA  71           H        ALA  71   2.425  10.884  -4.889
  538    HA   ALA  71           HA       ALA  71   0.899  12.861  -3.456
  539    HB1  ALA  71           1HB      ALA  71   0.022  10.825  -5.508
  540    HB2  ALA  71           2HB      ALA  71   0.507  12.487  -5.842
  541    HB3  ALA  71           3HB      ALA  71  -0.951  12.166  -4.904
  542    H    MET  72           H        MET  72  -1.040  12.349  -2.224
  543    HA   MET  72           HA       MET  72  -1.112   9.650  -1.118
  544    HB2  MET  72           1HB      MET  72  -0.975  10.548   1.201
  545    HB3  MET  72           2HB      MET  72   0.514  10.731   0.285
  546    HG2  MET  72           1HG      MET  72  -0.153  13.078  -0.201
  547    HG3  MET  72           2HG      MET  72  -1.519  12.860   0.892
  548    HE1  MET  72           3HE      MET  72   2.141  11.364   1.348
  549    HE2  MET  72           1HE      MET  72   2.907  12.709   2.191
  550    HE3  MET  72           2HE      MET  72   2.360  12.909   0.527
  551    HA   PRO  73           HA       PRO  73  -2.010   8.685   0.472
  552    HB2  PRO  73           1HB      PRO  73  -4.058   6.959   0.745
  553    HB3  PRO  73           2HB      PRO  73  -3.695   8.200   1.945
  554    HG2  PRO  73           1HG      PRO  73  -5.848   8.111  -0.100
  555    HG3  PRO  73           2HG      PRO  73  -5.868   8.835   1.526
  556    HD2  PRO  73           1HD      PRO  73  -5.517  10.208  -0.896
  557    HD3  PRO  73           2HD      PRO  73  -5.142  10.836   0.719
  558    H    THR  74           H        THR  74  -1.317   6.768  -0.477
  559    HA   THR  74           HA       THR  74  -2.344   6.160  -3.167
  560    HB   THR  74           HB       THR  74   0.478   6.848  -2.400
  561    HG1  THR  74           1HG      THR  74  -0.193   8.549  -3.449
  562   HG21  THR  74          3HG2      THR  74   0.822   4.754  -3.450
  563   HG22  THR  74          1HG2      THR  74   1.166   5.980  -4.669
  564   HG23  THR  74          2HG2      THR  74  -0.368   5.104  -4.711
  565    H    LEU  75           H        LEU  75  -2.567   4.099  -3.571
  566    HA   LEU  75           HA       LEU  75  -1.442   2.130  -1.714
  567    HB2  LEU  75           1HB      LEU  75  -3.410   1.790  -3.967
  568    HB3  LEU  75           2HB      LEU  75  -2.938   0.550  -2.821
  569    HG   LEU  75           HG       LEU  75  -3.907   2.444  -1.143
  570   HD11  LEU  75          1HD1      LEU  75  -4.619   3.895  -3.001
  571   HD12  LEU  75          2HD1      LEU  75  -5.986   3.315  -2.053
  572   HD13  LEU  75          3HD1      LEU  75  -5.635   2.590  -3.619
  573   HD21  LEU  75          3HD2      LEU  75  -4.445   0.129  -1.050
  574   HD22  LEU  75          1HD2      LEU  75  -5.343   0.219  -2.568
  575   HD23  LEU  75          2HD2      LEU  75  -5.955   1.038  -1.132
  576    H    LEU  76           H        LEU  76   0.372   1.050  -2.316
  577    HA   LEU  76           HA       LEU  76   0.874   0.810  -5.208
  578    HB2  LEU  76           1HB      LEU  76   2.578   1.661  -3.073
  579    HB3  LEU  76           2HB      LEU  76   3.219   0.179  -3.755
  580    HG   LEU  76           HG       LEU  76   2.552   2.653  -5.354
  581   HD11  LEU  76          1HD1      LEU  76   4.452   3.007  -3.838
  582   HD12  LEU  76          2HD1      LEU  76   4.955   3.000  -5.537
  583   HD13  LEU  76          3HD1      LEU  76   5.247   1.584  -4.513
  584   HD21  LEU  76          3HD2      LEU  76   3.707   1.526  -7.173
  585   HD22  LEU  76          1HD2      LEU  76   2.352   0.550  -6.609
  586   HD23  LEU  76          2HD2      LEU  76   3.996   0.121  -6.145
  587    H    LEU  77           H        LEU  77   0.383  -1.082  -5.962
  588    HA   LEU  77           HA       LEU  77   0.466  -3.460  -4.245
  589    HB2  LEU  77           1HB      LEU  77  -0.714  -2.916  -6.974
  590    HB3  LEU  77           2HB      LEU  77  -0.591  -4.529  -6.314
  591    HG   LEU  77           HG       LEU  77  -2.269  -4.127  -4.698
  592   HD11  LEU  77          1HD1      LEU  77  -2.109  -1.185  -5.377
  593   HD12  LEU  77          2HD1      LEU  77  -1.491  -1.927  -3.902
  594   HD13  LEU  77          3HD1      LEU  77  -3.223  -1.932  -4.233
  595   HD21  LEU  77          3HD2      LEU  77  -3.071  -2.587  -7.154
  596   HD22  LEU  77          1HD2      LEU  77  -4.140  -3.411  -6.020
  597   HD23  LEU  77          2HD2      LEU  77  -3.034  -4.349  -7.029
  598    H    PHE  78           H        PHE  78   2.103  -4.872  -4.421
  599    HA   PHE  78           HA       PHE  78   3.717  -4.819  -6.883
  600    HB2  PHE  78           1HB      PHE  78   4.648  -4.932  -4.025
  601    HB3  PHE  78           2HB      PHE  78   5.644  -5.528  -5.345
  602    HD1  PHE  78           1HD      PHE  78   4.120  -2.542  -3.852
  603    HD2  PHE  78           2HD      PHE  78   6.757  -4.043  -6.829
  604    HE1  PHE  78           1HE      PHE  78   5.004  -0.284  -4.216
  605    HE2  PHE  78           2HE      PHE  78   7.641  -1.781  -7.199
  606    HZ   PHE  78           HZ       PHE  78   6.765   0.107  -5.886
  607    H    LYS  79           H        LYS  79   4.589  -6.847  -7.568
  608    HA   LYS  79           HA       LYS  79   4.079  -9.116  -5.767
  609    HB2  LYS  79           1HB      LYS  79   2.316  -8.974  -7.603
  610    HB3  LYS  79           2HB      LYS  79   3.610  -9.326  -8.740
  611    HG2  LYS  79           1HG      LYS  79   4.023 -11.453  -7.670
  612    HG3  LYS  79           2HG      LYS  79   2.807 -11.096  -6.443
  613    HD2  LYS  79           1HD      LYS  79   1.080 -11.026  -8.184
  614    HD3  LYS  79           2HD      LYS  79   2.301 -11.397  -9.403
  615    HE2  LYS  79           1HE      LYS  79   2.760 -13.528  -8.279
  616    HE3  LYS  79           2HE      LYS  79   1.525 -13.156  -7.078
  617    HZ1  LYS  79           3HZ      LYS  79  -0.141 -13.167  -8.823
  618    HZ2  LYS  79           1HZ      LYS  79   0.700 -14.639  -8.802
  619    HZ3  LYS  79           2HZ      LYS  79   1.048 -13.489  -9.991
  620    H    ASN  80           H        ASN  80   5.845 -10.248  -5.439
  621    HA   ASN  80           HA       ASN  80   7.975 -10.950  -5.468
  622    HB2  ASN  80           1HB      ASN  80   8.764 -12.062  -7.515
  623    HB3  ASN  80           2HB      ASN  80   7.126 -12.519  -7.085
  624   HD21  ASN  80          1HD2      ASN  80   5.467 -12.033  -8.468
  625   HD22  ASN  80          2HD2      ASN  80   5.711 -11.414 -10.061
  626    H    GLY  81           H        GLY  81   8.072  -8.276  -5.313
  627    HA2  GLY  81           1HA      GLY  81   9.823  -6.739  -5.332
  628    HA3  GLY  81           2HA      GLY  81  10.714  -7.829  -6.390
  629    H    LYS  82           H        LYS  82   7.749  -7.474  -7.721
  630    HA   LYS  82           HA       LYS  82   8.613  -5.206  -9.396
  631    HB2  LYS  82           1HB      LYS  82   6.879  -7.545 -10.221
  632    HB3  LYS  82           2HB      LYS  82   7.491  -6.274 -11.265
  633    HG2  LYS  82           1HG      LYS  82   9.777  -7.081 -10.872
  634    HG3  LYS  82           2HG      LYS  82   9.128  -8.379  -9.867
  635    HD2  LYS  82           1HD      LYS  82   9.388  -9.440 -11.900
  636    HD3  LYS  82           2HD      LYS  82   7.703  -8.933 -11.971
  637    HE2  LYS  82           1HE      LYS  82  10.000  -7.396 -13.175
  638    HE3  LYS  82           2HE      LYS  82   8.991  -8.528 -14.066
  639    HZ1  LYS  82           3HZ      LYS  82   7.063  -7.117 -13.472
  640    HZ2  LYS  82           1HZ      LYS  82   8.200  -6.331 -14.448
  641    HZ3  LYS  82           2HZ      LYS  82   8.128  -5.993 -12.797
  642    H    GLU  83           H        GLU  83   6.760  -3.927 -10.243
  643    HA   GLU  83           HA       GLU  83   4.763  -3.505  -8.254
  644    HB2  GLU  83           1HB      GLU  83   5.760  -1.791  -9.870
  645    HB3  GLU  83           2HB      GLU  83   4.729  -2.495 -11.103
  646    HG2  GLU  83           1HG      GLU  83   2.751  -1.835  -9.921
  647    HG3  GLU  83           2HG      GLU  83   3.712  -1.310  -8.533
  648    H    VAL  84           H        VAL  84   2.369  -3.424  -9.036
  649    HA   VAL  84           HA       VAL  84   1.748  -5.062 -11.332
  650    HB   VAL  84           HB       VAL  84  -0.248  -6.039  -9.942
  651   HG11  VAL  84          1HG1      VAL  84   0.932  -8.109  -9.682
  652   HG12  VAL  84          2HG1      VAL  84   2.489  -7.274  -9.722
  653   HG13  VAL  84          3HG1      VAL  84   1.475  -7.330 -11.169
  654   HG21  VAL  84          3HG2      VAL  84   0.335  -4.936  -7.876
  655   HG22  VAL  84          1HG2      VAL  84   1.906  -5.731  -7.876
  656   HG23  VAL  84          2HG2      VAL  84   0.436  -6.686  -7.692
  657    H    ALA  85           H        ALA  85   0.852  -2.784  -8.858
  658    HA   ALA  85           HA       ALA  85  -0.592  -1.197 -10.684
  659    HB1  ALA  85           1HB      ALA  85  -2.204  -2.859  -8.773
  660    HB2  ALA  85           2HB      ALA  85  -2.400  -2.702 -10.518
  661    HB3  ALA  85           3HB      ALA  85  -2.814  -1.354  -9.459
  662    H    LYS  86           H        LYS  86  -1.419   0.765  -9.733
  663    HA   LYS  86           HA       LYS  86  -0.961   1.218  -6.922
  664    HB2  LYS  86           1HB      LYS  86   0.478   3.172  -7.249
  665    HB3  LYS  86           2HB      LYS  86   1.253   1.708  -7.819
  666    HG2  LYS  86           1HG      LYS  86   0.620   2.329 -10.130
  667    HG3  LYS  86           2HG      LYS  86  -0.028   3.847  -9.505
