*HEADER    REPLICATION                             28-MAY-08   2K47              
*TITLE     SOLUTION STRUCTURE OF THE C-TERMINAL N-RNA BINDING DOMAIN             
*TITLE    2 OF THE VESICULAR STOMATITIS VIRUS PHOSPHOPROTEIN                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PHOSPHOPROTEIN;                                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: C-TERMINAL DOMAIN;                                         
*COMPND   5 SYNONYM: P PROTEIN, M1;                                              
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: VESICULAR STOMATITIS INDIANA VIRUS;             
*SOURCE   3 ORGANISM_COMMON: VSIV;                                               
*SOURCE   4 GENE: P;                                                             
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET22B                                     
*KEYWDS    FLEXIBLE TAIL, CHAPERONE, CYTOPLASM, PHOSPHOPROTEIN, RNA              
*KEYWDS   2 REPLICATION, VIRION                                                  
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    E.A.RIBEIRO, A.FAVIER, F.C.GERARD, C.LEYRAT, B.BRUTSCHER,             
*AUTHOR   2 D.BLONDEL, R.W.RUIGROK, M.BLACKLEDGE, M.JAMIN                        
*REVDAT   1   09-SEP-08 2K47    0                                                


assign ( resid 2 and name CA ) ( resid 2  and name HA ) 23.24    5.26   1.00    0
assign ( resid 4 and name CA ) ( resid 4  and name HA ) -42.69    3.07   1.00    0
assign ( resid 5 and name CA ) ( resid 5  and name HA ) 1.96    2.76   1.00    0
assign ( resid 7 and name CA ) ( resid 7  and name HA ) -3.97    5.25   1.00    0
assign ( resid 13 and name CA ) ( resid 13  and name HA ) 16.63    2.88   1.00    0
assign ( resid 15 and name CA ) ( resid 15  and name HA ) 19.60    3.31   1.00    0
assign ( resid 16 and name CA ) ( resid 16  and name HA ) 16.80    2.79   1.00    0
assign ( resid 24 and name CA ) ( resid 24  and name HA ) 16.56    1.97   1.00    0
assign ( resid 27 and name CA ) ( resid 27  and name HA ) 15.64    2.96   1.00    0
assign ( resid 28 and name CA ) ( resid 28  and name HA ) 14.46    4.68   1.00    0
assign ( resid 30 and name CA ) ( resid 30  and name HA ) -7.58    3.49   1.00    0
assign ( resid 31 and name CA ) ( resid 31  and name HA ) -8.93    2.69   1.00    0
assign ( resid 32 and name CA ) ( resid 32  and name HA ) 15.46    2.13   1.00    0
assign ( resid 33 and name CA ) ( resid 33  and name HA ) -21.67    3.40   1.00    0
assign ( resid 38 and name CA ) ( resid 38  and name HA ) 3.03    4.73   1.00    0
assign ( resid 39 and name CA ) ( resid 39  and name HA ) 26.46    2.27   1.00    0
assign ( resid 40 and name CA ) ( resid 40  and name HA ) -44.90    4.90   1.00    0
assign ( resid 43 and name CA ) ( resid 43  and name HA ) 23.41    4.84   1.00    0
assign ( resid 48 and name CA ) ( resid 48  and name HA ) 12.45    2.50   1.00    0
assign ( resid 49 and name CA ) ( resid 49  and name HA ) 12.67    2.04   1.00    0
assign ( resid 50 and name CA ) ( resid 50  and name HA ) -14.41    4.43   1.00    0
assign ( resid 51 and name CA ) ( resid 51  and name HA ) 4.86    2.79   1.00    0
assign ( resid 52 and name CA ) ( resid 52  and name HA ) 8.25    1.64   1.00    0
assign ( resid 53 and name CA ) ( resid 53  and name HA ) -36.14    2.23   1.00    0
assign ( resid 54 and name CA ) ( resid 54  and name HA ) 21.86    3.78   1.00    0
assign ( resid 56 and name CA ) ( resid 56  and name HA ) -22.97    2.39   1.00    0
assign ( resid 59 and name CA ) ( resid 59  and name HA ) 19.75    2.43   1.00    0
assign ( resid 61 and name CA ) ( resid 61  and name HA ) 17.92    3.18   1.00    0
assign ( resid 64 and name CA ) ( resid 64  and name HA ) 17.29    4.47   1.00    0
assign ( resid 65 and name CA ) ( resid 65  and name HA ) -17.84    4.00   1.00    0
assign ( resid 3 and name C ) ( resid 3  and name CA ) 1.50    0.93   1.00    0
assign ( resid 4 and name C ) ( resid 4  and name CA ) 2.07    0.86   1.00    0
assign ( resid 5 and name C ) ( resid 5  and name CA ) -2.01    0.90   1.00    0
assign ( resid 7 and name C ) ( resid 7  and name CA ) -0.63    0.86   1.00    0
assign ( resid 12 and name C ) ( resid 12  and name CA ) 0.52    0.73   1.00    0
assign ( resid 13 and name C ) ( resid 13  and name CA ) -3.52    0.96   1.00    0
assign ( resid 15 and name C ) ( resid 15  and name CA ) -0.74    0.89   1.00    0
assign ( resid 16 and name C ) ( resid 16  and name CA ) -3.99    1.24   1.00    0
assign ( resid 24 and name C ) ( resid 24  and name CA ) -2.90    0.66   1.00    0
assign ( resid 27 and name C ) ( resid 27  and name CA ) 1.25    0.68   1.00    0
assign ( resid 30 and name C ) ( resid 30  and name CA ) 2.21    1.00   1.00    0
assign ( resid 31 and name C ) ( resid 31  and name CA ) -0.54    1.16   1.00    0
assign ( resid 32 and name C ) ( resid 32  and name CA ) 1.61    0.76   1.00    0
assign ( resid 33 and name C ) ( resid 33  and name CA ) -0.75    0.93   1.00    0
assign ( resid 35 and name C ) ( resid 35  and name CA ) -4.66    0.71   1.00    0
assign ( resid 38 and name C ) ( resid 38  and name CA ) -2.98    0.78   1.00    0
assign ( resid 39 and name C ) ( resid 39  and name CA ) 1.36    0.70   1.00    0
assign ( resid 40 and name C ) ( resid 40  and name CA ) 2.40    0.91   1.00    0
assign ( resid 42 and name C ) ( resid 42  and name CA ) -2.67    0.76   1.00    0
assign ( resid 43 and name C ) ( resid 43  and name CA ) 2.65    0.96   1.00    0
assign ( resid 47 and name C ) ( resid 47  and name CA ) 2.72    1.04   1.00    0
assign ( resid 48 and name C ) ( resid 48  and name CA ) -3.71    0.56   1.00    0
assign ( resid 49 and name C ) ( resid 49  and name CA ) 2.19    0.57   1.00    0
assign ( resid 51 and name C ) ( resid 51  and name CA ) -4.17    0.82   1.00    0
assign ( resid 52 and name C ) ( resid 52  and name CA ) 2.84    0.50   1.00    0
assign ( resid 53 and name C ) ( resid 53  and name CA ) 2.00    0.57   1.00    0
assign ( resid 54 and name C ) ( resid 54  and name CA ) -0.23    0.84   1.00    0
assign ( resid 55 and name C ) ( resid 55  and name CA ) -0.27    0.55   1.00    0
assign ( resid 56 and name C ) ( resid 56  and name CA ) 1.84    0.64   1.00    0
assign ( resid 57 and name C ) ( resid 57  and name CA ) 0.45    1.12   1.00    0
assign ( resid 58 and name C ) ( resid 58  and name CA ) -2.74    0.86   1.00    0
assign ( resid 59 and name C ) ( resid 59  and name CA ) 1.75    0.82   1.00    0
assign ( resid 61 and name C ) ( resid 61  and name CA ) 0.19    0.92   1.00    0
assign ( resid 64 and name C ) ( resid 64  and name CA ) -0.88    1.12   1.00    0
assign ( resid 65 and name C ) ( resid 65  and name CA ) 2.04    1.13   1.00    0
assign ( resid 71 and name C ) ( resid 71  and name CA ) 1.44    0.95   1.00    0
assign ( resid   3 and name    C ) ( resid   3 and name   HN )  -1.54   0.74   1.00 0
assign ( resid   4 and name    C ) ( resid   4 and name   HN )  -0.83   0.60   1.00 0
assign ( resid   5 and name    C ) ( resid   5 and name   HN )  -4.96   0.60   1.00 0
assign ( resid   6 and name    C ) ( resid   6 and name   HN )  -2.50   0.60   1.00 0
assign ( resid   8 and name    C ) ( resid   8 and name   HN )   1.11   0.60   1.00 0
assign ( resid   9 and name    C ) ( resid   9 and name   HN )  -6.75   1.24   1.00 0
assign ( resid  11 and name    C ) ( resid  11 and name   HN )   6.35   0.60   1.00 0
assign ( resid  12 and name    C ) ( resid  12 and name   HN )  -0.73   0.60   1.00 0
assign ( resid  13 and name    C ) ( resid  13 and name   HN )   2.91   0.60   1.00 0
assign ( resid  14 and name    C ) ( resid  14 and name   HN )  -1.97   0.60   1.00 0
assign ( resid  16 and name    C ) ( resid  16 and name   HN )  -3.96   0.60   1.00 0
assign ( resid  17 and name    C ) ( resid  17 and name   HN )   5.76   0.60   1.00 0
assign ( resid  28 and name    C ) ( resid  28 and name   HN )  -3.99   0.60   1.00 0
assign ( resid  29 and name    C ) ( resid  29 and name   HN )  -4.05   0.60   1.00 0
assign ( resid  31 and name    C ) ( resid  31 and name   HN )   4.50   0.60   1.00 0
assign ( resid  32 and name    C ) ( resid  32 and name   HN )  -0.09   0.60   1.00 0
assign ( resid  34 and name    C ) ( resid  34 and name   HN )  -2.65   0.60   1.00 0
assign ( resid  36 and name    C ) ( resid  36 and name   HN )   7.30   0.60   1.00 0
assign ( resid  37 and name    C ) ( resid  37 and name   HN )   0.64   0.60   1.00 0
assign ( resid  39 and name    C ) ( resid  39 and name   HN )   7.57   0.60   1.00 0
assign ( resid  40 and name    C ) ( resid  40 and name   HN )  -5.38   0.60   1.00 0
assign ( resid  43 and name    C ) ( resid  43 and name   HN )  -4.30   0.60   1.00 0
assign ( resid  44 and name    C ) ( resid  44 and name   HN )  13.50   0.60   1.00 0
assign ( resid  45 and name    C ) ( resid  45 and name   HN )   1.10   1.40   1.00 0
assign ( resid  46 and name    C ) ( resid  46 and name   HN )  -0.32   0.60   1.00 0
assign ( resid  47 and name    C ) ( resid  47 and name   HN )   1.71   0.90   1.00 0
assign ( resid  48 and name    C ) ( resid  48 and name   HN )   8.22   0.60   1.00 0
assign ( resid  49 and name    C ) ( resid  49 and name   HN )  -2.53   0.60   1.00 0
assign ( resid  50 and name    C ) ( resid  50 and name   HN )   1.68   0.60   1.00 0
assign ( resid  51 and name    C ) ( resid  51 and name   HN )   3.39   0.60   1.00 0
assign ( resid  52 and name    C ) ( resid  52 and name   HN )  -0.48   0.60   1.00 0
assign ( resid  53 and name    C ) ( resid  53 and name   HN )  -1.78   0.60   1.00 0
assign ( resid  54 and name    C ) ( resid  54 and name   HN )  -0.06   0.60   1.00 0
assign ( resid  55 and name    C ) ( resid  55 and name   HN )   1.53   0.60   1.00 0
assign ( resid  56 and name    C ) ( resid  56 and name   HN )  -1.78   0.60   1.00 0
assign ( resid  57 and name    C ) ( resid  57 and name   HN )  -3.83   0.60   1.00 0
assign ( resid  58 and name    C ) ( resid  58 and name   HN )  -1.13   0.60   1.00 0
assign ( resid  59 and name    C ) ( resid  59 and name   HN )   1.68   0.60   1.00 0
assign ( resid  60 and name    C ) ( resid  60 and name   HN )   1.09   0.60   1.00 0
assign ( resid  61 and name    C ) ( resid  61 and name   HN )  -1.09   0.90   1.00 0
assign ( resid  62 and name    C ) ( resid  62 and name   HN )  -0.54   0.60   1.00 0
assign ( resid  65 and name    C ) ( resid  65 and name   HN )  -2.53   0.60   1.00 0
assign ( resid  66 and name    C ) ( resid  66 and name   HN )  -3.68   0.64   1.00 0
assign ( resid  68 and name    C ) ( resid  68 and name   HN )   0.07   0.60   1.00 0
assign ( resid  69 and name    C ) ( resid  69 and name   HN )  -4.00   0.60   1.00 0
assign ( resid  70 and name    C ) ( resid  70 and name   HN )   9.13   1.07   1.00 0
assign ( resid  71 and name    C ) ( resid  71 and name   HN )  -1.27   1.14   1.00 0
assign  ((resid 3 and name HG2*   )) ((resid 3 and name HG1*   ))   5.99 5.99  0.00 
assign  ((resid 3 and name HG1*   )) ((resid 6 and name HD1*   ))   7.21 7.21  0.00 
assign  ((resid 6 and name HD1*   )) ((resid 6 and name HD2*   ))   6.04 6.04  0.00 
assign  ((resid 20 and name HD1*   )) ((resid 20 and name HD2*   ))   6.00 6.00  0.00 
assign  ((resid 23 and name HD2*   )) ((resid 23 and name HD1*   ))   5.98 5.98  0.00 
assign  ((resid 23 and name HG   )) ((resid 23 and name HD1*   ))   5.81 5.81  0.00 
assign  ((resid 23 and name HD2*   )) ((resid 23 and name HG   ))   4.84 4.84  0.00 
assign  ((resid 23 and name HD1*   )) ((resid 25 and name HD1*   ))   8.02 8.02  0.00 
assign  ((resid 23 and name HD2*   )) ((resid 25 and name HD1*   ))   7.47 7.47  0.00 
assign  ((resid 23 and name HG   )) ((resid 25 and name HD1*   ))   5.75 5.75  0.00 
assign  ((resid 23 and name HD1*   )) ((resid 25 and name HG2*   ))   7.33 7.33  0.00 
assign  ((resid 23 and name HD2*   )) ((resid 25 and name HG2*   ))   7.53 7.53  0.00 
assign  ((resid 23 and name HG   )) ((resid 25 and name HG2*   ))   5.45 5.45  0.00 
assign  ((resid 25 and name HG2*   )) ((resid 25 and name HD1*   ))   6.53 6.53  0.00 
assign  ((resid 3 and name HG1*   )) ((resid 27 and name HD1*   ))   7.53 7.53  0.00 
assign  ((resid 3 and name HG2*   )) ((resid 27 and name HD1*   ))   8.04 8.04  0.00 
assign  ((resid 27 and name HD2*   )) ((resid 27 and name HD1*   ))   5.95 5.95  0.00 
assign  ((resid 27 and name HG   )) ((resid 27 and name HD1*   ))   5.76 5.76  0.00 
assign  ((resid 27 and name HG   )) ((resid 27 and name HD2*   ))   5.83 5.83  0.00 
assign  ((resid 25 and name HD1*   )) ((resid 30 and name HD2*   ))   6.58 6.58  0.00 
assign  ((resid 25 and name HG2*   )) ((resid 30 and name HD2*   ))   7.88 7.88  0.00 
assign  ((resid 27 and name HD1*   )) ((resid 30 and name HD2*   ))   6.96 6.96  0.00 
assign  ((resid 30 and name HD2*   )) ((resid 30 and name HD1*   ))   4.38 4.38  0.00 
assign  ((resid 30 and name HD2*   )) ((resid 30 and name HG   ))   4.70 4.70  0.00 
assign  ((resid 38 and name HD1*   )) ((resid 38 and name HG11   ))   4.84 4.84  0.00 
assign  ((resid 38 and name HG2*   )) ((resid 38 and name HD1*   ))   6.24 6.24  0.00 
assign  ((resid 38 and name HG2*   )) ((resid 38 and name HG11   ))   5.01 5.01  0.00 
assign  ((resid 40 and name HG1*   )) ((resid 40 and name HG2*   ))   5.96 5.96  0.00 
assign  ((resid 3 and name HG1*   )) ((resid 51 and name HB*   ))   6.81 6.81  0.00 
assign  ((resid 3 and name HG2*   )) ((resid 51 and name HB*   ))   6.86 6.86  0.00 
assign  ((resid 27 and name HD1*   )) ((resid 51 and name HB*   ))   7.02 7.02  0.00 
assign  ((resid 27 and name HD2*   )) ((resid 51 and name HB*   ))   6.61 6.61  0.00 
assign  ((resid 25 and name HG2*   )) ((resid 52 and name HD1*   ))   6.62 6.62  0.00 
assign  ((resid 27 and name HD2*   )) ((resid 52 and name HD1*   ))   6.78 6.78  0.00 
assign  ((resid 27 and name HG   )) ((resid 52 and name HD1*   ))   5.40 5.40  0.00 
assign  ((resid 52 and name HG2*   )) ((resid 52 and name HD1*   ))   5.83 5.83  0.00 
assign  ((resid 53 and name HD1*   )) ((resid 53 and name HD2*   ))   6.35 6.35  0.00 
assign  ((resid 40 and name HG2*   )) ((resid 54 and name HD1*   ))   7.27 7.27  0.00 
assign  ((resid 40 and name HG2*   )) ((resid 54 and name HD2*   ))   7.31 7.31  0.00 
assign  ((resid 54 and name HD2*   )) ((resid 54 and name HD1*   ))   5.96 5.96  0.00 
assign  ((resid 25 and name HD1*   )) ((resid 56 and name HD2*   ))   7.01 7.01  0.00 
assign  ((resid 30 and name HG   )) ((resid 56 and name HD2*   ))   5.86 5.86  0.00 
assign  ((resid 52 and name HG2*   )) ((resid 56 and name HD1*   ))   7.06 7.06  0.00 
assign  ((resid 56 and name HD2*   )) ((resid 56 and name HD1*   ))   6.07 6.07  0.00 
assign  ((resid 25 and name HD1*   )) ((resid 61 and name HD1*   ))   7.08 7.08  0.00 
assign  ((resid 30 and name HD2*   )) ((resid 61 and name HD1*   ))   6.54 6.54  0.00 
assign  ((resid 56 and name HD2*   )) ((resid 61 and name HD1*   ))   6.42 6.42  0.00 
assign  ((resid 56 and name HD2*   )) ((resid 61 and name HG   ))   7.02 7.02  0.00 
assign  ((resid 61 and name HD2*   )) ((resid 61 and name HD1*   ))   5.92 5.92  0.00 
assign  ((resid 61 and name HG   )) ((resid 61 and name HD1*   ))   6.69 6.69  0.00 
assign  ((resid 61 and name HD2*   )) ((resid 61 and name HG   ))   4.88 4.88  0.00 
assign  ((resid 23 and name HD1*   )) ((resid 65 and name HB*   ))   7.32 7.32  0.00 
assign  ((resid 56 and name HD1*   )) ((resid 65 and name HB*   ))   7.21 7.21  0.00 
assign  ((resid 56 and name HD2*   )) ((resid 65 and name HB*   ))   7.53 7.53  0.00 
assign  ((resid 67 and name HG2*   )) ((resid 67 and name HG1*   ))   4.24 4.24  0.00 
assign  ((resid 67 and name HG1*   )) ((resid 68 and name HG2   ))   6.53 6.53  0.00 
assign  ((resid 53 and name HD2*   )) ((resid 71 and name HD1*   ))   7.61 7.61  0.00 
assign  ((resid 65 and name HB*   )) ((resid 71 and name HD1*   ))   7.49 7.49  0.00 
assign  ((resid 65 and name HB*   )) ((resid 71 and name HD2*   ))   8.04 8.04  0.00 
assign  ((resid 67 and name HG1*   )) ((resid 71 and name HD2*   ))   7.61 7.61  0.00 
assign  ((resid 72 and name HD2*   )) ((resid 72 and name HD1*   ))   6.18 6.18  0.00 
assign ( resid   2 and name    N ) ( resid   2 and name   HN )   9.69   1.45   1.00 0
assign ( resid   3 and name    N ) ( resid   3 and name   HN )  10.70   2.40   1.00 0
assign ( resid   4 and name    N ) ( resid   4 and name   HN )  -6.18   1.39   1.00 0
assign ( resid   5 and name    N ) ( resid   5 and name   HN )   8.60   1.30   1.00 0
assign ( resid   6 and name    N ) ( resid   6 and name   HN )  13.27   1.17   1.00 0
assign ( resid   8 and name    N ) ( resid   8 and name   HN ) -13.09   1.97   1.00 0
assign ( resid  11 and name    N ) ( resid  11 and name   HN )   9.25   3.96   1.00 0
assign ( resid  12 and name    N ) ( resid  12 and name   HN )   6.39   2.30   1.00 0
assign ( resid  13 and name    N ) ( resid  13 and name   HN )   8.90   1.25   1.00 0
assign ( resid  14 and name    N ) ( resid  14 and name   HN )   7.85   1.49   1.00 0
assign ( resid  16 and name    N ) ( resid  16 and name   HN )  10.79   1.56   1.00 0
assign ( resid  17 and name    N ) ( resid  17 and name   HN )  -4.49   2.19   1.00 0
assign ( resid  21 and name    N ) ( resid  21 and name   HN )  10.16   1.11   1.00 0
assign ( resid  26 and name    N ) ( resid  26 and name   HN )   9.25   1.80   1.00 0
assign ( resid  28 and name    N ) ( resid  28 and name   HN )  12.20   1.21   1.00 0
assign ( resid  29 and name    N ) ( resid  29 and name   HN )  10.44   1.65   1.00 0
assign ( resid  31 and name    N ) ( resid  31 and name   HN )  13.31   1.07   1.00 0
assign ( resid  32 and name    N ) ( resid  32 and name   HN )   8.75   1.31   1.00 0
assign ( resid  34 and name    N ) ( resid  34 and name   HN )  -2.81   5.14   1.00 0
assign ( resid  38 and name    N ) ( resid  38 and name   HN )  -0.24   1.14   1.00 0
assign ( resid  40 and name    N ) ( resid  40 and name   HN )   9.84   1.08   1.00 0
assign ( resid  41 and name    N ) ( resid  41 and name   HN ) -14.78   1.27   1.00 0
assign ( resid  43 and name    N ) ( resid  43 and name   HN )  -6.00   1.00   1.00 0
assign ( resid  44 and name    N ) ( resid  44 and name   HN )  -3.80   2.87   1.00 0
assign ( resid  45 and name    N ) ( resid  45 and name   HN )  11.74   1.53   1.00 0
assign ( resid  46 and name    N ) ( resid  46 and name   HN )   8.52   1.01   1.00 0
assign ( resid  47 and name    N ) ( resid  47 and name   HN )   1.40   1.07   1.00 0
assign ( resid  48 and name    N ) ( resid  48 and name   HN )   7.98   3.08   1.00 0
assign ( resid  49 and name    N ) ( resid  49 and name   HN )   9.06   1.01   1.00 0
assign ( resid  50 and name    N ) ( resid  50 and name   HN )  -2.75   1.08   1.00 0
assign ( resid  53 and name    N ) ( resid  53 and name   HN )   5.37   1.04   1.00 0
assign ( resid  54 and name    N ) ( resid  54 and name   HN )  -1.29   1.01   1.00 0
assign ( resid  56 and name    N ) ( resid  56 and name   HN )  10.52   1.38   1.00 0
assign ( resid  59 and name    N ) ( resid  59 and name   HN )  10.35   1.35   1.00 0
assign ( resid  61 and name    N ) ( resid  61 and name   HN ) -20.70   2.00   1.00 0
assign ( resid  62 and name    N ) ( resid  62 and name   HN )  -3.66   2.30   1.00 0
assign ( resid  65 and name    N ) ( resid  65 and name   HN )  -3.09   2.16   1.00 0
assign ( resid  67 and name    N ) ( resid  67 and name   HN )   9.70   4.31   1.00 0
assign ( resid  68 and name    N ) ( resid  68 and name   HN )  -0.13   5.75   1.00 0
assign ( resid  70 and name    N ) ( resid  70 and name   HN )  11.24   2.61   1.00 0
!!