  668    HD2  LYS  86           1HD      LYS  86   2.831   2.912  -9.247
  669    HD3  LYS  86           2HD      LYS  86   2.246   4.114 -10.397
  670    HE2  LYS  86           1HE      LYS  86   1.564   5.557  -8.539
  671    HE3  LYS  86           2HE      LYS  86   2.148   4.352  -7.391
  672    HZ1  LYS  86           3HZ      LYS  86   3.763   6.125  -7.738
  673    HZ2  LYS  86           1HZ      LYS  86   3.821   5.773  -9.390
  674    HZ3  LYS  86           2HZ      LYS  86   4.373   4.641  -8.266
  675    H    VAL  87           H        VAL  87  -2.342   2.705  -6.109
  676    HA   VAL  87           HA       VAL  87  -3.927   4.291  -8.016
  677    HB   VAL  87           HB       VAL  87  -5.134   2.741  -5.719
  678   HG11  VAL  87          1HG1      VAL  87  -6.422   4.352  -7.920
  679   HG12  VAL  87          2HG1      VAL  87  -6.298   4.822  -6.224
  680   HG13  VAL  87          3HG1      VAL  87  -7.275   3.427  -6.683
  681   HG21  VAL  87          3HG2      VAL  87  -4.437   1.213  -7.489
  682   HG22  VAL  87          1HG2      VAL  87  -5.300   2.185  -8.681
  683   HG23  VAL  87          2HG2      VAL  87  -6.196   1.335  -7.421
  684    H    VAL  88           H        VAL  88  -3.818   6.347  -7.485
  685    HA   VAL  88           HA       VAL  88  -3.174   7.123  -4.766
  686    HB   VAL  88           HB       VAL  88  -1.986   8.236  -6.563
  687   HG11  VAL  88          1HG1      VAL  88  -3.664   8.055  -8.317
  688   HG12  VAL  88          2HG1      VAL  88  -3.084   9.714  -8.153
  689   HG13  VAL  88          3HG1      VAL  88  -4.659   9.262  -7.499
  690   HG21  VAL  88          3HG2      VAL  88  -3.891  10.092  -5.144
  691   HG22  VAL  88          1HG2      VAL  88  -2.407  10.589  -5.960
  692   HG23  VAL  88          2HG2      VAL  88  -2.327   9.528  -4.554
  693    H    GLY  89           H        GLY  89  -5.387   6.021  -4.305
  694    HA2  GLY  89           1HA      GLY  89  -7.132   7.937  -3.328
  695    HA3  GLY  89           2HA      GLY  89  -7.761   7.463  -4.899
  696    H    ALA  90           H        ALA  90  -8.326   6.994  -1.835
  697    HA   ALA  90           HA       ALA  90  -8.450   4.166  -1.568
  698    HB1  ALA  90           1HB      ALA  90  -9.713   4.608   0.416
  699    HB2  ALA  90           2HB      ALA  90 -10.041   6.257  -0.115
  700    HB3  ALA  90           3HB      ALA  90  -8.399   5.784   0.311
  701    H    ASN  91           H        ASN  91  -9.598   3.196  -3.195
  702    HA   ASN  91           HA       ASN  91 -12.378   4.102  -3.497
  703    HB2  ASN  91           1HB      ASN  91 -10.502   4.039  -5.447
  704    HB3  ASN  91           2HB      ASN  91 -11.171   2.417  -5.606
  705   HD21  ASN  91          1HD2      ASN  91 -13.059   5.145  -4.503
  706   HD22  ASN  91          2HD2      ASN  91 -14.080   5.241  -5.886
  707    HA   PRO  92           HA       PRO  92 -12.676   0.381  -0.849
  708    HB2  PRO  92           1HB      PRO  92 -15.485   1.039  -1.653
  709    HB3  PRO  92           2HB      PRO  92 -14.864   0.503  -0.087
  710    HG2  PRO  92           1HG      PRO  92 -15.369   3.093  -0.587
  711    HG3  PRO  92           2HG      PRO  92 -14.025   2.581   0.447
  712    HD2  PRO  92           1HD      PRO  92 -13.957   3.789  -2.228
  713    HD3  PRO  92           2HD      PRO  92 -12.663   3.650  -1.025
  714    H    ALA  93           H        ALA  93 -14.909   0.615  -3.644
  715    HA   ALA  93           HA       ALA  93 -15.051  -2.235  -3.817
  716    HB1  ALA  93           1HB      ALA  93 -16.969  -0.805  -4.358
  717    HB2  ALA  93           2HB      ALA  93 -16.539  -1.868  -5.698
  718    HB3  ALA  93           3HB      ALA  93 -16.087  -0.164  -5.745
  719    H    ALA  94           H        ALA  94 -13.566   0.292  -5.817
  720    HA   ALA  94           HA       ALA  94 -12.680  -1.508  -7.832
  721    HB1  ALA  94           1HB      ALA  94 -11.613   1.236  -7.185
  722    HB2  ALA  94           2HB      ALA  94 -12.996   0.902  -8.229
  723    HB3  ALA  94           3HB      ALA  94 -11.386   0.347  -8.690
  724    H    ILE  95           H        ILE  95 -11.344  -0.475  -4.783
  725    HA   ILE  95           HA       ILE  95  -8.684  -1.389  -5.388
  726    HB   ILE  95           HB       ILE  95  -9.969  -0.670  -2.754
  727   HG12  ILE  95          1HG1      ILE  95  -9.617   1.237  -4.228
  728   HG13  ILE  95          2HG1      ILE  95  -8.473   1.299  -2.892
  729   HG21  ILE  95          1HG2      ILE  95  -7.112  -1.422  -3.339
  730   HG22  ILE  95          2HG2      ILE  95  -8.255  -2.324  -2.344
  731   HG23  ILE  95          3HG2      ILE  95  -7.686  -0.738  -1.819
  732   HD11  ILE  95          3HD1      ILE  95  -6.747   0.359  -4.387
  733   HD12  ILE  95          1HD1      ILE  95  -7.371   1.917  -4.928
  734   HD13  ILE  95          2HD1      ILE  95  -7.903   0.433  -5.715
  735    H    LYS  96           H        LYS  96 -11.432  -2.617  -3.533
  736    HA   LYS  96           HA       LYS  96 -10.284  -5.046  -2.758
  737    HB2  LYS  96           1HB      LYS  96 -12.221  -4.462  -1.623
  738    HB3  LYS  96           2HB      LYS  96 -13.092  -4.074  -3.105
  739    HG2  LYS  96           1HG      LYS  96 -13.221  -6.478  -3.617
  740    HG3  LYS  96           2HG      LYS  96 -12.392  -6.823  -2.097
  741    HD2  LYS  96           1HD      LYS  96 -14.198  -5.807  -0.841
  742    HD3  LYS  96           2HD      LYS  96 -15.010  -5.348  -2.337
  743    HE2  LYS  96           1HE      LYS  96 -15.248  -7.714  -2.921
  744    HE3  LYS  96           2HE      LYS  96 -14.454  -8.163  -1.413
  745    HZ1  LYS  96           3HZ      LYS  96 -16.256  -7.131  -0.188
  746    HZ2  LYS  96           1HZ      LYS  96 -16.863  -8.306  -1.243
  747    HZ3  LYS  96           2HZ      LYS  96 -17.010  -6.669  -1.630
  748    H    GLN  97           H        GLN  97 -11.735  -4.026  -5.741
  749    HA   GLN  97           HA       GLN  97 -11.594  -6.673  -6.886
  750    HB2  GLN  97           1HB      GLN  97 -12.261  -3.962  -8.038
  751    HB3  GLN  97           2HB      GLN  97 -12.160  -5.415  -9.027
  752    HG2  GLN  97           1HG      GLN  97 -14.018  -5.010  -6.692
  753    HG3  GLN  97           2HG      GLN  97 -14.460  -4.891  -8.395
  754   HE21  GLN  97          1HE2      GLN  97 -12.754  -7.127  -9.171
  755   HE22  GLN  97          2HE2      GLN  97 -13.554  -8.557  -8.628
  756    H    ALA  98           H        ALA  98  -9.525  -3.892  -6.658
  757    HA   ALA  98           HA       ALA  98  -7.876  -4.518  -8.891
  758    HB1  ALA  98           1HB      ALA  98  -6.320  -2.895  -7.964
  759    HB2  ALA  98           2HB      ALA  98  -7.255  -2.844  -6.469
  760    HB3  ALA  98           3HB      ALA  98  -7.965  -2.263  -7.975
  761    H    ILE  99           H        ILE  99  -7.402  -4.828  -5.406
  762    HA   ILE  99           HA       ILE  99  -4.964  -6.115  -5.395
  763    HB   ILE  99           HB       ILE  99  -7.145  -6.893  -3.456
  764   HG12  ILE  99          1HG1      ILE  99  -7.374  -4.565  -3.378
  765   HG13  ILE  99          2HG1      ILE  99  -6.225  -4.911  -2.089
  766   HG21  ILE  99          1HG2      ILE  99  -5.172  -6.909  -1.906
  767   HG22  ILE  99          2HG2      ILE  99  -4.156  -6.650  -3.323
  768   HG23  ILE  99          3HG2      ILE  99  -5.129  -8.112  -3.194
  769   HD11  ILE  99          3HD1      ILE  99  -5.486  -2.998  -3.279
  770   HD12  ILE  99          1HD1      ILE  99  -5.644  -3.843  -4.824
  771   HD13  ILE  99          2HD1      ILE  99  -4.405  -4.340  -3.663
  772    H    ALA 100           H        ALA 100  -8.218  -7.478  -5.744
  773    HA   ALA 100           HA       ALA 100  -7.406 -10.206  -5.689
  774    HB1  ALA 100           1HB      ALA 100  -9.657 -10.691  -6.477
  775    HB2  ALA 100           2HB      ALA 100  -9.905  -8.987  -6.859
  776    HB3  ALA 100           3HB      ALA 100  -9.696  -9.494  -5.183
  777    H    ALA 101           H        ALA 101  -7.668  -7.802  -8.198
  778    HA   ALA 101           HA       ALA 101  -7.535  -9.616 -10.405
  779    HB1  ALA 101           1HB      ALA 101  -6.916  -6.661 -10.357
  780    HB2  ALA 101           2HB      ALA 101  -8.534  -7.350 -10.532
  781    HB3  ALA 101           3HB      ALA 101  -7.313  -7.642 -11.770
  782    H    ASN 102           H        ASN 102  -5.197  -7.666  -8.626
  783    HA   ASN 102           HA       ASN 102  -3.058  -8.263 -10.470
  784    HB2  ASN 102           1HB      ASN 102  -2.992  -6.886  -7.789
  785    HB3  ASN 102           2HB      ASN 102  -1.654  -6.956  -8.925
  786   HD21  ASN 102          1HD2      ASN 102  -4.574  -5.446  -8.069
  787   HD22  ASN 102          2HD2      ASN 102  -4.662  -4.305  -9.357
  788    H    ALA 103           H        ALA 103  -4.346  -9.671  -7.622
  789    HA   ALA 103           HA       ALA 103  -2.031 -11.003  -6.689
  790    HB1  ALA 103           1HB      ALA 103  -4.929 -11.768  -6.342
  791    HB2  ALA 103           2HB      ALA 103  -4.016 -10.680  -5.295
  792    HB3  ALA 103           3HB      ALA 103  -3.572 -12.384  -5.399
  Start of MODEL   20
    1    H1   MET   1           1H       MET   1  -5.631  -6.870  12.210
    2    H2   MET   1           2H       MET   1  -4.035  -7.283  11.842
    3    H3   MET   1           3H       MET   1  -5.209  -7.285  10.630
    4    HA   MET   1           HA       MET   1  -5.481  -4.920  10.819
    5    HB2  MET   1           1HB      MET   1  -4.077  -3.591  12.238
    6    HB3  MET   1           2HB      MET   1  -4.850  -4.811  13.237
    7    HG2  MET   1           1HG      MET   1  -2.038  -4.971  12.175
    8    HG3  MET   1           2HG      MET   1  -2.481  -4.445  13.798
    9    HE1  MET   1           3HE      MET   1  -4.113  -7.735  15.229
   10    HE2  MET   1           1HE      MET   1  -4.952  -6.480  14.316
   11    HE3  MET   1           2HE      MET   1  -3.760  -6.034  15.539
   12    H    VAL   2           H        VAL   2  -4.140  -3.477   9.618
   13    HA   VAL   2           HA       VAL   2  -2.303  -4.836   7.875
   14    HB   VAL   2           HB       VAL   2  -3.211  -1.958   8.006
   15   HG11  VAL   2          1HG1      VAL   2  -1.059  -2.016   6.926
   16   HG12  VAL   2          2HG1      VAL   2  -2.308  -1.781   5.702
   17   HG13  VAL   2          3HG1      VAL   2  -1.561  -3.364   5.912
   18   HG21  VAL   2          3HG2      VAL   2  -4.036  -4.271   6.268
   19   HG22  VAL   2          1HG2      VAL   2  -4.543  -2.603   6.024
   20   HG23  VAL   2          2HG2      VAL   2  -5.008  -3.459   7.492
   21    H    THR   3           H        THR   3  -0.163  -4.801   7.899
   22    HA   THR   3           HA       THR   3   1.051  -4.227  10.409
   23    HB   THR   3           HB       THR   3   2.426  -5.120   7.872
   24    HG1  THR   3           1HG      THR   3   1.772  -7.159   8.337
   25   HG21  THR   3          3HG2      THR   3   3.088  -5.572  10.785
   26   HG22  THR   3          1HG2      THR   3   3.933  -4.473   9.694
   27   HG23  THR   3          2HG2      THR   3   3.987  -6.212   9.409
   28    H    GLN   4           H        GLN   4   2.694  -2.877  10.941
   29    HA   GLN   4           HA       GLN   4   2.791  -0.367   9.449
   30    HB2  GLN   4           1HB      GLN   4   2.288  -0.510  11.896
   31    HB3  GLN   4           2HB      GLN   4   3.923  -1.091  12.158
   32    HG2  GLN   4           1HG      GLN   4   3.693   1.291  12.663
   33    HG3  GLN   4           2HG      GLN   4   4.837   0.994  11.352
   34   HE21  GLN   4          1HE2      GLN   4   4.367   1.676   9.314
   35   HE22  GLN   4          2HE2      GLN   4   3.021   2.681   8.932
   36    H    PHE   5           H        PHE   5   4.401  -0.046   8.029
   37    HA   PHE   5           HA       PHE   5   6.897  -1.477   8.124
   38    HB2  PHE   5           1HB      PHE   5   5.782   0.722   6.439
   39    HB3  PHE   5           2HB      PHE   5   7.516   0.452   6.438
   40    HD1  PHE   5           2HD      PHE   5   6.959  -2.703   6.817
   41    HD2  PHE   5           1HD      PHE   5   5.753   0.302   4.054
   42    HE1  PHE   5           2HE      PHE   5   6.688  -4.412   5.079
   43    HE2  PHE   5           1HE      PHE   5   5.484  -1.409   2.314
   44    HZ   PHE   5           HZ       PHE   5   5.949  -3.764   2.825
   45    H    LYS   6           H        LYS   6   8.994  -0.244   8.086
   46    HA   LYS   6           HA       LYS   6   8.919   1.998   9.974
   47    HB2  LYS   6           1HB      LYS   6  11.051  -0.131  10.015
   48    HB3  LYS   6           2HB      LYS   6  10.759   1.124  11.210
   49    HG2  LYS   6           1HG      LYS   6   8.634   0.047  11.796
   50    HG3  LYS   6           2HG      LYS   6   8.985  -1.225  10.624
   51    HD2  LYS   6           1HD      LYS   6  10.989  -1.836  11.866
   52    HD3  LYS   6           2HD      LYS   6  10.684  -0.537  13.019
   53    HE2  LYS   6           1HE      LYS   6   8.574  -1.615  13.654
   54    HE3  LYS   6           2HE      LYS   6   8.905  -2.919  12.518
   55    HZ1  LYS   6           3HZ      LYS   6  10.531  -2.222  14.899
   56    HZ2  LYS   6           1HZ      LYS   6  10.911  -3.440  13.788
   57    HZ3  LYS   6           2HZ      LYS   6   9.520  -3.565  14.741
   58    H    THR   7           H        THR   7  10.783   0.291   7.485
   59    HA   THR   7           HA       THR   7  11.782   2.898   6.593
   60    HB   THR   7           HB       THR   7  14.064   2.011   6.224
   61    HG1  THR   7           1HG      THR   7  13.079  -0.217   7.728
   62   HG21  THR   7          3HG2      THR   7  14.813   2.079   8.557
   63   HG22  THR   7          1HG2      THR   7  13.147   1.876   9.097
   64   HG23  THR   7          2HG2      THR   7  13.621   3.334   8.225
   65    H    ALA   8           H        ALA   8  13.193   2.445   4.464
   66    HA   ALA   8           HA       ALA   8  11.380   1.415   2.562
   67    HB1  ALA   8           1HB      ALA   8  12.847   3.132   1.862
   68    HB2  ALA   8           2HB      ALA   8  13.297   1.681   0.968
   69    HB3  ALA   8           3HB      ALA   8  14.267   2.204   2.342
   70    H    SER   9           H        SER   9  14.101   0.047   4.261
   71    HA   SER   9           HA       SER   9  14.544  -2.249   2.745
   72    HB2  SER   9           1HB      SER   9  14.686  -2.033   5.760
   73    HB3  SER   9           2HB      SER   9  15.576  -3.158   4.731
   74    HG   SER   9           HG       SER   9  17.046  -1.639   4.811
   75    H    GLU  10           H        GLU  10  12.323  -1.729   5.495
   76    HA   GLU  10           HA       GLU  10  10.972  -4.118   5.485
   77    HB2  GLU  10           1HB      GLU  10  10.205  -1.297   6.103
   78    HB3  GLU  10           2HB      GLU  10   8.982  -2.554   6.142
   79    HG2  GLU  10           1HG      GLU  10   9.821  -2.199   8.328
   80    HG3  GLU  10           2HG      GLU  10  10.336  -3.783   7.778
   81    H    PHE  11           H        PHE  11  10.436  -1.269   3.398
   82    HA   PHE  11           HA       PHE  11   8.052  -2.145   2.218
   83    HB2  PHE  11           1HB      PHE  11   9.032   0.176   2.027
   84    HB3  PHE  11           2HB      PHE  11  10.156  -0.451   0.823
   85    HD1  PHE  11           2HD      PHE  11   9.190  -1.439  -1.307
   86    HD2  PHE  11           1HD      PHE  11   6.865   0.852   1.427
   87    HE1  PHE  11           2HE      PHE  11   7.527  -1.017  -3.071
   88    HE2  PHE  11           1HE      PHE  11   5.197   1.294  -0.354
   89    HZ   PHE  11           HZ       PHE  11   5.538   0.344  -2.593
   90    H    ASP  12           H        ASP  12  11.336  -2.378   0.906
   91    HA   ASP  12           HA       ASP  12  10.669  -3.874  -1.376
   92    HB2  ASP  12           1HB      ASP  12  13.253  -3.656   0.164
   93    HB3  ASP  12           2HB      ASP  12  13.111  -4.535  -1.354
   94    H    SER  13           H        SER  13  11.423  -4.911   1.897
   95    HA   SER  13           HA       SER  13  11.819  -7.641   1.345
   96    HB2  SER  13           1HB      SER  13  10.790  -6.315   3.865
   97    HB3  SER  13           2HB      SER  13  11.355  -7.982   3.752
   98    HG   SER  13           HG       SER  13  12.824  -5.582   3.508
   99    H    ALA  14           H        ALA  14   8.895  -5.813   2.171
  100    HA   ALA  14           HA       ALA  14   7.145  -8.018   2.125
  101    HB1  ALA  14           1HB      ALA  14   6.520  -5.121   1.565
  102    HB2  ALA  14           2HB      ALA  14   6.563  -5.865   3.163
  103    HB3  ALA  14           3HB      ALA  14   5.352  -6.376   1.987
  104    H    ILE  15           H        ILE  15   8.364  -5.832  -0.302
  105    HA   ILE  15           HA       ILE  15   6.608  -6.442  -2.404
  106    HB   ILE  15           HB       ILE  15   9.477  -5.572  -2.605
  107   HG12  ILE  15          1HG1      ILE  15   8.477  -3.867  -1.366
  108   HG13  ILE  15          2HG1      ILE  15   8.342  -3.322  -3.034
  109   HG21  ILE  15          1HG2      ILE  15   9.100  -4.963  -4.797
  110   HG22  ILE  15          2HG2      ILE  15   7.348  -4.986  -4.605
  111   HG23  ILE  15          3HG2      ILE  15   8.246  -6.501  -4.655
  112   HD11  ILE  15          3HD1      ILE  15   6.297  -2.906  -1.776
  113   HD12  ILE  15          1HD1      ILE  15   6.149  -4.632  -1.441
  114   HD13  ILE  15          2HD1      ILE  15   6.024  -4.040  -3.098
  115    H    ALA  16           H        ALA  16   9.607  -7.926  -1.352
  116    HA   ALA  16           HA       ALA  16  10.033  -9.414  -3.750
  117    HB1  ALA  16           1HB      ALA  16  11.884  -8.711  -2.352
  118    HB2  ALA  16           2HB      ALA  16  11.864 -10.467  -2.511
  119    HB3  ALA  16           3HB      ALA  16  11.287  -9.708  -1.026
  120    H    GLN  17           H        GLN  17   7.551  -9.832  -1.882
  121    HA   GLN  17           HA       GLN  17   7.754 -12.655  -1.339
  122    HB2  GLN  17           1HB      GLN  17   5.709 -10.523  -0.853
  123    HB3  GLN  17           2HB      GLN  17   5.324 -12.215  -0.628
  124    HG2  GLN  17           1HG      GLN  17   7.114 -12.431   0.997
  125    HG3  GLN  17           2HG      GLN  17   7.546 -10.742   0.751
  126   HE21  GLN  17          1HE2      GLN  17   4.852  -9.770   0.602
  127   HE22  GLN  17          2HE2      GLN  17   4.168  -9.896   2.185
  128    H    ASP  18           H        ASP  18   6.503 -14.230  -2.300
  129    HA   ASP  18           HA       ASP  18   5.948 -13.814  -5.089
  130    HB2  ASP  18           1HB      ASP  18   5.445 -16.242  -5.085
  131    HB3  ASP  18           2HB      ASP  18   7.008 -15.874  -4.366
  132    H    LYS  19           H        LYS  19   4.216 -12.338  -3.334
  133    HA   LYS  19           HA       LYS  19   1.652 -13.276  -4.271
  134    HB2  LYS  19           1HB      LYS  19   0.696 -13.045  -1.902
  135    HB3  LYS  19           2HB      LYS  19   1.598 -14.506  -2.273
  136    HG2  LYS  19           1HG      LYS  19   3.612 -13.214  -1.277
  137    HG3  LYS  19           2HG      LYS  19   2.372 -12.195  -0.548