  !!W-4
 assign (resid 3 and name c)   (resid 4 and name n)
        (resid 4 and name ca)   (resid 4 and name c)  1.0  -62.6   30.0   2
 assign (resid 4 and name n)   (resid 4 and name ca)
        (resid 4 and name c)   (resid 5 and name n)  1.0  -40.4   30.0   2
  !!S-5
 assign (resid 4 and name c)   (resid 5 and name n)
        (resid 5 and name ca)   (resid 5 and name c)  1.0  -62.3   30.0   2
 assign (resid 5 and name n)   (resid 5 and name ca)
        (resid 5 and name c)   (resid 6 and name n)  1.0  -34.5   30.0   2
  !!M-11
 assign (resid 10 and name c)   (resid 11 and name n)
        (resid 11 and name ca)   (resid 11 and name c)  1.0 -128.8   30.0   2
 assign (resid 11 and name n)   (resid 11 and name ca)
        (resid 11 and name c)   (resid 12 and name n)  1.0  147.3   30.0   2
  !!T-12
 assign (resid 11 and name c)   (resid 12 and name n)
        (resid 12 and name ca)   (resid 12 and name c)  1.0 -117.9   30.0   2
 assign (resid 12 and name n)   (resid 12 and name ca)
        (resid 12 and name c)   (resid 13 and name n)  1.0  137.8   30.0   2
  !!F-13
 assign (resid 12 and name c)   (resid 13 and name n)
        (resid 13 and name ca)   (resid 13 and name c)  1.0 -125.1   30.0   2
 assign (resid 13 and name n)   (resid 13 and name ca)
        (resid 13 and name c)   (resid 14 and name n)  1.0  131.5   30.0   2
  !!Q-14
 assign (resid 13 and name c)   (resid 14 and name n)
        (resid 14 and name ca)   (resid 14 and name c)  1.0  -98.7   30.0   2
 assign (resid 14 and name n)   (resid 14 and name ca)
        (resid 14 and name c)   (resid 15 and name n)  1.0  130.5   30.0   2
  !!P-15
 assign (resid 14 and name c)   (resid 15 and name n)
        (resid 15 and name ca)   (resid 15 and name c)  1.0  -62.5   30.0   2
 assign (resid 15 and name n)   (resid 15 and name ca)
        (resid 15 and name c)   (resid 16 and name n)  1.0  149.0   30.0   2
  !!K-16
 assign (resid 15 and name c)   (resid 16 and name n)
        (resid 16 and name ca)   (resid 16 and name c)  1.0  -71.5   30.0   2
 assign (resid 16 and name n)   (resid 16 and name ca)
        (resid 16 and name c)   (resid 17 and name n)  1.0  -27.9   30.0   2
  !!S-19
 assign (resid 18 and name c)   (resid 19 and name n)
        (resid 19 and name ca)   (resid 19 and name c)  1.0  -71.3   30.0   2
 assign (resid 19 and name n)   (resid 19 and name ca)
        (resid 19 and name c)   (resid 20 and name n)  1.0  -30.6   30.0   2
  !!L-20
 assign (resid 19 and name c)   (resid 20 and name n)
        (resid 20 and name ca)   (resid 20 and name c)  1.0  -96.8   30.0   2
 assign (resid 20 and name n)   (resid 20 and name ca)
        (resid 20 and name c)   (resid 21 and name n)  1.0  146.1   30.0   2
  !!Q-21
 assign (resid 20 and name c)   (resid 21 and name n)
        (resid 21 and name ca)   (resid 21 and name c)  1.0  -89.2   30.0   2
 assign (resid 21 and name n)   (resid 21 and name ca)
        (resid 21 and name c)   (resid 22 and name n)  1.0  130.1   30.0   2
  !!I-25
 assign (resid 24 and name c)   (resid 25 and name n)
        (resid 25 and name ca)   (resid 25 and name c)  1.0 -131.0   30.0   2
 assign (resid 25 and name n)   (resid 25 and name ca)
        (resid 25 and name c)   (resid 26 and name n)  1.0  152.3   30.0   2
  !!S-26
 assign (resid 25 and name c)   (resid 26 and name n)
        (resid 26 and name ca)   (resid 26 and name c)  1.0 -109.5   30.0   2
 assign (resid 26 and name n)   (resid 26 and name ca)
        (resid 26 and name c)   (resid 27 and name n)  1.0  153.9   30.0   2
  !!L-27
 assign (resid 26 and name c)   (resid 27 and name n)
        (resid 27 and name ca)   (resid 27 and name c)  1.0  -64.7   30.0   2
 assign (resid 27 and name n)   (resid 27 and name ca)
        (resid 27 and name c)   (resid 28 and name n)  1.0  -35.4   30.0   2
  !!D-28
 assign (resid 27 and name c)   (resid 28 and name n)
        (resid 28 and name ca)   (resid 28 and name c)  1.0  -75.2   30.0   2
 assign (resid 28 and name n)   (resid 28 and name ca)
        (resid 28 and name c)   (resid 29 and name n)  1.0  -31.3   30.0   2
  !!F-31
 assign (resid 30 and name c)   (resid 31 and name n)
        (resid 31 and name ca)   (resid 31 and name c)  1.0 -124.0   30.0   2
 assign (resid 31 and name n)   (resid 31 and name ca)
        (resid 31 and name c)   (resid 32 and name n)  1.0  152.7   30.0   2
  !!E-36
 assign (resid 35 and name c)   (resid 36 and name n)
        (resid 36 and name ca)   (resid 36 and name c)  1.0  -63.7   30.0   2
 assign (resid 36 and name n)   (resid 36 and name ca)
        (resid 36 and name c)   (resid 37 and name n)  1.0  -45.7   30.0   2
  !!F-37
 assign (resid 36 and name c)   (resid 37 and name n)
        (resid 37 and name ca)   (resid 37 and name c)  1.0  -62.9   30.0   2
 assign (resid 37 and name n)   (resid 37 and name ca)
        (resid 37 and name c)   (resid 38 and name n)  1.0  -46.3   30.0   2
  !!I-38
 assign (resid 37 and name c)   (resid 38 and name n)
        (resid 38 and name ca)   (resid 38 and name c)  1.0  -64.7   30.0   2
 assign (resid 38 and name n)   (resid 38 and name ca)
        (resid 38 and name c)   (resid 39 and name n)  1.0  -37.3   30.0   2
  !!S-39
 assign (resid 38 and name c)   (resid 39 and name n)
        (resid 39 and name ca)   (resid 39 and name c)  1.0  -64.2   30.0   2
 assign (resid 39 and name n)   (resid 39 and name ca)
        (resid 39 and name c)   (resid 40 and name n)  1.0  -35.6   30.0   2
  !!K-49
 assign (resid 48 and name c)   (resid 49 and name n)
        (resid 49 and name ca)   (resid 49 and name c)  1.0  -62.8   30.0   2
 assign (resid 49 and name n)   (resid 49 and name ca)
        (resid 49 and name c)   (resid 50 and name n)  1.0  -42.0   30.0   2
  !!E-50
 assign (resid 49 and name c)   (resid 50 and name n)
        (resid 50 and name ca)   (resid 50 and name c)  1.0  -65.4   30.0   2
 assign (resid 50 and name n)   (resid 50 and name ca)
        (resid 50 and name c)   (resid 51 and name n)  1.0  -39.6   30.0   2
  !!A-51
 assign (resid 50 and name c)   (resid 51 and name n)
        (resid 51 and name ca)   (resid 51 and name c)  1.0  -66.5   30.0   2
 assign (resid 51 and name n)   (resid 51 and name ca)
        (resid 51 and name c)   (resid 52 and name n)  1.0  -40.1   30.0   2
  !!I-52
 assign (resid 51 and name c)   (resid 52 and name n)
        (resid 52 and name ca)   (resid 52 and name c)  1.0  -67.2   30.0   2
 assign (resid 52 and name n)   (resid 52 and name ca)
        (resid 52 and name c)   (resid 53 and name n)  1.0  -38.4   30.0   2
  !!L-53
 assign (resid 52 and name c)   (resid 53 and name n)
        (resid 53 and name ca)   (resid 53 and name c)  1.0  -62.0   30.0   2
 assign (resid 53 and name n)   (resid 53 and name ca)
        (resid 53 and name c)   (resid 54 and name n)  1.0  -39.3   30.0   2
  !!L-54
 assign (resid 53 and name c)   (resid 54 and name n)
        (resid 54 and name ca)   (resid 54 and name c)  1.0  -64.7   30.0   2
 assign (resid 54 and name n)   (resid 54 and name ca)
        (resid 54 and name c)   (resid 55 and name n)  1.0  -41.3   30.0   2
  !!G-55
 assign (resid 54 and name c)   (resid 55 and name n)
        (resid 55 and name ca)   (resid 55 and name c)  1.0  -61.4   30.0   2
 assign (resid 55 and name n)   (resid 55 and name ca)
        (resid 55 and name c)   (resid 56 and name n)  1.0  -43.2   30.0   2
  !!L-56
 assign (resid 55 and name c)   (resid 56 and name n)
        (resid 56 and name ca)   (resid 56 and name c)  1.0  -64.2   30.0   2
 assign (resid 56 and name n)   (resid 56 and name ca)
        (resid 56 and name c)   (resid 57 and name n)  1.0  -41.4   30.0   2
  !!R-57
 assign (resid 56 and name c)   (resid 57 and name n)
        (resid 57 and name ca)   (resid 57 and name c)  1.0  -65.3   30.0   2
 assign (resid 57 and name n)   (resid 57 and name ca)
        (resid 57 and name c)   (resid 58 and name n)  1.0  -40.4   30.0   2
  !!Y-58
 assign (resid 57 and name c)   (resid 58 and name n)
        (resid 58 and name ca)   (resid 58 and name c)  1.0  -70.1   30.0   2
 assign (resid 58 and name n)   (resid 58 and name ca)
        (resid 58 and name c)   (resid 59 and name n)  1.0  -35.2   30.0   2
  !!N-63
 assign (resid 62 and name c)   (resid 63 and name n)
        (resid 63 and name ca)   (resid 63 and name c)  1.0  -59.4   30.0   2
 assign (resid 63 and name n)   (resid 63 and name ca)