  138    HD2  LYS  19           1HD      LYS  19   2.590 -15.192  -0.245
  139    HD3  LYS  19           2HD      LYS  19   3.080 -14.002   0.960
  140    HE2  LYS  19           1HE      LYS  19   0.273 -14.257  -0.107
  141    HE3  LYS  19           2HE      LYS  19   0.840 -15.049   1.361
  142    HZ1  LYS  19           3HZ      LYS  19   1.234 -12.955   2.371
  143    HZ2  LYS  19           1HZ      LYS  19  -0.324 -12.898   1.719
  144    HZ3  LYS  19           2HZ      LYS  19   0.958 -12.110   0.931
  145    H    LEU  20           H        LEU  20  -0.094 -11.629  -3.464
  146    HA   LEU  20           HA       LEU  20   0.829  -9.196  -4.632
  147    HB2  LEU  20           1HB      LEU  20  -1.445 -10.353  -4.887
  148    HB3  LEU  20           2HB      LEU  20  -1.860  -9.612  -3.357
  149    HG   LEU  20           HG       LEU  20  -2.726  -8.375  -5.314
  150   HD11  LEU  20          1HD1      LEU  20  -2.070  -6.172  -4.623
  151   HD12  LEU  20          2HD1      LEU  20  -0.639  -6.811  -3.816
  152   HD13  LEU  20          3HD1      LEU  20  -2.245  -7.203  -3.205
  153   HD21  LEU  20          3HD2      LEU  20   0.083  -7.557  -5.936
  154   HD22  LEU  20          1HD2      LEU  20  -1.380  -7.358  -6.915
  155   HD23  LEU  20          2HD2      LEU  20  -0.660  -8.963  -6.702
  156    H    VAL  21           H        VAL  21   1.770  -7.617  -3.623
  157    HA   VAL  21           HA       VAL  21   1.348  -7.240  -0.744
  158    HB   VAL  21           HB       VAL  21   3.303  -5.579  -2.233
  159   HG11  VAL  21          1HG1      VAL  21   3.419  -7.017   0.411
  160   HG12  VAL  21          2HG1      VAL  21   3.015  -5.319   0.162
  161   HG13  VAL  21          3HG1      VAL  21   4.636  -5.903  -0.214
  162   HG21  VAL  21          3HG2      VAL  21   3.837  -7.591  -3.322
  163   HG22  VAL  21          1HG2      VAL  21   3.648  -8.537  -1.840
  164   HG23  VAL  21          2HG2      VAL  21   5.012  -7.435  -2.015
  165    H    VAL  22           H        VAL  22  -0.086  -5.711  -0.143
  166    HA   VAL  22           HA       VAL  22  -0.473  -3.425  -1.964
  167    HB   VAL  22           HB       VAL  22  -2.311  -4.215   0.290
  168   HG11  VAL  22          1HG1      VAL  22  -3.912  -2.768  -0.882
  169   HG12  VAL  22          2HG1      VAL  22  -2.674  -2.383  -2.078
  170   HG13  VAL  22          3HG1      VAL  22  -2.460  -1.892  -0.399
  171   HG21  VAL  22          3HG2      VAL  22  -2.292  -6.039  -1.282
  172   HG22  VAL  22          1HG2      VAL  22  -2.516  -4.922  -2.627
  173   HG23  VAL  22          2HG2      VAL  22  -3.801  -5.140  -1.440
  174    H    VAL  23           H        VAL  23   0.804  -1.819  -1.348
  175    HA   VAL  23           HA       VAL  23   1.301  -1.543   1.522
  176    HB   VAL  23           HB       VAL  23   2.895  -0.252  -0.682
  177   HG11  VAL  23          1HG1      VAL  23   3.013   0.793   1.531
  178   HG12  VAL  23          2HG1      VAL  23   4.543   0.040   1.092
  179   HG13  VAL  23          3HG1      VAL  23   3.464  -0.755   2.237
  180   HG21  VAL  23          3HG2      VAL  23   3.361  -2.835   0.796
  181   HG22  VAL  23          1HG2      VAL  23   4.549  -2.040  -0.238
  182   HG23  VAL  23          2HG2      VAL  23   3.048  -2.654  -0.931
  183    H    ALA  24           H        ALA  24   0.522  -0.012   2.584
  184    HA   ALA  24           HA       ALA  24  -1.175   1.978   1.287
  185    HB1  ALA  24           1HB      ALA  24  -1.795   0.462   3.282
  186    HB2  ALA  24           2HB      ALA  24  -2.228   2.169   3.378
  187    HB3  ALA  24           3HB      ALA  24  -0.825   1.565   4.255
  188    H    PHE  25           H        PHE  25   0.261   3.624   0.572
  189    HA   PHE  25           HA       PHE  25   1.897   4.857   2.677
  190    HB2  PHE  25           1HB      PHE  25   2.245   4.573  -0.225
  191    HB3  PHE  25           2HB      PHE  25   2.696   6.146   0.433
  192    HD1  PHE  25           2HD      PHE  25   2.958   2.643   1.609
  193    HD2  PHE  25           1HD      PHE  25   4.951   6.306   0.828
  194    HE1  PHE  25           2HE      PHE  25   5.044   1.676   2.468
  195    HE2  PHE  25           1HE      PHE  25   7.046   5.353   1.694
  196    HZ   PHE  25           HZ       PHE  25   7.088   3.031   2.513
  197    H    TYR  26           H        TYR  26   0.876   6.338   3.724
  198    HA   TYR  26           HA       TYR  26  -0.573   8.398   2.205
  199    HB2  TYR  26           1HB      TYR  26  -2.166   8.541   4.136
  200    HB3  TYR  26           2HB      TYR  26  -2.267   7.032   3.239
  201    HD1  TYR  26           1HD      TYR  26  -1.205   8.578   6.405
  202    HD2  TYR  26           2HD      TYR  26  -1.652   4.943   4.251
  203    HE1  TYR  26           1HE      TYR  26  -0.888   7.314   8.486
  204    HE2  TYR  26           2HE      TYR  26  -1.341   3.662   6.312
  205    HH   TYR  26           HH       TYR  26  -0.079   4.214   8.645
  206    H    ALA  27           H        ALA  27  -1.082  10.209   4.124
  207    HA   ALA  27           HA       ALA  27   1.469  10.640   5.513
  208    HB1  ALA  27           1HB      ALA  27   1.415  11.950   3.413
  209    HB2  ALA  27           2HB      ALA  27   1.501  12.959   4.858
  210    HB3  ALA  27           3HB      ALA  27  -0.028  12.774   4.001
  211    H    THR  28           H        THR  28   1.233  11.317   7.586
  212    HA   THR  28           HA       THR  28  -1.311  11.066   8.786
  213    HB   THR  28           HB       THR  28  -0.071  11.899  10.858
  214    HG1  THR  28           1HG      THR  28   2.312  11.704  10.452
  215   HG21  THR  28          3HG2      THR  28   1.187   9.806  11.077
  216   HG22  THR  28          1HG2      THR  28   1.034   9.532   9.341
  217   HG23  THR  28          2HG2      THR  28  -0.402   9.527  10.365
  218    H    TRP  29           H        TRP  29   0.389  13.800   7.539
  219    HA   TRP  29           HA       TRP  29  -1.205  15.722   8.988
  220    HB2  TRP  29           1HB      TRP  29  -0.035  17.394   7.537
  221    HB3  TRP  29           2HB      TRP  29   1.052  16.375   8.470
  222    HD1  TRP  29           HD       TRP  29   2.870  15.071   7.152
  223    HE1  TRP  29           1HE      TRP  29   3.450  14.796   4.659
  224    HE3  TRP  29           3HE      TRP  29  -1.277  17.252   5.099
  225    HZ2  TRP  29           2HZ      TRP  29   2.298  15.414   2.159
  226    HZ3  TRP  29           3HZ      TRP  29  -1.464  17.364   2.654
  227    HH2  TRP  29           HH       TRP  29   0.291  16.467   1.211
  228    H    CYS  30           H        CYS  30  -1.725  13.737   6.387
  229    HA   CYS  30           HA       CYS  30  -3.288  15.649   4.829
  230    HB2  CYS  30           1HB      CYS  30  -1.714  14.108   3.682
  231    HB3  CYS  30           2HB      CYS  30  -2.647  12.740   4.273
  232    HG   CYS  30           HG       CYS  30  -4.099  15.122   2.314
  233    H    GLY  31           H        GLY  31  -5.507  15.350   4.423
  234    HA2  GLY  31           1HA      GLY  31  -7.004  14.359   6.616
  235    HA3  GLY  31           2HA      GLY  31  -7.662  14.955   5.104
  236    HA   PRO  32           HA       PRO  32  -8.901  11.055   3.722
  237    HB2  PRO  32           1HB      PRO  32  -7.195  10.932   1.336
  238    HB3  PRO  32           2HB      PRO  32  -8.949  11.077   1.458
  239    HG2  PRO  32           1HG      PRO  32  -7.411  13.125   0.654
  240    HG3  PRO  32           2HG      PRO  32  -8.880  13.374   1.612
  241    HD2  PRO  32           1HD      PRO  32  -6.020  13.394   2.492
  242    HD3  PRO  32           2HD      PRO  32  -7.349  14.475   2.960
  243    H    CYS  33           H        CYS  33  -5.742  11.207   4.710
  244    HA   CYS  33           HA       CYS  33  -4.712   8.697   3.908
  245    HB2  CYS  33           1HB      CYS  33  -3.162   8.917   5.761
  246    HB3  CYS  33           2HB      CYS  33  -3.348  10.484   4.981
  247    HG   CYS  33           HG       CYS  33  -4.340  11.785   7.008
  248    H    LYS  34           H        LYS  34  -6.899   9.744   6.366
  249    HA   LYS  34           HA       LYS  34  -6.976   7.340   7.869
  250    HB2  LYS  34           1HB      LYS  34  -8.916   9.647   7.674
  251    HB3  LYS  34           2HB      LYS  34  -9.046   8.337   8.842
  252    HG2  LYS  34           1HG      LYS  34  -7.013   8.970   9.897
  253    HG3  LYS  34           2HG      LYS  34  -6.641  10.126   8.621
  254    HD2  LYS  34           1HD      LYS  34  -9.038  10.331  10.435
  255    HD3  LYS  34           2HD      LYS  34  -7.504  11.145  10.736
  256    HE2  LYS  34           1HE      LYS  34  -7.736  12.252   8.511
  257    HE3  LYS  34           2HE      LYS  34  -9.343  11.541   8.380
  258    HZ1  LYS  34           3HZ      LYS  34  -9.426  13.813   9.204
  259    HZ2  LYS  34           1HZ      LYS  34  -8.457  13.395  10.525
  260    HZ3  LYS  34           2HZ      LYS  34 -10.003  12.733  10.365
  261    H    MET  35           H        MET  35  -8.130   8.074   4.762
  262    HA   MET  35           HA       MET  35 -10.394   6.256   4.935
  263    HB2  MET  35           1HB      MET  35 -10.290   8.208   3.296
  264    HB3  MET  35           2HB      MET  35  -9.090   7.263   2.402
  265    HG2  MET  35           1HG      MET  35 -10.693   5.477   2.089
  266    HG3  MET  35           2HG      MET  35 -11.892   6.353   3.033
  267    HE1  MET  35           3HE      MET  35 -12.120   5.060   0.120
  268    HE2  MET  35           1HE      MET  35 -13.044   6.260  -0.790
  269    HE3  MET  35           2HE      MET  35 -13.530   5.826   0.852
  270    H    ILE  36           H        ILE  36  -7.038   6.252   4.130
  271    HA   ILE  36           HA       ILE  36  -7.041   3.680   2.889
  272    HB   ILE  36           HB       ILE  36  -5.046   5.711   3.566
  273   HG12  ILE  36          1HG1      ILE  36  -4.229   5.119   1.352
  274   HG13  ILE  36          2HG1      ILE  36  -5.268   3.700   1.331
  275   HG21  ILE  36          1HG2      ILE  36  -3.145   4.089   3.270
  276   HG22  ILE  36          2HG2      ILE  36  -4.300   2.804   3.629
  277   HG23  ILE  36          3HG2      ILE  36  -3.958   4.043   4.833
  278   HD11  ILE  36          3HD1      ILE  36  -6.086   6.578   1.247
  279   HD12  ILE  36          1HD1      ILE  36  -7.218   5.267   1.579
  280   HD13  ILE  36          2HD1      ILE  36  -6.356   5.324   0.036
  281    H    ALA  37           H        ALA  37  -6.778   4.895   6.116
  282    HA   ALA  37           HA       ALA  37  -5.793   2.684   7.438
  283    HB1  ALA  37           1HB      ALA  37  -7.804   4.753   8.242
  284    HB2  ALA  37           2HB      ALA  37  -6.134   4.552   8.769
  285    HB3  ALA  37           3HB      ALA  37  -7.376   3.431   9.327
  286    HA   PRO  38           HA       PRO  38  -9.887   0.427   7.753
  287    HB2  PRO  38           1HB      PRO  38 -12.262   1.422   7.057
  288    HB3  PRO  38           2HB      PRO  38 -11.457   1.924   8.551
  289    HG2  PRO  38           1HG      PRO  38 -11.625   3.338   5.923
  290    HG3  PRO  38           2HG      PRO  38 -11.763   3.999   7.563
  291    HD2  PRO  38           1HD      PRO  38  -9.470   4.072   6.019
  292    HD3  PRO  38           2HD      PRO  38  -9.512   4.207   7.786
  293    H    MET  39           H        MET  39  -9.806   2.209   4.657
  294    HA   MET  39           HA       MET  39 -11.371   0.279   3.243
  295    HB2  MET  39           1HB      MET  39 -11.246   2.505   2.343
  296    HB3  MET  39           2HB      MET  39  -9.497   2.479   2.361
  297    HG2  MET  39           1HG      MET  39 -11.023   0.579   0.635
  298    HG3  MET  39           2HG      MET  39 -10.758   2.244   0.130
  299    HE1  MET  39           3HE      MET  39  -7.685   2.118   1.953
  300    HE2  MET  39           1HE      MET  39  -8.177   3.245   0.678
  301    HE3  MET  39           2HE      MET  39  -6.740   2.249   0.468
  302    H    ILE  40           H        ILE  40  -7.953   0.770   3.777
  303    HA   ILE  40           HA       ILE  40  -7.168  -1.398   2.087
  304    HB   ILE  40           HB       ILE  40  -5.885   0.686   3.650
  305   HG12  ILE  40          1HG1      ILE  40  -4.816  -0.883   1.317
  306   HG13  ILE  40          2HG1      ILE  40  -6.021   0.389   1.145
  307   HG21  ILE  40          1HG2      ILE  40  -4.564  -2.021   3.572
  308   HG22  ILE  40          2HG2      ILE  40  -4.961  -1.057   4.994
  309   HG23  ILE  40          3HG2      ILE  40  -3.707  -0.511   3.883
  310   HD11  ILE  40          3HD1      ILE  40  -3.615   1.032   0.748
  311   HD12  ILE  40          1HD1      ILE  40  -3.388   0.847   2.485
  312   HD13  ILE  40          2HD1      ILE  40  -4.527   2.037   1.869
  313    H    GLU  41           H        GLU  41  -7.658  -0.913   5.551
  314    HA   GLU  41           HA       GLU  41  -6.815  -3.523   6.274
  315    HB2  GLU  41           1HB      GLU  41  -7.180  -1.485   7.779
  316    HB3  GLU  41           2HB      GLU  41  -8.894  -1.874   7.731
  317    HG2  GLU  41           1HG      GLU  41  -8.663  -3.584   9.166
  318    HG3  GLU  41           2HG      GLU  41  -7.139  -4.114   8.451
  319    H    LYS  42           H        LYS  42  -9.594  -2.306   4.707
  320    HA   LYS  42           HA       LYS  42 -11.302  -4.515   5.374
  321    HB2  LYS  42           1HB      LYS  42 -12.309  -2.344   5.076
  322    HB3  LYS  42           2HB      LYS  42 -11.667  -2.222   3.444
  323    HG2  LYS  42           1HG      LYS  42 -13.126  -3.912   2.651
  324    HG3  LYS  42           2HG      LYS  42 -13.593  -4.373   4.288
  325    HD2  LYS  42           1HD      LYS  42 -14.132  -1.648   3.128
  326    HD3  LYS  42           2HD      LYS  42 -15.273  -2.988   3.011
  327    HE2  LYS  42           1HE      LYS  42 -14.182  -1.848   5.584
  328    HE3  LYS  42           2HE      LYS  42 -15.764  -1.476   4.899
  329    HZ1  LYS  42           3HZ      LYS  42 -14.842  -4.168   5.776
  330    HZ2  LYS  42           1HZ      LYS  42 -16.355  -3.814   5.099
  331    HZ3  LYS  42           2HZ      LYS  42 -15.932  -3.170   6.602
  332    H    PHE  43           H        PHE  43  -9.236  -3.623   2.609
  333    HA   PHE  43           HA       PHE  43 -10.293  -5.505   0.813
  334    HB2  PHE  43           1HB      PHE  43  -8.365  -5.297  -0.535
  335    HB3  PHE  43           2HB      PHE  43  -8.527  -3.734   0.250
  336    HD1  PHE  43           2HD      PHE  43  -6.722  -6.986   0.787
  337    HD2  PHE  43           1HD      PHE  43  -6.616  -2.746   0.990
  338    HE1  PHE  43           2HE      PHE  43  -4.368  -7.087   1.472
  339    HE2  PHE  43           1HE      PHE  43  -4.256  -2.840   1.671
  340    HZ   PHE  43           HZ       PHE  43  -3.133  -5.013   1.923
  341    H    SER  44           H        SER  44  -7.783  -5.930   3.354
  342    HA   SER  44           HA       SER  44  -7.563  -8.729   2.631
  343    HB2  SER  44           1HB      SER  44  -5.882  -8.840   4.368
  344    HB3  SER  44           2HB      SER  44  -5.575  -7.472   3.310
  345    HG   SER  44           HG       SER  44  -5.488  -6.417   5.135
  346    H    GLU  45           H        GLU  45  -9.395  -6.781   4.792
  347    HA   GLU  45           HA       GLU  45 -10.262  -8.652   6.655
  348    HB2  GLU  45           1HB      GLU  45 -10.971  -6.325   6.736
  349    HB3  GLU  45           2HB      GLU  45 -11.832  -6.505   5.215
  350    HG2  GLU  45           1HG      GLU  45 -13.332  -8.135   6.306
  351    HG3  GLU  45           2HG      GLU  45 -12.508  -7.819   7.833
  352    H    GLN  46           H        GLN  46 -11.030  -8.269   3.252
  353    HA   GLN  46           HA       GLN  46 -12.912 -10.466   3.301
  354    HB2  GLN  46           1HB      GLN  46 -11.738  -9.018   0.924
  355    HB3  GLN  46           2HB      GLN  46 -13.122 -10.099   0.909
  356    HG2  GLN  46           1HG      GLN  46 -14.335  -8.507   2.348
  357    HG3  GLN  46           2HG      GLN  46 -12.959  -7.408   2.242
  358   HE21  GLN  46          1HE2      GLN  46 -12.476  -6.443   0.253
  359   HE22  GLN  46          2HE2      GLN  46 -13.652  -6.334  -1.008
  360    H    TYR  47           H        TYR  47  -9.727  -9.745   1.915
  361    HA   TYR  47           HA       TYR  47  -9.237 -12.630   1.772
  362    HB2  TYR  47           1HB      TYR  47  -7.826 -12.006  -0.307
  363    HB3  TYR  47           2HB      TYR  47  -9.570 -12.146  -0.448
  364    HD1  TYR  47           2HD      TYR  47  -6.835  -9.637  -0.053
  365    HD2  TYR  47           1HD      TYR  47 -10.850 -10.400  -1.255
  366    HE1  TYR  47           2HE      TYR  47  -6.975  -7.379  -1.045
  367    HE2  TYR  47           1HE      TYR  47 -11.000  -8.143  -2.216
  368    HH   TYR  47           HH       TYR  47  -8.273  -6.151  -2.658
  369    HA   PRO  48           HA       PRO  48  -5.788 -10.914   4.232
  370    HB2  PRO  48           1HB      PRO  48  -5.425 -13.130   5.726
  371    HB3  PRO  48           2HB      PRO  48  -6.652 -11.922   6.105
  372    HG2  PRO  48           1HG      PRO  48  -6.957 -14.545   4.691
  373    HG3  PRO  48           2HG      PRO  48  -7.982 -13.826   5.947
  374    HD2  PRO  48           1HD      PRO  48  -8.621 -13.729   3.318
  375    HD3  PRO  48           2HD      PRO  48  -9.058 -12.438   4.452
  376    H    GLN  49           H        GLN  49  -6.124 -13.235   1.874
  377    HA   GLN  49           HA       GLN  49  -3.641 -14.538   1.874
  378    HB2  GLN  49           1HB      GLN  49  -4.075 -14.921  -0.532
  379    HB3  GLN  49           2HB      GLN  49  -5.429 -15.376   0.493
  380    HG2  GLN  49           1HG      GLN  49  -6.694 -13.623  -0.180
  381    HG3  GLN  49           2HG      GLN  49  -5.271 -12.659  -0.554
  382   HE21  GLN  49          1HE2      GLN  49  -4.302 -12.839  -2.544
  383   HE22  GLN  49          2HE2      GLN  49  -5.026 -13.699  -3.858
  384    H    ALA  50           H        ALA  50  -4.462 -11.314   1.176
  385    HA   ALA  50           HA       ALA  50  -2.016 -10.922  -0.403
  386    HB1  ALA  50           1HB      ALA  50  -4.334  -9.065   0.113
  387    HB2  ALA  50           2HB      ALA  50  -4.045  -9.991  -1.364
  388    HB3  ALA  50           3HB      ALA  50  -2.933  -8.700  -0.894
  389    H    ASP  51           H        ASP  51  -0.660  -9.043   0.171
  390    HA   ASP  51           HA       ASP  51  -0.314  -9.175   3.046
  391    HB2  ASP  51           1HB      ASP  51   1.561  -8.196   0.897
  392    HB3  ASP  51           2HB      ASP  51   1.925  -8.186   2.611
  393    H    PHE  52           H        PHE  52  -0.596  -7.636   4.381
  394    HA   PHE  52           HA       PHE  52  -1.513  -5.051   3.348
  395    HB2  PHE  52           1HB      PHE  52  -2.433  -5.037   5.843
  396    HB3  PHE  52           2HB      PHE  52  -3.310  -5.831   4.546
  397    HD1  PHE  52           1HD      PHE  52  -1.062  -6.395   7.427
  398    HD2  PHE  52           2HD      PHE  52  -3.658  -8.169   4.560
  399    HE1  PHE  52           1HE      PHE  52  -1.000  -8.506   8.685