        (resid 63 and name c)   (resid 64 and name n)  1.0  -40.7   30.0   2
  !!Q-64
 assign (resid 63 and name c)   (resid 64 and name n)
        (resid 64 and name ca)   (resid 64 and name c)  1.0  -65.0   30.0   2
 assign (resid 64 and name n)   (resid 64 and name ca)
        (resid 64 and name c)   (resid 65 and name n)  1.0  -36.3   30.0   2
  !!A-65
 assign (resid 64 and name c)   (resid 65 and name n)
        (resid 65 and name ca)   (resid 65 and name c)  1.0  -64.0   30.0   2
 assign (resid 65 and name n)   (resid 65 and name ca)
        (resid 65 and name c)   (resid 66 and name n)  1.0  -37.5   30.0   2
  !!R-66
 assign (resid 65 and name c)   (resid 66 and name n)
         (resid 66 and name ca)   (resid 66 and name c)  1.0  -63.1   30.0   2
 assign (resid 66 and name n)   (resid 66 and name ca)
        (resid 66 and name c)   (resid 67 and name n)  1.0  -37.2   30.0   2
end

set message=on echo=on end
! Distance constraint file from ATNOS/CANDID
! ATNOS/CANDID version 1.1  
! File format   : cns
! File generated: 2008 April  2th, 18:07:51

assign  ((resid   27 and name HN   )) ((resid   27 and name HG   ))   5.50  3.70  0.00 ! #SUP  4.68
assign  ((resid   60 and name HN   )) ((resid   62 and name HN   ))   5.01  3.21  0.00 ! #SUP  2.64
assign  ((resid   58 and name HA   )) ((resid   60 and name HN   ))   5.13  3.33  0.00 ! #SUP  2.07
assign  ((resid   59 and name HB2  )) ((resid   60 and name HN   ))   5.50  3.70  0.00 ! #SUP  9.91
assign  ((resid   60 and name HN   )) ((resid   60 and name HD2  ))   5.50  3.70  0.00 ! #SUP  7.90
assign  ((resid   59 and name HB1  )) ((resid   60 and name HN   ))   4.83  3.03  0.00 ! #SUP  7.95
assign  ((resid   60 and name HN   )) ((resid   60 and name HG2  ))   3.83  2.03  0.00 ! #SUP  8.14
assign  ((resid   39 and name HB2  )) ((resid   40 and name HN   ))   3.75  1.95  0.00 ! #SUP  5.39
assign  ((resid   37 and name HA   )) ((resid   40 and name HN   ))   4.78  2.98  0.00 ! #SUP  4.57
assign  ((resid   38 and name HA   )) ((resid   40 and name HN   ))   5.26  3.46  0.00 ! #SUP  4.97
assign  ((resid   40 and name HN   )) ((resid   40 and name HB   ))   3.73  1.93  0.00 ! #SUP  5.27
assign  ((resid   38 and name HG2* )) ((resid   40 and name HN   ))   5.39  3.59  0.00 ! #SUP  6.57
assign  ((resid   40 and name HN   )) ((resid   40 and name HG1* ))   3.59  1.79  0.00 ! #SUP  6.44
assign  ((resid   40 and name HN   )) ((resid   40 and name HG2* ))   3.23  1.43  0.00 ! #SUP  6.07
assign  ((resid    4 and name HN   )) ((resid    6 and name HN   ))   5.04  3.24  0.00 ! #SUP  2.20
assign  ((resid    5 and name HB2  )) ((resid    6 and name HN   ))   4.01  2.21  0.00 ! #SUP  5.28
assign  ((resid    6 and name HN   )) ((resid    7 and name HB2  ))   5.50  3.70  0.00 ! #SUP  2.73
assign  ((resid    6 and name HN   )) ((resid    6 and name HB2  ))   2.98  1.18  0.00 ! #SUP  6.50
assign  ((resid    6 and name HN   )) ((resid   27 and name HD1* ))   5.18  3.38  0.00 ! #SUP  1.56
assign  ((resid    5 and name HN   )) ((resid    6 and name HN   ))   3.37  1.57  0.00 ! #SUP  6.86
assign  ((resid    5 and name HB1  )) ((resid    6 and name HN   ))   4.52  2.72  0.00 ! #SUP  5.89
assign  ((resid    6 and name HN   )) ((resid    6 and name HB1  ))   3.64  1.84  0.00 ! #SUP  5.52
assign  ((resid    6 and name HN   )) ((resid    6 and name HD1* ))   3.98  2.18  0.00 ! #SUP  5.67
assign  ((resid   43 and name HA   )) ((resid   44 and name HN   ))   3.65  1.85  0.00 ! #SUP  4.96
assign  ((resid    3 and name HG2* )) ((resid   44 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.25
assign  ((resid   43 and name HB1  )) ((resid   44 and name HN   ))   5.24  3.44  0.00 ! #SUP  5.24
assign  ((resid   43 and name HB2  )) ((resid   44 and name HN   ))   5.42  3.62  0.00 ! #SUP  5.70
assign  ((resid    3 and name HB   )) ((resid    4 and name HN   ))   5.41  3.61  0.00 ! #SUP  4.86
assign  ((resid    4 and name HN   )) ((resid   27 and name HD1* ))   5.50  3.70  0.00 ! #SUP  1.73
assign  ((resid    3 and name HN   )) ((resid    4 and name HN   ))   4.19  2.39  0.00 ! #SUP  6.88
assign  ((resid    2 and name HA   )) ((resid    4 and name HN   ))   4.47  2.67  0.00 ! #SUP  4.14
assign  ((resid    4 and name HN   )) ((resid    4 and name HB1  ))   3.68  1.88  0.00 ! #SUP  5.71
assign  ((resid    4 and name HN   )) ((resid    4 and name HB2  ))   3.53  1.73  0.00 ! #SUP  5.01
assign  ((resid    2 and name HB1  )) ((resid    4 and name HN   ))   4.97  3.17  0.00 ! #SUP  4.23
assign  ((resid    3 and name HG2* )) ((resid    4 and name HN   ))   3.94  2.14  0.00 ! #SUP  6.55
assign  ((resid   54 and name HN   )) ((resid   56 and name HN   ))   5.01  3.21  0.00 ! #SUP  3.55
assign  ((resid   56 and name HN   )) ((resid   56 and name HB2  ))   3.77  1.97  0.00 ! #SUP  6.62
assign  ((resid   56 and name HN   )) ((resid   56 and name HB1  ))   4.16  2.36  0.00 ! #SUP  6.18
assign  ((resid   52 and name HG2* )) ((resid   56 and name HN   ))   5.06  3.26  0.00 ! #SUP  3.23
assign  ((resid   56 and name HN   )) ((resid   56 and name HD2* ))   4.60  2.80  0.00 ! #SUP  5.45
assign  ((resid   35 and name HN   )) ((resid   37 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.26
assign  ((resid   53 and name HA   )) ((resid   56 and name HN   ))   4.12  2.32  0.00 ! #SUP  5.72
assign  ((resid   56 and name HN   )) ((resid   56 and name HD1* ))   4.68  2.88  0.00 ! #SUP  6.06
assign  ((resid   33 and name HA   )) ((resid   35 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.18
assign  ((resid   33 and name HB2  )) ((resid   35 and name HN   ))   5.48  3.68  0.00 ! #SUP  3.39
assign  ((resid   34 and name HB1  )) ((resid   35 and name HN   ))   5.50  3.70  0.00 ! #SUP  5.12
assign  ((resid   57 and name HA   )) ((resid   62 and name HN   ))   4.24  2.44  0.00 ! #SUP  3.11
assign  ((resid   62 and name HN   )) ((resid   62 and name HB2  ))   3.90  2.10  0.00 ! #SUP  4.02
assign  ((resid   62 and name HN   )) ((resid   62 and name HB1  ))   4.03  2.23  0.00 ! #SUP  3.70
assign  ((resid   56 and name HB1  )) ((resid   62 and name HN   ))   4.81  3.01  0.00 ! #SUP  5.49
assign  ((resid   61 and name HD1* )) ((resid   62 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.84
assign  ((resid   56 and name HA   )) ((resid   62 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.88
assign  ((resid   57 and name HN   )) ((resid   57 and name HG2  ))   3.98  2.18  0.00 ! #SUP  6.57
assign  ((resid   56 and name HB2  )) ((resid   57 and name HN   ))   4.18  2.38  0.00 ! #SUP  6.64
assign  ((resid   56 and name HD1* )) ((resid   57 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.18
assign  ((resid   52 and name HD1* )) ((resid   54 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.15
assign  ((resid   56 and name HN   )) ((resid   57 and name HN   ))   3.57  1.77  0.00 ! #SUP  6.71
assign  ((resid   57 and name HN   )) ((resid   57 and name HD1  ))   4.69  2.89  0.00 ! #SUP  5.74
assign  ((resid   56 and name HB1  )) ((resid   57 and name HN   ))   4.01  2.21  0.00 ! #SUP  6.12
assign  ((resid   53 and name HN   )) ((resid   54 and name HN   ))   3.41  1.61  0.00 ! #SUP  9.66
assign  ((resid   51 and name HA   )) ((resid   54 and name HN   ))   3.95  2.15  0.00 ! #SUP  3.59
assign  ((resid   52 and name HA   )) ((resid   54 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.15
assign  ((resid   54 and name HN   )) ((resid   54 and name HB1  ))   3.18  1.38  0.00 ! #SUP  7.54
assign  ((resid   53 and name HB2  )) ((resid   54 and name HN   ))   3.97  2.17  0.00 ! #SUP  9.24
assign  ((resid   54 and name HN   )) ((resid   54 and name HB2  ))   3.55  1.75  0.00 ! #SUP  7.48
assign  ((resid   53 and name HB1  )) ((resid   54 and name HN   ))   4.00  2.20  0.00 ! #SUP  7.52
assign  ((resid   54 and name HN   )) ((resid   54 and name HD2* ))   4.62  2.82  0.00 ! #SUP  7.66
assign  ((resid   52 and name HG2* )) ((resid   54 and name HN   ))   5.07  3.27  0.00 ! #SUP  7.66
assign  ((resid   54 and name HN   )) ((resid   54 and name HD1* ))   4.57  2.77  0.00 ! #SUP  9.07
assign  ((resid   44 and name HN   )) ((resid   46 and name HN   ))   5.10  3.30  0.00 ! #SUP  1.59
assign  ((resid    2 and name HA   )) ((resid   46 and name HN   ))   4.50  2.70  0.00 ! #SUP  3.09
assign  ((resid    3 and name HB   )) ((resid   46 and name HN   ))   3.85  2.05  0.00 ! #SUP  4.34