  400    HE2  PHE  52           2HE      PHE  52  -3.600 -10.285   5.813
  401    HZ   PHE  52           HZ       PHE  52  -2.270 -10.455   7.877
  402    H    TYR  53           H        TYR  53  -0.011  -3.502   3.488
  403    HA   TYR  53           HA       TYR  53   1.328  -3.180   6.077
  404    HB2  TYR  53           1HB      TYR  53   2.752  -3.077   3.399
  405    HB3  TYR  53           2HB      TYR  53   3.447  -2.561   4.931
  406    HD1  TYR  53           2HD      TYR  53   3.798  -4.279   6.737
  407    HD2  TYR  53           1HD      TYR  53   2.762  -5.340   2.751
  408    HE1  TYR  53           2HE      TYR  53   4.575  -6.573   7.153
  409    HE2  TYR  53           1HE      TYR  53   3.543  -7.636   3.152
  410    HH   TYR  53           HH       TYR  53   5.148  -8.798   4.726
  411    H    LYS  54           H        LYS  54   1.842  -1.096   6.650
  412    HA   LYS  54           HA       LYS  54   0.717   1.056   4.979
  413    HB2  LYS  54           1HB      LYS  54   0.104   0.260   7.768
  414    HB3  LYS  54           2HB      LYS  54   0.121   1.976   7.417
  415    HG2  LYS  54           1HG      LYS  54  -1.692   1.759   5.920
  416    HG3  LYS  54           2HG      LYS  54  -1.545   0.003   5.883
  417    HD2  LYS  54           1HD      LYS  54  -3.439   0.681   7.260
  418    HD3  LYS  54           2HD      LYS  54  -2.199  -0.093   8.247
  419    HE2  LYS  54           1HE      LYS  54  -1.372   2.171   8.864
  420    HE3  LYS  54           2HE      LYS  54  -2.738   2.861   7.993
  421    HZ1  LYS  54           3HZ      LYS  54  -2.920   1.032  10.326
  422    HZ2  LYS  54           1HZ      LYS  54  -4.232   1.701   9.498
  423    HZ3  LYS  54           2HZ      LYS  54  -3.177   2.700  10.363
  424    H    LEU  55           H        LEU  55   1.759   3.061   5.125
  425    HA   LEU  55           HA       LEU  55   3.539   3.636   7.302
  426    HB2  LEU  55           1HB      LEU  55   5.024   2.331   5.893
  427    HB3  LEU  55           2HB      LEU  55   4.610   3.298   4.497
  428    HG   LEU  55           HG       LEU  55   5.867   4.647   6.848
  429   HD11  LEU  55          1HD1      LEU  55   7.271   2.687   6.494
  430   HD12  LEU  55          2HD1      LEU  55   8.088   4.140   5.918
  431   HD13  LEU  55          3HD1      LEU  55   7.342   3.033   4.766
  432   HD21  LEU  55          3HD2      LEU  55   6.352   5.060   3.920
  433   HD22  LEU  55          1HD2      LEU  55   6.556   6.203   5.244
  434   HD23  LEU  55          2HD2      LEU  55   4.934   5.738   4.722
  435    H    ASP  56           H        ASP  56   3.943   5.882   7.479
  436    HA   ASP  56           HA       ASP  56   2.406   7.541   5.628
  437    HB2  ASP  56           1HB      ASP  56   2.523   9.251   7.406
  438    HB3  ASP  56           2HB      ASP  56   1.661   7.802   7.897
  439    H    VAL  57           H        VAL  57   3.332   9.042   4.410
  440    HA   VAL  57           HA       VAL  57   6.142   8.957   4.004
  441    HB   VAL  57           HB       VAL  57   5.802  10.331   2.164
  442   HG11  VAL  57          1HG1      VAL  57   3.063   9.154   2.612
  443   HG12  VAL  57          2HG1      VAL  57   4.466   8.258   2.019
  444   HG13  VAL  57          3HG1      VAL  57   3.792   9.577   1.060
  445   HG21  VAL  57          3HG2      VAL  57   3.370  11.479   3.525
  446   HG22  VAL  57          1HG2      VAL  57   3.944  11.914   1.916
  447   HG23  VAL  57          2HG2      VAL  57   4.932  12.271   3.330
  448    H    ASP  58           H        ASP  58   4.239  10.692   6.191
  449    HA   ASP  58           HA       ASP  58   5.734  13.104   6.360
  450    HB2  ASP  58           1HB      ASP  58   3.487  12.990   7.289
  451    HB3  ASP  58           2HB      ASP  58   3.985  11.728   8.413
  452    H    GLU  59           H        GLU  59   5.773  10.055   8.161
  453    HA   GLU  59           HA       GLU  59   8.134  10.831   9.628
  454    HB2  GLU  59           1HB      GLU  59   6.288   9.395  10.554
  455    HB3  GLU  59           2HB      GLU  59   6.823   8.116   9.477
  456    HG2  GLU  59           1HG      GLU  59   8.982   8.060  10.585
  457    HG3  GLU  59           2HG      GLU  59   8.487   9.384  11.638
  458    H    LEU  60           H        LEU  60   7.316   8.619   6.952
  459    HA   LEU  60           HA       LEU  60  10.227   8.373   6.476
  460    HB2  LEU  60           1HB      LEU  60   8.104   6.273   6.203
  461    HB3  LEU  60           2HB      LEU  60   9.629   6.145   5.361
  462    HG   LEU  60           HG       LEU  60   9.911   4.824   7.251
  463   HD11  LEU  60          1HD1      LEU  60  11.571   5.917   8.615
  464   HD12  LEU  60          2HD1      LEU  60  11.014   7.500   8.076
  465   HD13  LEU  60          3HD1      LEU  60  11.766   6.393   6.928
  466   HD21  LEU  60          3HD2      LEU  60   8.596   6.998   8.865
  467   HD22  LEU  60          1HD2      LEU  60   9.309   5.529   9.532
  468   HD23  LEU  60          2HD2      LEU  60   7.919   5.423   8.453
  469    H    GLY  61           H        GLY  61   9.886  10.299   5.155
  470    HA2  GLY  61           1HA      GLY  61   8.345  10.128   2.745
  471    HA3  GLY  61           2HA      GLY  61   9.507  11.381   3.155
  472    H    ASP  62           H        ASP  62  11.698   9.544   3.602
  473    HA   ASP  62           HA       ASP  62  12.736   9.434   0.975
  474    HB2  ASP  62           1HB      ASP  62  13.714   8.068   3.482
  475    HB3  ASP  62           2HB      ASP  62  14.625   8.178   1.982
  476    H    VAL  63           H        VAL  63  11.056   7.176   2.950
  477    HA   VAL  63           HA       VAL  63  11.529   4.878   1.331
  478    HB   VAL  63           HB       VAL  63   9.232   5.453   3.192
  479   HG11  VAL  63          1HG1      VAL  63  10.242   2.882   1.985
  480   HG12  VAL  63          2HG1      VAL  63   8.689   3.657   1.690
  481   HG13  VAL  63          3HG1      VAL  63   9.044   2.973   3.274
  482   HG21  VAL  63          3HG2      VAL  63  11.739   3.866   3.732
  483   HG22  VAL  63          1HG2      VAL  63  10.461   4.263   4.880
  484   HG23  VAL  63          2HG2      VAL  63  11.499   5.541   4.244
  485    H    ALA  64           H        ALA  64   8.777   7.142   1.615
  486    HA   ALA  64           HA       ALA  64   7.193   6.198  -0.417
  487    HB1  ALA  64           1HB      ALA  64   7.717   9.089   0.253
  488    HB2  ALA  64           2HB      ALA  64   6.551   8.037   1.057
  489    HB3  ALA  64           3HB      ALA  64   6.329   8.468  -0.640
  490    H    GLN  65           H        GLN  65  10.040   8.264  -0.647
  491    HA   GLN  65           HA       GLN  65   9.822   8.730  -3.459
  492    HB2  GLN  65           1HB      GLN  65  12.286   8.847  -1.708
  493    HB3  GLN  65           2HB      GLN  65  12.137   9.534  -3.319
  494    HG2  GLN  65           1HG      GLN  65  10.438  11.078  -2.512
  495    HG3  GLN  65           2HG      GLN  65  10.565  10.380  -0.897
  496   HE21  GLN  65          1HE2      GLN  65  13.490  10.058  -1.196
  497   HE22  GLN  65          2HE2      GLN  65  14.148  11.640  -0.979
  498    H    LYS  66           H        LYS  66  11.390   6.301  -1.489
  499    HA   LYS  66           HA       LYS  66  12.909   5.056  -3.445
  500    HB2  LYS  66           1HB      LYS  66  13.481   4.453  -1.301
  501    HB3  LYS  66           2HB      LYS  66  11.813   4.397  -0.754
  502    HG2  LYS  66           1HG      LYS  66  12.630   2.201  -0.703
  503    HG3  LYS  66           2HG      LYS  66  11.545   2.328  -2.081
  504    HD2  LYS  66           1HD      LYS  66  13.538   2.702  -3.537
  505    HD3  LYS  66           2HD      LYS  66  14.561   2.374  -2.140
  506    HE2  LYS  66           1HE      LYS  66  14.302   0.412  -3.581
  507    HE3  LYS  66           2HE      LYS  66  13.657   0.141  -1.962
  508    HZ1  LYS  66           3HZ      LYS  66  12.125   0.673  -4.445
  509    HZ2  LYS  66           1HZ      LYS  66  11.433   0.690  -2.901
  510    HZ3  LYS  66           2HZ      LYS  66  12.116  -0.735  -3.501
  511    H    ASN  67           H        ASN  67   9.489   5.045  -2.866
  512    HA   ASN  67           HA       ASN  67   9.154   2.521  -4.326
  513    HB2  ASN  67           1HB      ASN  67   7.017   3.994  -2.844
  514    HB3  ASN  67           2HB      ASN  67   7.098   2.297  -3.251
  515   HD21  ASN  67          1HD2      ASN  67   6.909   4.041  -0.786
  516   HD22  ASN  67          2HD2      ASN  67   7.990   3.293   0.307
  517    H    GLU  68           H        GLU  68   8.943   5.846  -4.665
  518    HA   GLU  68           HA       GLU  68   8.365   7.106  -6.464
  519    HB2  GLU  68           1HB      GLU  68   7.010   4.632  -7.542
  520    HB3  GLU  68           2HB      GLU  68   7.219   6.150  -8.412
  521    HG2  GLU  68           1HG      GLU  68   9.604   5.870  -8.450
  522    HG3  GLU  68           2HG      GLU  68   9.491   4.444  -7.419
  523    H    VAL  69           H        VAL  69   6.766   6.553  -4.012
  524    HA   VAL  69           HA       VAL  69   4.170   7.480  -5.023
  525    HB   VAL  69           HB       VAL  69   3.567   5.770  -3.607
  526   HG11  VAL  69          1HG1      VAL  69   5.915   5.374  -2.796
  527   HG12  VAL  69          2HG1      VAL  69   4.630   5.032  -1.644
  528   HG13  VAL  69          3HG1      VAL  69   5.577   6.518  -1.499
  529   HG21  VAL  69          3HG2      VAL  69   2.727   6.715  -1.503
  530   HG22  VAL  69          1HG2      VAL  69   2.422   7.778  -2.876
  531   HG23  VAL  69          2HG2      VAL  69   3.732   8.140  -1.754
  532    H    SER  70           H        SER  70   3.886   9.574  -5.075
  533    HA   SER  70           HA       SER  70   5.331  11.237  -3.118
  534    HB2  SER  70           1HB      SER  70   5.145  13.050  -4.890
  535    HB3  SER  70           2HB      SER  70   6.227  11.711  -5.273
  536    HG   SER  70           HG       SER  70   4.897  11.037  -6.800
  537    H    ALA  71           H        ALA  71   2.283  10.427  -4.491
  538    HA   ALA  71           HA       ALA  71   0.963  12.737  -3.283
  539    HB1  ALA  71           1HB      ALA  71   0.305  12.122  -5.556
  540    HB2  ALA  71           2HB      ALA  71  -1.044  11.936  -4.435
  541    HB3  ALA  71           3HB      ALA  71  -0.160  10.517  -4.992
  542    H    MET  72           H        MET  72  -1.105  12.244  -2.052
  543    HA   MET  72           HA       MET  72  -1.088   9.700  -0.673
  544    HB2  MET  72           1HB      MET  72  -1.059  10.756   1.577
  545    HB3  MET  72           2HB      MET  72   0.462  10.904   0.714
  546    HG2  MET  72           1HG      MET  72  -1.575  13.103   0.712
  547    HG3  MET  72           2HG      MET  72  -0.389  12.931   2.001
  548    HE1  MET  72           3HE      MET  72   2.986  13.355   0.060
  549    HE2  MET  72           1HE      MET  72   2.151  11.814   0.249
  550    HE3  MET  72           2HE      MET  72   2.218  12.950   1.595
  551    HA   PRO  73           HA       PRO  73  -2.014   8.705   0.724
  552    HB2  PRO  73           1HB      PRO  73  -4.039   6.935   0.879
  553    HB3  PRO  73           2HB      PRO  73  -3.721   8.140   2.127
  554    HG2  PRO  73           1HG      PRO  73  -5.820   8.097   0.023
  555    HG3  PRO  73           2HG      PRO  73  -5.897   8.750   1.680
  556    HD2  PRO  73           1HD      PRO  73  -5.514  10.230  -0.669
  557    HD3  PRO  73           2HD      PRO  73  -5.162  10.793   0.974
  558    H    THR  74           H        THR  74  -1.266   6.807  -0.211
  559    HA   THR  74           HA       THR  74  -2.119   6.241  -2.977
  560    HB   THR  74           HB       THR  74   0.689   6.632  -1.920
  561    HG1  THR  74           1HG      THR  74   0.178   8.529  -2.732
  562   HG21  THR  74          3HG2      THR  74   1.555   5.887  -4.061
  563   HG22  THR  74          1HG2      THR  74  -0.079   5.503  -4.618
  564   HG23  THR  74          2HG2      THR  74   0.642   4.591  -3.290
  565    H    LEU  75           H        LEU  75  -2.251   4.167  -3.512
  566    HA   LEU  75           HA       LEU  75  -1.298   2.150  -1.585
  567    HB2  LEU  75           1HB      LEU  75  -3.318   1.883  -3.801
  568    HB3  LEU  75           2HB      LEU  75  -2.882   0.636  -2.648
  569    HG   LEU  75           HG       LEU  75  -3.733   2.570  -0.965
  570   HD11  LEU  75          1HD1      LEU  75  -4.366   4.072  -2.811
  571   HD12  LEU  75          2HD1      LEU  75  -5.761   3.575  -1.854
  572   HD13  LEU  75          3HD1      LEU  75  -5.467   2.838  -3.429
  573   HD21  LEU  75          3HD2      LEU  75  -5.323   0.454  -2.391
  574   HD22  LEU  75          1HD2      LEU  75  -5.859   1.296  -0.937
  575   HD23  LEU  75          2HD2      LEU  75  -4.411   0.293  -0.888
  576    H    LEU  76           H        LEU  76   0.432   0.968  -2.236
  577    HA   LEU  76           HA       LEU  76   0.930   0.802  -5.135
  578    HB2  LEU  76           1HB      LEU  76   2.653   1.566  -2.981
  579    HB3  LEU  76           2HB      LEU  76   3.274   0.100  -3.715
  580    HG   LEU  76           HG       LEU  76   2.643   2.654  -5.202
  581   HD11  LEU  76          1HD1      LEU  76   5.066   2.900  -5.430
  582   HD12  LEU  76          2HD1      LEU  76   5.306   1.460  -4.430
  583   HD13  LEU  76          3HD1      LEU  76   4.576   2.903  -3.730
  584   HD21  LEU  76          3HD2      LEU  76   2.346   0.663  -6.577
  585   HD22  LEU  76          1HD2      LEU  76   3.953   0.095  -6.125
  586   HD23  LEU  76          2HD2      LEU  76   3.773   1.566  -7.082
  587    H    LEU  77           H        LEU  77   0.464  -1.069  -5.955
  588    HA   LEU  77           HA       LEU  77   0.469  -3.486  -4.284
  589    HB2  LEU  77           1HB      LEU  77  -0.681  -2.840  -6.998
  590    HB3  LEU  77           2HB      LEU  77  -0.590  -4.476  -6.393
  591    HG   LEU  77           HG       LEU  77  -2.296  -4.130  -4.817
  592   HD11  LEU  77          1HD1      LEU  77  -1.427  -2.038  -3.826
  593   HD12  LEU  77          2HD1      LEU  77  -3.158  -1.951  -4.158
  594   HD13  LEU  77          3HD1      LEU  77  -2.012  -1.146  -5.230
  595   HD21  LEU  77          3HD2      LEU  77  -3.014  -4.107  -7.172
  596   HD22  LEU  77          1HD2      LEU  77  -2.990  -2.339  -7.132
  597   HD23  LEU  77          2HD2      LEU  77  -4.108  -3.229  -6.095
  598    H    PHE  78           H        PHE  78   2.005  -5.014  -4.534
  599    HA   PHE  78           HA       PHE  78   3.648  -4.924  -6.971
  600    HB2  PHE  78           1HB      PHE  78   4.573  -5.088  -4.117
  601    HB3  PHE  78           2HB      PHE  78   5.558  -5.708  -5.435
  602    HD1  PHE  78           1HD      PHE  78   4.073  -2.673  -3.978
  603    HD2  PHE  78           2HD      PHE  78   6.733  -4.255  -6.894
  604    HE1  PHE  78           1HE      PHE  78   4.999  -0.433  -4.354
  605    HE2  PHE  78           2HE      PHE  78   7.658  -2.011  -7.277
  606    HZ   PHE  78           HZ       PHE  78   6.791  -0.092  -6.002
  607    H    LYS  79           H        LYS  79   4.346  -6.925  -7.792
  608    HA   LYS  79           HA       LYS  79   3.633  -9.307  -6.201
  609    HB2  LYS  79           1HB      LYS  79   3.096  -8.638  -9.036
  610    HB3  LYS  79           2HB      LYS  79   3.634 -10.280  -8.710
  611    HG2  LYS  79           1HG      LYS  79   1.295  -8.960  -7.346
  612    HG3  LYS  79           2HG      LYS  79   1.158  -9.973  -8.783
  613    HD2  LYS  79           1HD      LYS  79   2.429 -10.924  -6.225
  614    HD3  LYS  79           2HD      LYS  79   0.709 -11.107  -6.567
  615    HE2  LYS  79           1HE      LYS  79   2.928 -12.175  -8.309
  616    HE3  LYS  79           2HE      LYS  79   2.057 -13.123  -7.107
  617    HZ1  LYS  79           3HZ      LYS  79   1.110 -13.496  -9.264
  618    HZ2  LYS  79           1HZ      LYS  79   0.897 -11.840  -9.522
  619    HZ3  LYS  79           2HZ      LYS  79  -0.010 -12.637  -8.334
  620    H    ASN  80           H        ASN  80   5.575  -9.939  -5.416
  621    HA   ASN  80           HA       ASN  80   7.569 -11.031  -5.437
  622    HB2  ASN  80           1HB      ASN  80   6.381 -12.467  -7.025
  623    HB3  ASN  80           2HB      ASN  80   6.880 -11.424  -8.345
  624   HD21  ASN  80          1HD2      ASN  80   7.926 -12.967  -9.444
  625   HD22  ASN  80          2HD2      ASN  80   9.411 -13.686  -8.916
  626    H    GLY  81           H        GLY  81   8.013  -8.444  -5.339
  627    HA2  GLY  81           1HA      GLY  81   9.767  -6.954  -5.593
  628    HA3  GLY  81           2HA      GLY  81  10.575  -8.168  -6.585
  629    H    LYS  82           H        LYS  82   7.519  -7.646  -7.779
  630    HA   LYS  82           HA       LYS  82   8.442  -5.556  -9.644
  631    HB2  LYS  82           1HB      LYS  82   6.558  -7.862 -10.233
  632    HB3  LYS  82           2HB      LYS  82   7.078  -6.631 -11.376
  633    HG2  LYS  82           1HG      LYS  82   9.325  -7.452 -11.333
  634    HG3  LYS  82           2HG      LYS  82   8.933  -8.579 -10.036
  635    HD2  LYS  82           1HD      LYS  82   9.029  -9.787 -12.114
  636    HD3  LYS  82           2HD      LYS  82   7.353  -9.723 -11.571
  637    HE2  LYS  82           1HE      LYS  82   8.328  -7.612 -13.426
  638    HE3  LYS  82           2HE      LYS  82   8.027  -9.219 -14.076
  639    HZ1  LYS  82           3HZ      LYS  82   6.040  -7.600 -12.578
  640    HZ2  LYS  82           1HZ      LYS  82   5.763  -9.102 -13.302
  641    HZ3  LYS  82           2HZ      LYS  82   6.097  -7.748 -14.257
  642    H    GLU  83           H        GLU  83   6.681  -4.166 -10.390
  643    HA   GLU  83           HA       GLU  83   4.754  -3.607  -8.363
  644    HB2  GLU  83           1HB      GLU  83   5.865  -1.952  -9.942
  645    HB3  GLU  83           2HB      GLU  83   4.818  -2.578 -11.204
  646    HG2  GLU  83           1HG      GLU  83   2.861  -1.803 -10.060
  647    HG3  GLU  83           2HG      GLU  83   3.827  -1.349  -8.648
  648    H    VAL  84           H        VAL  84   2.362  -3.353  -9.124
  649    HA   VAL  84           HA       VAL  84   1.625  -4.916 -11.431
  650    HB   VAL  84           HB       VAL  84  -0.413  -5.800 -10.014
  651   HG11  VAL  84          1HG1      VAL  84   1.121  -7.156 -11.373
  652   HG12  VAL  84          2HG1      VAL  84   0.689  -7.952  -9.860
  653   HG13  VAL  84          3HG1      VAL  84   2.267  -7.177 -10.030
  654   HG21  VAL  84          3HG2      VAL  84   1.827  -5.931  -8.023
  655   HG22  VAL  84          1HG2      VAL  84   0.171  -6.496  -7.820
  656   HG23  VAL  84          2HG2      VAL  84   0.504  -4.768  -7.939
  657    H    ALA  85           H        ALA  85   0.814  -2.676  -8.877
  658    HA   ALA  85           HA       ALA  85  -0.485  -0.969 -10.700
  659    HB1  ALA  85           1HB      ALA  85  -2.753  -1.019  -9.625
  660    HB2  ALA  85           2HB      ALA  85  -2.259  -2.516  -8.831
  661    HB3  ALA  85           3HB      ALA  85  -2.349  -2.438 -10.587