assign  ((resid   46 and name HN   )) ((resid   46 and name HB1  ))   3.70  1.90  0.00 ! #SUP  4.51
assign  ((resid   46 and name HN   )) ((resid   46 and name HB2  ))   3.20  1.40  0.00 ! #SUP  5.37
assign  ((resid   45 and name HB1  )) ((resid   46 and name HN   ))   4.27  2.47  0.00 ! #SUP  5.09
assign  ((resid   45 and name HG1  )) ((resid   46 and name HN   ))   4.63  2.83  0.00 ! #SUP  5.48
assign  ((resid    3 and name HG2* )) ((resid   46 and name HN   ))   4.37  2.57  0.00 ! #SUP  6.06
assign  ((resid   45 and name HB2  )) ((resid   46 and name HN   ))   4.78  2.98  0.00 ! #SUP  5.61
assign  ((resid   52 and name HG2* )) ((resid   53 and name HN   ))   3.78  1.98  0.00 ! #SUP 10.00
assign  ((resid   53 and name HN   )) ((resid   54 and name HD1* ))   5.50  3.70  0.00 ! #SUP  7.05
assign  ((resid   51 and name HN   )) ((resid   53 and name HN   ))   5.04  3.24  0.00 ! #SUP  7.47
assign  ((resid   52 and name HN   )) ((resid   53 and name HN   ))   3.46  1.66  0.00 ! #SUP  9.99
assign  ((resid   50 and name HN   )) ((resid   53 and name HN   ))   5.25  3.45  0.00 ! #SUP  3.19
assign  ((resid   51 and name HA   )) ((resid   53 and name HN   ))   5.32  3.52  0.00 ! #SUP  7.26
assign  ((resid   52 and name HB   )) ((resid   53 and name HN   ))   3.45  1.65  0.00 ! #SUP  8.49
assign  ((resid   53 and name HN   )) ((resid   53 and name HB2  ))   2.82  1.02  0.00 ! #SUP  8.16
assign  ((resid   51 and name HB*  )) ((resid   53 and name HN   ))   5.23  3.43  0.00 ! #SUP  5.80
assign  ((resid   53 and name HN   )) ((resid   53 and name HB1  ))   3.67  1.87  0.00 ! #SUP  7.17
assign  ((resid   52 and name HG11 )) ((resid   53 and name HN   ))   5.50  3.70  0.00 ! #SUP  8.38
assign  ((resid   53 and name HN   )) ((resid   53 and name HD1* ))   4.17  2.37  0.00 ! #SUP  5.64
assign  ((resid   52 and name HD1* )) ((resid   53 and name HN   ))   5.18  3.38  0.00 ! #SUP  8.95
assign  ((resid   30 and name HN   )) ((resid   31 and name HN   ))   2.99  1.19  0.00 ! #SUP  7.13
assign  ((resid   29 and name HN   )) ((resid   30 and name HN   ))   3.07  1.27  0.00 ! #SUP  8.15
assign  ((resid   30 and name HN   )) ((resid   31 and name HA   ))   5.33  3.53  0.00 ! #SUP  4.38
assign  ((resid   28 and name HA   )) ((resid   30 and name HN   ))   4.89  3.09  0.00 ! #SUP  4.56
assign  ((resid   30 and name HN   )) ((resid   31 and name HB2  ))   5.21  3.41  0.00 ! #SUP  4.06
assign  ((resid   28 and name HB1  )) ((resid   30 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.45
assign  ((resid   29 and name HB1  )) ((resid   30 and name HN   ))   4.02  2.22  0.00 ! #SUP  4.43
assign  ((resid   30 and name HN   )) ((resid   30 and name HB1  ))   3.05  1.25  0.00 ! #SUP  6.48
assign  ((resid   30 and name HN   )) ((resid   30 and name HB2  ))   3.48  1.68  0.00 ! #SUP  5.64
assign  ((resid   16 and name HN   )) ((resid   17 and name HN   ))   3.68  1.88  0.00 ! #SUP  6.66
assign  ((resid   16 and name HN   )) ((resid   69 and name HA   ))   3.54  1.74  0.00 ! #SUP  3.22
assign  ((resid   15 and name HA   )) ((resid   16 and name HN   ))   3.30  1.50  0.00 ! #SUP  4.59
assign  ((resid   16 and name HN   )) ((resid   17 and name HA   ))   5.50  3.70  0.00 ! #SUP  4.99
assign  ((resid   16 and name HN   )) ((resid   68 and name HA   ))   5.20  3.40  0.00 ! #SUP  0.76
assign  ((resid   16 and name HN   )) ((resid   16 and name HE2  ))   5.44  3.64  0.00 ! #SUP  6.94
assign  ((resid   15 and name HB1  )) ((resid   16 and name HN   ))   4.13  2.33  0.00 ! #SUP  5.36
assign  ((resid   15 and name HB2  )) ((resid   16 and name HN   ))   4.46  2.66  0.00 ! #SUP  7.07
assign  ((resid   16 and name HN   )) ((resid   16 and name HB2  ))   3.97  2.17  0.00 ! #SUP  7.31
assign  ((resid   16 and name HN   )) ((resid   16 and name HB1  ))   3.41  1.61  0.00 ! #SUP  7.61
assign  ((resid   16 and name HN   )) ((resid   16 and name HG1  ))   4.35  2.55  0.00 ! #SUP  7.36
assign  ((resid   16 and name HN   )) ((resid   16 and name HG2  ))   3.86  2.06  0.00 ! #SUP  7.55
assign  ((resid   16 and name HN   )) ((resid   20 and name HD1* ))   5.50  3.70  0.00 ! #SUP  3.72
assign  ((resid   52 and name HN   )) ((resid   52 and name HB   ))   3.17  1.37  0.00 ! #SUP  7.65
assign  ((resid   52 and name HN   )) ((resid   53 and name HB2  ))   5.10  3.30  0.00 ! #SUP  4.84
assign  ((resid   52 and name HN   )) ((resid   52 and name HG12 ))   4.03  2.23  0.00 ! #SUP  7.35
assign  ((resid   52 and name HN   )) ((resid   52 and name HG11 ))   3.79  1.99  0.00 ! #SUP  7.92
assign  ((resid   52 and name HN   )) ((resid   52 and name HG2* ))   4.54  2.74  0.00 ! #SUP  8.41
assign  ((resid   27 and name HD1* )) ((resid   52 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.75
assign  ((resid   48 and name HA   )) ((resid   52 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.50
assign  ((resid   50 and name HA   )) ((resid   52 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.01
assign  ((resid   51 and name HB*  )) ((resid   52 and name HN   ))   3.98  2.18  0.00 ! #SUP  6.82
assign  ((resid   27 and name HD2* )) ((resid   52 and name HN   ))   4.57  2.77  0.00 ! #SUP  8.14
assign  ((resid   52 and name HN   )) ((resid   52 and name HD1* ))   5.03  3.23  0.00 ! #SUP  7.36
assign  ((resid   11 and name HN   )) ((resid   12 and name HN   ))   5.28  3.48  0.00 ! #SUP  5.09
assign  ((resid   33 and name HA   )) ((resid   37 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.99
assign  ((resid   35 and name HA1  )) ((resid   37 and name HN   ))   5.18  3.38  0.00 ! #SUP  6.41
assign  ((resid   12 and name HN   )) ((resid   24 and name HA   ))   5.50  3.70  0.00 ! #SUP  4.06
assign  ((resid   11 and name HA   )) ((resid   12 and name HN   ))   3.06  1.26  0.00 ! #SUP  6.57
assign  ((resid   12 and name HN   )) ((resid   12 and name HB   ))   3.49  1.69  0.00 ! #SUP  5.35
assign  ((resid   11 and name HG2  )) ((resid   12 and name HN   ))   4.23  2.43  0.00 ! #SUP  5.52
assign  ((resid   11 and name HG1  )) ((resid   12 and name HN   ))   4.17  2.37  0.00 ! #SUP  6.34
assign  ((resid   11 and name HB1  )) ((resid   12 and name HN   ))   4.65  2.85  0.00 ! #SUP  5.26
assign  ((resid   12 and name HN   )) ((resid   12 and name HG2* ))   4.80  3.00  0.00 ! #SUP  4.63
assign  ((resid   37 and name HN   )) ((resid   37 and name HD1  ))   5.50  3.70  0.00 ! #SUP  7.29
assign  ((resid   37 and name HN   )) ((resid   37 and name HB1  ))   3.36  1.56  0.00 ! #SUP  6.77
assign  ((resid   36 and name HB1  )) ((resid   37 and name HN   ))   3.84  2.04  0.00 ! #SUP  5.61
assign  ((resid   36 and name HB2  )) ((resid   37 and name HN   ))   4.35  2.55  0.00 ! #SUP  5.61
assign  ((resid   37 and name HN   )) ((resid   37 and name HB2  ))   3.44  1.64  0.00 ! #SUP  5.65
assign  ((resid   37 and name HN   )) ((resid   38 and name HG12 ))   5.50  3.70  0.00 ! #SUP  6.18
assign  ((resid   37 and name HN   )) ((resid   40 and name HG2* ))   5.50  3.70  0.00 ! #SUP  4.05
assign  ((resid   20 and name HA   )) ((resid   21 and name HN   ))   2.91  1.11  0.00 ! #SUP  5.22
assign  ((resid   15 and name HD2  )) ((resid   21 and name HN   ))   5.29  3.49  0.00 ! #SUP  2.36
assign  ((resid   21 and name HN   )) ((resid   21 and name HG2  ))   5.10  3.30  0.00 ! #SUP  4.97
assign  ((resid   21 and name HN   )) ((resid   21 and name HB1  ))   3.73  1.93  0.00 ! #SUP  4.83
assign  ((resid   21 and name HN   )) ((resid   21 and name HB2  ))   3.17  1.37  0.00 ! #SUP  4.87
assign  ((resid   20 and name HB2  )) ((resid   21 and name HN   ))   3.39  1.59  0.00 ! #SUP  5.06
assign  ((resid   20 and name HD2* )) ((resid   21 and name HN   ))   4.47  2.67  0.00 ! #SUP  5.19
assign  ((resid    7 and name HN   )) ((resid   27 and name HD1* ))   5.50  3.70  0.00 ! #SUP  2.97
assign  ((resid    5 and name HA   )) ((resid    7 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.06
assign  ((resid    4 and name HA   )) ((resid    7 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.27
assign  ((resid   41 and name HN   )) ((resid   42 and name HN   ))   3.08  1.28  0.00 ! #SUP  4.26
assign  ((resid   42 and name HN   )) ((resid   43 and name HN   ))   4.47  2.67  0.00 ! #SUP  2.91
assign  ((resid   39 and name HA   )) ((resid   42 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.57
assign  ((resid   37 and name HA   )) ((resid   42 and name HN   ))   5.50  3.70  0.00 ! #SUP  2.61