  662    H    LYS  86           H        LYS  86  -0.993   1.072  -9.841
  663    HA   LYS  86           HA       LYS  86  -0.618   1.449  -6.976
  664    HB2  LYS  86           1HB      LYS  86   0.790   3.432  -7.296
  665    HB3  LYS  86           2HB      LYS  86   1.572   1.986  -7.901
  666    HG2  LYS  86           1HG      LYS  86   0.091   3.852  -9.723
  667    HG3  LYS  86           2HG      LYS  86   1.776   4.120  -9.276
  668    HD2  LYS  86           1HD      LYS  86   2.252   1.790 -10.095
  669    HD3  LYS  86           2HD      LYS  86   0.608   1.759 -10.736
  670    HE2  LYS  86           1HE      LYS  86   1.104   3.685 -12.140
  671    HE3  LYS  86           2HE      LYS  86   2.733   3.772 -11.469
  672    HZ1  LYS  86           3HZ      LYS  86   1.593   1.629 -13.168
  673    HZ2  LYS  86           1HZ      LYS  86   3.061   1.463 -12.333
  674    HZ3  LYS  86           2HZ      LYS  86   2.888   2.656 -13.525
  675    H    VAL  87           H        VAL  87  -1.969   2.918  -6.098
  676    HA   VAL  87           HA       VAL  87  -3.627   4.506  -7.939
  677    HB   VAL  87           HB       VAL  87  -4.751   2.950  -5.604
  678   HG11  VAL  87          1HG1      VAL  87  -6.925   3.587  -6.585
  679   HG12  VAL  87          2HG1      VAL  87  -6.073   4.572  -7.775
  680   HG13  VAL  87          3HG1      VAL  87  -5.979   4.980  -6.061
  681   HG21  VAL  87          3HG2      VAL  87  -4.082   1.408  -7.365
  682   HG22  VAL  87          1HG2      VAL  87  -4.963   2.364  -8.557
  683   HG23  VAL  87          2HG2      VAL  87  -5.840   1.523  -7.280
  684    H    VAL  88           H        VAL  88  -3.698   6.571  -7.354
  685    HA   VAL  88           HA       VAL  88  -2.666   7.299  -4.728
  686    HB   VAL  88           HB       VAL  88  -2.664   9.641  -5.678
  687   HG11  VAL  88          1HG1      VAL  88  -1.090   7.529  -7.147
  688   HG12  VAL  88          2HG1      VAL  88  -0.657   8.264  -5.606
  689   HG13  VAL  88          3HG1      VAL  88  -0.687   9.244  -7.072
  690   HG21  VAL  88          3HG2      VAL  88  -4.366   9.255  -7.428
  691   HG22  VAL  88          1HG2      VAL  88  -3.231   8.202  -8.270
  692   HG23  VAL  88          2HG2      VAL  88  -2.867   9.917  -8.079
  693    H    GLY  89           H        GLY  89  -5.026   6.231  -4.257
  694    HA2  GLY  89           1HA      GLY  89  -6.488   8.065  -2.864
  695    HA3  GLY  89           2HA      GLY  89  -7.210   8.067  -4.468
  696    H    ALA  90           H        ALA  90  -7.943   7.018  -1.641
  697    HA   ALA  90           HA       ALA  90  -8.275   4.229  -1.885
  698    HB1  ALA  90           1HB      ALA  90  -9.703   4.392   0.016
  699    HB2  ALA  90           2HB      ALA  90  -9.947   6.117  -0.264
  700    HB3  ALA  90           3HB      ALA  90  -8.366   5.524   0.226
  701    H    ASN  91           H        ASN  91  -9.329   3.417  -3.552
  702    HA   ASN  91           HA       ASN  91 -11.972   4.538  -4.204
  703    HB2  ASN  91           1HB      ASN  91  -9.911   4.168  -5.891
  704    HB3  ASN  91           2HB      ASN  91 -10.620   2.561  -5.970
  705   HD21  ASN  91          1HD2      ASN  91 -13.337   3.637  -5.506
  706   HD22  ASN  91          2HD2      ASN  91 -13.810   4.321  -7.025
  707    HA   PRO  92           HA       PRO  92 -12.808   1.184  -1.215
  708    HB2  PRO  92           1HB      PRO  92 -15.453   1.717  -2.527
  709    HB3  PRO  92           2HB      PRO  92 -15.097   1.367  -0.831
  710    HG2  PRO  92           1HG      PRO  92 -15.450   3.882  -1.697
  711    HG3  PRO  92           2HG      PRO  92 -14.288   3.487  -0.420
  712    HD2  PRO  92           1HD      PRO  92 -13.790   4.383  -3.161
  713    HD3  PRO  92           2HD      PRO  92 -12.686   4.340  -1.782
  714    H    ALA  93           H        ALA  93 -15.004   0.766  -3.994
  715    HA   ALA  93           HA       ALA  93 -14.679  -2.068  -3.828
  716    HB1  ALA  93           1HB      ALA  93 -16.072  -0.431  -5.943
  717    HB2  ALA  93           2HB      ALA  93 -16.811  -1.052  -4.467
  718    HB3  ALA  93           3HB      ALA  93 -16.231  -2.170  -5.700
  719    H    ALA  94           H        ALA  94 -13.470   0.428  -5.993
  720    HA   ALA  94           HA       ALA  94 -12.481  -1.313  -7.987
  721    HB1  ALA  94           1HB      ALA  94 -12.843   1.073  -8.381
  722    HB2  ALA  94           2HB      ALA  94 -11.189   0.596  -8.767
  723    HB3  ALA  94           3HB      ALA  94 -11.531   1.453  -7.266
  724    H    ILE  95           H        ILE  95 -11.140  -0.173  -4.953
  725    HA   ILE  95           HA       ILE  95  -8.495  -1.145  -5.497
  726    HB   ILE  95           HB       ILE  95  -9.803  -0.319  -2.907
  727   HG12  ILE  95          1HG1      ILE  95  -9.391   1.522  -4.468
  728   HG13  ILE  95          2HG1      ILE  95  -8.307   1.631  -3.086
  729   HG21  ILE  95          1HG2      ILE  95  -8.119  -1.987  -2.432
  730   HG22  ILE  95          2HG2      ILE  95  -7.539  -0.397  -1.934
  731   HG23  ILE  95          3HG2      ILE  95  -6.949  -1.126  -3.430
  732   HD11  ILE  95          3HD1      ILE  95  -7.108   2.156  -5.090
  733   HD12  ILE  95          1HD1      ILE  95  -7.618   0.645  -5.842
  734   HD13  ILE  95          2HD1      ILE  95  -6.524   0.616  -4.459
  735    H    LYS  96           H        LYS  96 -11.217  -2.268  -3.505
  736    HA   LYS  96           HA       LYS  96  -9.963  -4.651  -2.666
  737    HB2  LYS  96           1HB      LYS  96 -12.935  -4.172  -2.959
  738    HB3  LYS  96           2HB      LYS  96 -12.146  -5.377  -1.932
  739    HG2  LYS  96           1HG      LYS  96 -11.182  -3.626  -0.565
  740    HG3  LYS  96           2HG      LYS  96 -11.915  -2.394  -1.595
  741    HD2  LYS  96           1HD      LYS  96 -13.452  -4.470  -0.033
  742    HD3  LYS  96           2HD      LYS  96 -13.181  -2.810   0.499
  743    HE2  LYS  96           1HE      LYS  96 -14.366  -1.985  -1.478
  744    HE3  LYS  96           2HE      LYS  96 -14.625  -3.642  -2.017
  745    HZ1  LYS  96           3HZ      LYS  96 -16.571  -2.730  -0.904
  746    HZ2  LYS  96           1HZ      LYS  96 -15.673  -2.483   0.506
  747    HZ3  LYS  96           2HZ      LYS  96 -15.952  -4.052  -0.058
  748    H    GLN  97           H        GLN  97 -11.604  -3.760  -5.579
  749    HA   GLN  97           HA       GLN  97 -11.664  -6.435  -6.646
  750    HB2  GLN  97           1HB      GLN  97 -13.241  -4.747  -7.457
  751    HB3  GLN  97           2HB      GLN  97 -11.909  -3.739  -8.007
  752    HG2  GLN  97           1HG      GLN  97 -11.264  -5.721  -9.486
  753    HG3  GLN  97           2HG      GLN  97 -12.870  -6.349  -9.120
  754   HE21  GLN  97          1HE2      GLN  97 -11.056  -3.871 -10.723
  755   HE22  GLN  97          2HE2      GLN  97 -12.358  -3.252 -11.678
  756    H    ALA  98           H        ALA  98  -9.468  -3.683  -6.731
  757    HA   ALA  98           HA       ALA  98  -7.836  -4.502  -8.863
  758    HB1  ALA  98           1HB      ALA  98  -7.083  -2.900  -6.428
  759    HB2  ALA  98           2HB      ALA  98  -7.732  -2.254  -7.936
  760    HB3  ALA  98           3HB      ALA  98  -6.148  -3.026  -7.919
  761    H    ILE  99           H        ILE  99  -7.270  -4.787  -5.397
  762    HA   ILE  99           HA       ILE  99  -4.959  -6.240  -5.390
  763    HB   ILE  99           HB       ILE  99  -7.147  -6.942  -3.453
  764   HG12  ILE  99          1HG1      ILE  99  -7.394  -4.601  -3.452
  765   HG13  ILE  99          2HG1      ILE  99  -6.309  -4.935  -2.105
  766   HG21  ILE  99          1HG2      ILE  99  -5.086  -8.128  -3.199
  767   HG22  ILE  99          2HG2      ILE  99  -5.228  -6.966  -1.879
  768   HG23  ILE  99          3HG2      ILE  99  -4.167  -6.626  -3.245
  769   HD11  ILE  99          3HD1      ILE  99  -4.411  -4.369  -3.588
  770   HD12  ILE  99          1HD1      ILE  99  -5.520  -3.029  -3.282
  771   HD13  ILE  99          2HD1      ILE  99  -5.589  -3.895  -4.820
  772    H    ALA 100           H        ALA 100  -8.269  -7.387  -5.824
  773    HA   ALA 100           HA       ALA 100  -7.623 -10.169  -5.667
  774    HB1  ALA 100           1HB      ALA 100 -10.075  -8.777  -6.733
  775    HB2  ALA 100           2HB      ALA 100  -9.834  -9.366  -5.088
  776    HB3  ALA 100           3HB      ALA 100  -9.931 -10.507  -6.427
  777    H    ALA 101           H        ALA 101  -7.437  -7.799  -8.169
  778    HA   ALA 101           HA       ALA 101  -7.633  -9.763 -10.309
  779    HB1  ALA 101           1HB      ALA 101  -7.144  -6.789 -10.451
  780    HB2  ALA 101           2HB      ALA 101  -8.727  -7.567 -10.564
  781    HB3  ALA 101           3HB      ALA 101  -7.510  -7.861 -11.806
  782    H    ASN 102           H        ASN 102  -5.307  -7.921  -8.516
  783    HA   ASN 102           HA       ASN 102  -3.203  -8.652 -10.392
  784    HB2  ASN 102           1HB      ASN 102  -1.800  -7.193  -8.714
  785    HB3  ASN 102           2HB      ASN 102  -2.830  -6.471  -9.905
  786   HD21  ASN 102          1HD2      ASN 102  -4.434  -5.143  -9.310
  787   HD22  ASN 102          2HD2      ASN 102  -4.747  -4.751  -7.664
  788    H    ALA 103           H        ALA 103  -4.556  -9.847  -7.565
  789    HA   ALA 103           HA       ALA 103  -2.195 -11.039  -6.475
  790    HB1  ALA 103           1HB      ALA 103  -3.715 -12.323  -5.073
  791    HB2  ALA 103           2HB      ALA 103  -5.083 -11.800  -6.056
  792    HB3  ALA 103           3HB      ALA 103  -4.183 -10.623  -5.100