assign  ((resid   38 and name HA   )) ((resid   42 and name HN   ))   3.47  1.67  0.00 ! #SUP  5.08
assign  ((resid   42 and name HN   )) ((resid   54 and name HD2* ))   5.37  3.57  0.00 ! #SUP  4.67
assign  ((resid   40 and name HG2* )) ((resid   42 and name HN   ))   4.46  2.66  0.00 ! #SUP  3.06
assign  ((resid   38 and name HD1* )) ((resid   42 and name HN   ))   5.18  3.38  0.00 ! #SUP  6.42
assign  ((resid   31 and name HA   )) ((resid   33 and name HN   ))   4.59  2.79  0.00 ! #SUP  4.97
assign  ((resid   32 and name HN   )) ((resid   33 and name HN   ))   3.50  1.70  0.00 ! #SUP  5.70
assign  ((resid   33 and name HN   )) ((resid   34 and name HN   ))   5.50  3.70  0.00 ! #SUP  2.90
assign  ((resid   33 and name HN   )) ((resid   36 and name HN   ))   4.71  2.91  0.00 ! #SUP  4.48
assign  ((resid   32 and name HB2  )) ((resid   33 and name HN   ))   4.63  2.83  0.00 ! #SUP  5.50
assign  ((resid   31 and name HB1  )) ((resid   33 and name HN   ))   3.82  2.02  0.00 ! #SUP  3.08
assign  ((resid   31 and name HB2  )) ((resid   33 and name HN   ))   4.35  2.55  0.00 ! #SUP  3.08
assign  ((resid   33 and name HN   )) ((resid   36 and name HB1  ))   3.80  2.00  0.00 ! #SUP  2.95
assign  ((resid   33 and name HN   )) ((resid   37 and name HN   ))   4.65  2.85  0.00 ! #SUP  2.95
assign  ((resid   65 and name HN   )) ((resid   68 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.25
assign  ((resid   67 and name HN   )) ((resid   68 and name HN   ))   4.13  2.33  0.00 ! #SUP  7.28
assign  ((resid   64 and name HA   )) ((resid   68 and name HN   ))   5.19  3.39  0.00 ! #SUP  2.67
assign  ((resid   66 and name HA   )) ((resid   68 and name HN   ))   4.82  3.02  0.00 ! #SUP  4.05
assign  ((resid   67 and name HB   )) ((resid   68 and name HN   ))   4.69  2.89  0.00 ! #SUP  6.08
assign  ((resid   68 and name HN   )) ((resid   68 and name HG2  ))   4.79  2.99  0.00 ! #SUP  7.69
assign  ((resid   68 and name HN   )) ((resid   68 and name HG1  ))   4.78  2.98  0.00 ! #SUP  7.44
assign  ((resid   67 and name HG2* )) ((resid   68 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.18
assign  ((resid   38 and name HN   )) ((resid   42 and name HN   ))   4.94  3.14  0.00 ! #SUP  3.03
assign  ((resid   38 and name HN   )) ((resid   40 and name HN   ))   5.19  3.39  0.00 ! #SUP  7.25
assign  ((resid   37 and name HN   )) ((resid   38 and name HN   ))   3.65  1.85  0.00 ! #SUP  8.04
assign  ((resid   37 and name HD1  )) ((resid   38 and name HN   ))   4.90  3.10  0.00 ! #SUP  7.95
assign  ((resid   36 and name HA   )) ((resid   38 and name HN   ))   4.65  2.85  0.00 ! #SUP  3.78
assign  ((resid   35 and name HA2  )) ((resid   38 and name HN   ))   5.27  3.47  0.00 ! #SUP  6.70
assign  ((resid   35 and name HA1  )) ((resid   38 and name HN   ))   4.41  2.61  0.00 ! #SUP  7.42
assign  ((resid   37 and name HB1  )) ((resid   38 and name HN   ))   3.74  1.94  0.00 ! #SUP  6.82
assign  ((resid   38 and name HN   )) ((resid   38 and name HB   ))   3.04  1.24  0.00 ! #SUP  8.00
assign  ((resid   38 and name HN   )) ((resid   38 and name HG12 ))   3.26  1.46  0.00 ! #SUP  8.43
assign  ((resid   38 and name HN   )) ((resid   38 and name HG11 ))   3.73  1.93  0.00 ! #SUP  7.16
assign  ((resid   38 and name HN   )) ((resid   38 and name HG2* ))   4.00  2.20  0.00 ! #SUP  7.86
assign  ((resid   38 and name HN   )) ((resid   40 and name HG1* ))   5.50  3.70  0.00 ! #SUP  4.19
assign  ((resid   38 and name HN   )) ((resid   40 and name HG2* ))   5.50  3.70  0.00 ! #SUP  4.81
assign  ((resid   38 and name HN   )) ((resid   38 and name HD1* ))   4.36  2.56  0.00 ! #SUP  8.18
assign  ((resid   36 and name HN   )) ((resid   38 and name HN   ))   4.90  3.10  0.00 ! #SUP  5.16
assign  ((resid   38 and name HN   )) ((resid   39 and name HA   ))   5.43  3.63  0.00 ! #SUP  6.79
assign  ((resid   43 and name HN   )) ((resid   44 and name HN   ))   5.45  3.65  0.00 ! #SUP  3.57
assign  ((resid   42 and name HA1  )) ((resid   43 and name HN   ))   3.28  1.48  0.00 ! #SUP  3.54
assign  ((resid   43 and name HN   )) ((resid   43 and name HB1  ))   4.04  2.24  0.00 ! #SUP  4.36
assign  ((resid   43 and name HN   )) ((resid   43 and name HB2  ))   3.89  2.09  0.00 ! #SUP  5.27
assign  ((resid   42 and name HA2  )) ((resid   43 and name HN   ))   3.58  1.78  0.00 ! #SUP  2.91
assign  ((resid    3 and name HG2* )) ((resid   43 and name HN   ))   5.18  3.38  0.00 ! #SUP  1.97
assign  ((resid   43 and name HN   )) ((resid   54 and name HD1* ))   4.95  3.15  0.00 ! #SUP  3.70
assign  ((resid   38 and name HD1* )) ((resid   43 and name HN   ))   5.36  3.56  0.00 ! #SUP  3.00
assign  ((resid   13 and name HN   )) ((resid   25 and name HN   ))   5.15  3.35  0.00 ! #SUP  0.75
assign  ((resid   25 and name HN   )) ((resid   26 and name HN   ))   4.84  3.04  0.00 ! #SUP  3.93
assign  ((resid   24 and name HA   )) ((resid   25 and name HN   ))   2.83  1.03  0.00 ! #SUP  6.07
assign  ((resid   10 and name HA   )) ((resid   25 and name HN   ))   4.80  3.00  0.00 ! #SUP  0.87
assign  ((resid   23 and name HA   )) ((resid   25 and name HN   ))   5.15  3.35  0.00 ! #SUP  2.30
assign  ((resid   10 and name HB2  )) ((resid   25 and name HN   ))   4.47  2.67  0.00 ! #SUP  3.57
assign  ((resid   25 and name HN   )) ((resid   25 and name HB   ))   3.99  2.19  0.00 ! #SUP  6.26
assign  ((resid   24 and name HG2* )) ((resid   25 and name HN   ))   3.83  2.03  0.00 ! #SUP  4.49
assign  ((resid   25 and name HN   )) ((resid   25 and name HG2* ))   3.57  1.77  0.00 ! #SUP  5.19
assign  ((resid   46 and name HG2  )) ((resid   50 and name HN   ))   5.43  3.63  0.00 ! #SUP  3.21
assign  ((resid   12 and name HN   )) ((resid   13 and name HN   ))   5.30  3.50  0.00 ! #SUP  5.64
assign  ((resid   13 and name HN   )) ((resid   23 and name HN   ))   4.07  2.27  0.00 ! #SUP  9.23
assign  ((resid   12 and name HA   )) ((resid   13 and name HN   ))   2.88  1.08  0.00 ! #SUP  4.99
assign  ((resid   13 and name HN   )) ((resid   24 and name HA   ))   4.04  2.24  0.00 ! #SUP  6.18
assign  ((resid   12 and name HB   )) ((resid   13 and name HN   ))   4.60  2.80  0.00 ! #SUP  4.40
assign  ((resid   13 and name HN   )) ((resid   13 and name HB2  ))   3.76  1.96  0.00 ! #SUP  4.31
assign  ((resid   13 and name HN   )) ((resid   22 and name HB1  ))   5.25  3.45  0.00 ! #SUP  4.92
assign  ((resid   13 and name HN   )) ((resid   22 and name HB2  ))   5.04  3.24  0.00 ! #SUP  4.92
assign  ((resid   11 and name HG1  )) ((resid   13 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.08
assign  ((resid   13 and name HN   )) ((resid   23 and name HB2  ))   4.35  2.55  0.00 ! #SUP  5.85
assign  ((resid   12 and name HG2* )) ((resid   13 and name HN   ))   3.73  1.93  0.00 ! #SUP  6.09
assign  ((resid   13 and name HN   )) ((resid   23 and name HD1* ))   5.50  3.70  0.00 ! #SUP  6.18
assign  ((resid   13 and name HN   )) ((resid   23 and name HB1  ))   5.50  3.70  0.00 ! #SUP  5.83
assign  ((resid   50 and name HN   )) ((resid   52 and name HN   ))   4.90  3.10  0.00 ! #SUP  4.31
assign  ((resid   47 and name HB1  )) ((resid   50 and name HN   ))   5.04  3.24  0.00 ! #SUP  4.99
assign  ((resid   47 and name HB2  )) ((resid   50 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.25
assign  ((resid   50 and name HN   )) ((resid   50 and name HB1  ))   3.22  1.42  0.00 ! #SUP  4.49
assign  ((resid   50 and name HN   )) ((resid   50 and name HB2  ))   3.57  1.77  0.00 ! #SUP  4.63
assign  ((resid   49 and name HB1  )) ((resid   50 and name HN   ))   3.34  1.54  0.00 ! #SUP  4.25
assign  ((resid   50 and name HN   )) ((resid   51 and name HB*  ))   4.91  3.11  0.00 ! #SUP  3.31
assign  ((resid   49 and name HG2  )) ((resid   50 and name HN   ))   4.69  2.89  0.00 ! #SUP  5.02
assign  ((resid   50 and name HN   )) ((resid   72 and name HD1* ))   5.21  3.41  0.00 ! #SUP  3.70
assign  ((resid   19 and name HN   )) ((resid   20 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.18
assign  ((resid   16 and name HG2  )) ((resid   17 and name HN   ))   5.50  3.70  0.00 ! #SUP  5.66
assign  ((resid   17 and name HN   )) ((resid   18 and name HN   ))   5.38  3.58  0.00 ! #SUP  1.22
assign  ((resid    6 and name HD2* )) ((resid    8 and name HN   ))   5.50  3.70  0.00 ! #SUP  2.49
assign  ((resid    7 and name HN   )) ((resid    8 and name HN   ))   3.86  2.06  0.00 ! #SUP  5.93
assign  ((resid    8 and name HN   )) ((resid    9 and name HN   ))   3.67  1.87  0.00 ! #SUP  3.16
assign  ((resid    6 and name HA   )) ((resid    8 and name HN   ))   5.18  3.38  0.00 ! #SUP  3.03
assign  ((resid    8 and name HN   )) ((resid    8 and name HE1  ))   5.50  3.70  0.00 ! #SUP  4.95
assign  ((resid    7 and name HB1  )) ((resid    8 and name HN   ))   4.97  3.17  0.00 ! #SUP  5.79
assign  ((resid    7 and name HB2  )) ((resid    8 and name HN   ))   5.50  3.70  0.00 ! #SUP  5.54
assign  ((resid    8 and name HN   )) ((resid    8 and name HB2  ))   3.83  2.03  0.00 ! #SUP  5.82
assign  ((resid    8 and name HN   )) ((resid    8 and name HB1  ))   3.40  1.60  0.00 ! #SUP  5.15
assign  ((resid    8 and name HN   )) ((resid    8 and name HG2  ))   3.60  1.80  0.00 ! #SUP  6.99
assign  ((resid   15 and name HB2  )) ((resid   17 and name HN   ))   4.90  3.10  0.00 ! #SUP  3.23
assign  ((resid   17 and name HN   )) ((resid   17 and name HD*  ))   4.54  2.74  0.00 ! #SUP  3.54
assign  ((resid   17 and name HN   )) ((resid   17 and name HB2  ))   3.74  1.94  0.00 ! #SUP  4.96
assign  ((resid   16 and name HB1  )) ((resid   17 and name HN   ))   4.53  2.73  0.00 ! #SUP  5.87
assign  ((resid   17 and name HN   )) ((resid   20 and name HD1* ))   5.08  3.28  0.00 ! #SUP  2.93
assign  ((resid   44 and name HN   )) ((resid   45 and name HN   ))   3.93  2.13  0.00 ! #SUP  5.90
assign  ((resid   45 and name HN   )) ((resid   45 and name HD2  ))   5.39  3.59  0.00 ! #SUP  6.79
assign  ((resid   45 and name HN   )) ((resid   45 and name HD1  ))   5.39  3.59  0.00 ! #SUP  6.76
assign  ((resid   43 and name HB1  )) ((resid   45 and name HN   ))   5.26  3.46  0.00 ! #SUP  3.31
assign  ((resid   43 and name HB2  )) ((resid   45 and name HN   ))   4.56  2.76  0.00 ! #SUP  3.80
assign  ((resid   45 and name HN   )) ((resid   46 and name HB2  ))   5.50  3.70  0.00 ! #SUP  3.69
assign  ((resid   45 and name HN   )) ((resid   45 and name HB2  ))   3.93  2.13  0.00 ! #SUP  7.10
assign  ((resid   45 and name HN   )) ((resid   45 and name HB1  ))   4.17  2.37  0.00 ! #SUP  7.01
assign  ((resid   45 and name HN   )) ((resid   45 and name HG1  ))   3.64  1.84  0.00 ! #SUP  8.34
assign  ((resid   27 and name HN   )) ((resid   28 and name HN   ))   4.26  2.46  0.00 ! #SUP  7.58
assign  ((resid   28 and name HN   )) ((resid   30 and name HN   ))   4.83  3.03  0.00 ! #SUP  4.56
assign  ((resid   28 and name HN   )) ((resid   29 and name HN   ))   3.57  1.77  0.00 ! #SUP  6.69
assign  ((resid   26 and name HA   )) ((resid   28 and name HN   ))   5.50  3.70  0.00 ! #SUP  2.92
assign  ((resid    8 and name HA   )) ((resid   28 and name HN   ))   4.70  2.90  0.00 ! #SUP  2.53
assign  ((resid   26 and name HB1  )) ((resid   28 and name HN   ))   4.03  2.23  0.00 ! #SUP  5.17
assign  ((resid    7 and name HA   )) ((resid   28 and name HN   ))   4.97  3.17  0.00 ! #SUP  3.30
assign  ((resid   28 and name HN   )) ((resid   28 and name HB1  ))   3.20  1.40  0.00 ! #SUP  5.21
assign  ((resid   28 and name HN   )) ((resid   28 and name HB2  ))   3.58  1.78  0.00 ! #SUP  5.09
assign  ((resid    7 and name HB2  )) ((resid   28 and name HN   ))   5.29  3.49  0.00 ! #SUP  5.13
assign  ((resid   27 and name HG   )) ((resid   28 and name HN   ))   5.50  3.70  0.00 ! #SUP  7.66
assign  ((resid   27 and name HB2  )) ((resid   28 and name HN   ))   3.97  2.17  0.00 ! #SUP  7.58
assign  ((resid   27 and name HB1  )) ((resid   28 and name HN   ))   4.21  2.41  0.00 ! #SUP  7.58
assign  ((resid   27 and name HD2* )) ((resid   28 and name HN   ))   5.50  3.70  0.00 ! #SUP  7.62
assign  ((resid   27 and name HD1* )) ((resid   28 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.95
assign  ((resid   66 and name HG1  )) ((resid   71 and name HN   ))   4.62  2.82  0.00 ! #SUP  1.53
assign  ((resid   66 and name HA   )) ((resid   71 and name HN   ))   5.37  3.57  0.00 ! #SUP  3.41
assign  ((resid   71 and name HN   )) ((resid   71 and name HD2* ))   5.50  3.70  0.00 ! #SUP  4.46
assign  ((resid   15 and name HD2  )) ((resid   23 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.19
assign  ((resid   14 and name HA   )) ((resid   23 and name HN   ))   5.11  3.31  0.00 ! #SUP  7.08
assign  ((resid   15 and name HD1  )) ((resid   23 and name HN   ))   5.02  3.22  0.00 ! #SUP  5.99
assign  ((resid   13 and name HB1  )) ((resid   23 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.60
assign  ((resid   13 and name HB2  )) ((resid   23 and name HN   ))   4.78  2.98  0.00 ! #SUP  5.63
assign  ((resid   22 and name HB1  )) ((resid   23 and name HN   ))   4.11  2.31  0.00 ! #SUP  3.66
assign  ((resid   22 and name HG2  )) ((resid   23 and name HN   ))   5.50  3.70  0.00 ! #SUP  5.33
assign  ((resid   22 and name HB2  )) ((resid   23 and name HN   ))   4.21  2.41  0.00 ! #SUP  3.42
assign  ((resid   23 and name HN   )) ((resid   23 and name HB2  ))   3.71  1.91  0.00 ! #SUP  5.85
assign  ((resid   12 and name HG2* )) ((resid   23 and name HN   ))   4.88  3.08  0.00 ! #SUP  5.29
assign  ((resid   23 and name HN   )) ((resid   23 and name HD2* ))   5.50  3.70  0.00 ! #SUP  6.19
assign  ((resid   23 and name HN   )) ((resid   23 and name HD1* ))   5.38  3.58  0.00 ! #SUP  6.37
assign  ((resid   23 and name HN   )) ((resid   23 and name HB1  ))   4.18  2.38  0.00 ! #SUP  6.24
assign  ((resid   26 and name HN   )) ((resid   29 and name HN   ))   4.85  3.05  0.00 ! #SUP  7.45
assign  ((resid   25 and name HA   )) ((resid   26 and name HN   ))   3.16  1.36  0.00 ! #SUP  4.97
assign  ((resid   26 and name HN   )) ((resid   29 and name HB1  ))   3.96  2.16  0.00 ! #SUP  3.22
assign  ((resid   26 and name HN   )) ((resid   30 and name HB1  ))   5.50  3.70  0.00 ! #SUP  3.00
assign  ((resid   25 and name HB   )) ((resid   26 and name HN   ))   4.07  2.27  0.00 ! #SUP  5.03
assign  ((resid   25 and name HG12 )) ((resid   26 and name HN   ))   3.93  2.13  0.00 ! #SUP  4.41
assign  ((resid   26 and name HN   )) ((resid   30 and name HB2  ))   5.17  3.37  0.00 ! #SUP  4.08
assign  ((resid   25 and name HG2* )) ((resid   26 and name HN   ))   4.26  2.46  0.00 ! #SUP  4.76
assign  ((resid   26 and name HN   )) ((resid   52 and name HD1* ))   5.50  3.70  0.00 ! #SUP  1.89
assign  ((resid   39 and name HN   )) ((resid   40 and name HN   ))   3.30  1.50  0.00 ! #SUP  8.19
assign  ((resid   37 and name HN   )) ((resid   39 and name HN   ))   5.09  3.29  0.00 ! #SUP  5.12
assign  ((resid   39 and name HN   )) ((resid   39 and name HB2  ))   2.83  1.03  0.00 ! #SUP  5.55
assign  ((resid   35 and name HA1  )) ((resid   39 and name HN   ))   4.94  3.14  0.00 ! #SUP  3.24
assign  ((resid   37 and name HA   )) ((resid   39 and name HN   ))   5.38  3.58  0.00 ! #SUP  5.33
assign  ((resid   38 and name HB   )) ((resid   39 and name HN   ))   3.25  1.45  0.00 ! #SUP  7.89
assign  ((resid   38 and name HG12 )) ((resid   39 and name HN   ))   4.53  2.73  0.00 ! #SUP  7.82
assign  ((resid   38 and name HG11 )) ((resid   39 and name HN   ))   4.78  2.98  0.00 ! #SUP  7.18
assign  ((resid   38 and name HG2* )) ((resid   39 and name HN   ))   3.99  2.19  0.00 ! #SUP  9.67
assign  ((resid   39 and name HN   )) ((resid   40 and name HG1* ))   5.11  3.31  0.00 ! #SUP  6.87
assign  ((resid   39 and name HN   )) ((resid   40 and name HG2* ))   5.00  3.20  0.00 ! #SUP  5.46
assign  ((resid   38 and name HD1* )) ((resid   39 and name HN   ))   5.50  3.70  0.00 ! #SUP  7.18
assign  ((resid   20 and name HD1* )) ((resid   69 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.45
assign  ((resid   68 and name HN   )) ((resid   69 and name HN   ))   3.54  1.74  0.00 ! #SUP  6.12
assign  ((resid   67 and name HN   )) ((resid   69 and name HN   ))   5.38  3.58  0.00 ! #SUP  3.79
assign  ((resid   15 and name HA   )) ((resid   69 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.11
assign  ((resid   66 and name HA   )) ((resid   69 and name HN   ))   4.49  2.69  0.00 ! #SUP  2.77
assign  ((resid   16 and name HE2  )) ((resid   69 and name HN   ))   5.06  3.26  0.00 ! #SUP  5.51
assign  ((resid   69 and name HN   )) ((resid   69 and name HB2  ))   3.89  2.09  0.00 ! #SUP  4.95
assign  ((resid   68 and name HB2  )) ((resid   69 and name HN   ))   4.05  2.25  0.00 ! #SUP  6.59
assign  ((resid   68 and name HB1  )) ((resid   69 and name HN   ))   4.59  2.79  0.00 ! #SUP  7.01
assign  ((resid   68 and name HG1  )) ((resid   69 and name HN   ))   5.50  3.70  0.00 ! #SUP  7.03
assign  ((resid   69 and name HN   )) ((resid   71 and name HD2* ))   5.50  3.70  0.00 ! #SUP  2.10
assign  ((resid   63 and name HB1  )) ((resid   64 and name HN   ))   5.49  3.69  0.00 ! #SUP  1.96
assign  ((resid   35 and name HN   )) ((resid   36 and name HN   ))   4.06  2.26  0.00 ! #SUP  5.12
assign  ((resid   36 and name HN   )) ((resid   37 and name HN   ))   3.38  1.58  0.00 ! #SUP  8.15
assign  ((resid   36 and name HN   )) ((resid   36 and name HB1  ))   3.32  1.52  0.00 ! #SUP  4.33
assign  ((resid   36 and name HN   )) ((resid   36 and name HB2  ))   3.33  1.53  0.00 ! #SUP  4.33
assign  ((resid   34 and name HN   )) ((resid   36 and name HN   ))   5.40  3.60  0.00 ! #SUP  4.58
assign  ((resid   33 and name HA   )) ((resid   36 and name HN   ))   5.29  3.49  0.00 ! #SUP  4.48
assign  ((resid   36 and name HN   )) ((resid   37 and name HB1  ))   5.37  3.57  0.00 ! #SUP  4.14
assign  ((resid   23 and name HN   )) ((resid   24 and name HN   ))   4.73  2.93  0.00 ! #SUP  5.29
assign  ((resid   24 and name HN   )) ((resid   25 and name HN   ))   4.51  2.71  0.00 ! #SUP  3.97
assign  ((resid   12 and name HA   )) ((resid   24 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.75
assign  ((resid   23 and name HA   )) ((resid   24 and name HN   ))   2.83  1.03  0.00 ! #SUP  7.10
assign  ((resid   24 and name HN   )) ((resid   25 and name HB   ))   5.09  3.29  0.00 ! #SUP  5.75
assign  ((resid   23 and name HB2  )) ((resid   24 and name HN   ))   3.89  2.09  0.00 ! #SUP  5.62
assign  ((resid   23 and name HD2* )) ((resid   24 and name HN   ))   3.71  1.91  0.00 ! #SUP  7.24
assign  ((resid   23 and name HD1* )) ((resid   24 and name HN   ))   5.44  3.64  0.00 ! #SUP  6.73
assign  ((resid   23 and name HB1  )) ((resid   24 and name HN   ))   4.71  2.91  0.00 ! #SUP  5.61
assign  ((resid   69 and name HN   )) ((resid   70 and name HN   ))   5.42  3.62  0.00 ! #SUP  4.72
assign  ((resid   69 and name HN   )) ((resid   71 and name HN   ))   5.04  3.24  0.00 ! #SUP  1.43
assign  ((resid   64 and name HN   )) ((resid   64 and name HB1  ))   4.18  2.38  0.00 ! #SUP  5.20
assign  ((resid   64 and name HN   )) ((resid   64 and name HG1  ))   5.50  3.70  0.00 ! #SUP  4.92
assign  ((resid   55 and name HA2  )) ((resid   58 and name HN   ))   5.41  3.61  0.00 ! #SUP  1.96
assign  ((resid   57 and name HN   )) ((resid   58 and name HN   ))   4.21  2.41  0.00 ! #SUP  3.67
assign  ((resid   58 and name HN   )) ((resid   58 and name HB1  ))   4.04  2.24  0.00 ! #SUP  4.29
assign  ((resid   58 and name HN   )) ((resid   58 and name HB2  ))   3.94  2.14  0.00 ! #SUP  4.29
assign  ((resid   57 and name HB2  )) ((resid   58 and name HN   ))   4.95  3.15  0.00 ! #SUP  3.79
assign  ((resid   60 and name HN   )) ((resid   61 and name HN   ))   3.80  2.00  0.00 ! #SUP  9.31
assign  ((resid   61 and name HN   )) ((resid   62 and name HN   ))   3.53  1.73  0.00 ! #SUP  5.52
assign  ((resid   61 and name HN   )) ((resid   62 and name HB2  ))   5.50  3.70  0.00 ! #SUP  2.69
assign  ((resid   60 and name HB2  )) ((resid   61 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.62
assign  ((resid   59 and name HB1  )) ((resid   61 and name HN   ))   5.05  3.25  0.00 ! #SUP  6.35
assign  ((resid   60 and name HG2  )) ((resid   61 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.64
assign  ((resid   56 and name HB1  )) ((resid   61 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.92
assign  ((resid   61 and name HN   )) ((resid   61 and name HD2* ))   5.06  3.26  0.00 ! #SUP  6.09
assign  ((resid   61 and name HN   )) ((resid   61 and name HD1* ))   4.92  3.12  0.00 ! #SUP  6.58
assign  ((resid   56 and name HD2* )) ((resid   61 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.70
assign  ((resid   56 and name HA   )) ((resid   61 and name HN   ))   4.98  3.18  0.00 ! #SUP  5.61
assign  ((resid   59 and name HB2  )) ((resid   61 and name HN   ))   5.50  3.70  0.00 ! #SUP  7.75
assign  ((resid   31 and name HA   )) ((resid   32 and name HN   ))   3.19  1.39  0.00 ! #SUP  6.84
assign  ((resid   32 and name HN   )) ((resid   32 and name HB1  ))   3.86  2.06  0.00 ! #SUP  4.06
assign  ((resid   31 and name HB1  )) ((resid   32 and name HN   ))   4.23  2.43  0.00 ! #SUP  4.94
assign  ((resid   31 and name HB2  )) ((resid   32 and name HN   ))   4.76  2.96  0.00 ! #SUP  4.94
assign  ((resid   32 and name HN   )) ((resid   36 and name HB1  ))   4.50  2.70  0.00 ! #SUP  3.87
assign  ((resid   32 and name HN   )) ((resid   36 and name HB2  ))   5.05  3.25  0.00 ! #SUP  2.00
assign  ((resid   48 and name HN   )) ((resid   49 and name HN   ))   3.98  2.18  0.00 ! #SUP  4.63
assign  ((resid   49 and name HN   )) ((resid   51 and name HN   ))   4.57  2.77  0.00 ! #SUP  3.79
assign  ((resid   49 and name HN   )) ((resid   50 and name HN   ))   3.51  1.71  0.00 ! #SUP  4.95
assign  ((resid   47 and name HB1  )) ((resid   49 and name HN   ))   4.27  2.47  0.00 ! #SUP  5.11
assign  ((resid   49 and name HN   )) ((resid   49 and name HB1  ))   2.84  1.04  0.00 ! #SUP  4.63
assign  ((resid   49 and name HN   )) ((resid   49 and name HG2  ))   3.70  1.90  0.00 ! #SUP  5.15
assign  ((resid   49 and name HN   )) ((resid   72 and name HD1* ))   5.42  3.62  0.00 ! #SUP  3.59
assign  ((resid   16 and name HN   )) ((resid   70 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.86
assign  ((resid   15 and name HA   )) ((resid   70 and name HN   ))   4.82  3.02  0.00 ! #SUP  5.02
assign  ((resid   70 and name HN   )) ((resid   70 and name HB1  ))   4.16  2.36  0.00 ! #SUP  3.20
assign  ((resid   70 and name HN   )) ((resid   70 and name HB2  ))   3.91  2.11  0.00 ! #SUP  3.20
assign  ((resid   16 and name HE2  )) ((resid   70 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.37
assign  ((resid   69 and name HB1  )) ((resid   70 and name HN   ))   4.15  2.35  0.00 ! #SUP  4.36
assign  ((resid   69 and name HB2  )) ((resid   70 and name HN   ))   4.80  3.00  0.00 ! #SUP  4.25
assign  ((resid   16 and name HG2  )) ((resid   70 and name HN   ))   5.49  3.69  0.00 ! #SUP  5.10
assign  ((resid    2 and name HB2  )) ((resid    5 and name HN   ))   5.24  3.44  0.00 ! #SUP  3.39
assign  ((resid    3 and name HN   )) ((resid    5 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.51
assign  ((resid    4 and name HN   )) ((resid    5 and name HN   ))   3.58  1.78  0.00 ! #SUP  6.94
assign  ((resid    5 and name HN   )) ((resid    5 and name HB1  ))   3.65  1.85  0.00 ! #SUP  6.35
assign  ((resid    5 and name HN   )) ((resid    5 and name HB2  ))   3.56  1.76  0.00 ! #SUP  5.66
assign  ((resid    4 and name HB1  )) ((resid    5 and name HN   ))   4.59  2.79  0.00 ! #SUP  6.13
assign  ((resid    4 and name HB2  )) ((resid    5 and name HN   ))   4.77  2.97  0.00 ! #SUP  5.42
assign  ((resid    2 and name HB1  )) ((resid    5 and name HN   ))   4.48  2.68  0.00 ! #SUP  4.47
assign  ((resid    5 and name HN   )) ((resid    6 and name HB2  ))   5.06  3.26  0.00 ! #SUP  5.43
assign  ((resid    3 and name HG2* )) ((resid    5 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.48
assign  ((resid    3 and name HG1* )) ((resid    5 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.03
assign  ((resid   47 and name HN   )) ((resid   50 and name HN   ))   4.41  2.61  0.00 ! #SUP  6.94
assign  ((resid   46 and name HN   )) ((resid   47 and name HN   ))   4.77  2.97  0.00 ! #SUP  3.55
assign  ((resid   47 and name HN   )) ((resid   47 and name HB1  ))   3.90  2.10  0.00 ! #SUP  5.51
assign  ((resid   46 and name HA   )) ((resid   47 and name HN   ))   2.80  1.00  0.00 ! #SUP  5.04
assign  ((resid   46 and name HG2  )) ((resid   47 and name HN   ))   4.90  3.10  0.00 ! #SUP  6.51
assign  ((resid   46 and name HG1  )) ((resid   47 and name HN   ))   4.62  2.82  0.00 ! #SUP  4.52
assign  ((resid   47 and name HN   )) ((resid   50 and name HG1  ))   3.83  2.03  0.00 ! #SUP  0.02
assign  ((resid   47 and name HN   )) ((resid   50 and name HB1  ))   3.58  1.78  0.00 ! #SUP  4.15
assign  ((resid   46 and name HB2  )) ((resid   47 and name HN   ))   4.21  2.41  0.00 ! #SUP  4.90
assign  ((resid   47 and name HN   )) ((resid   50 and name HB2  ))   3.91  2.11  0.00 ! #SUP  4.15
assign  ((resid   47 and name HN   )) ((resid   51 and name HB*  ))   5.50  3.70  0.00 ! #SUP  3.91
assign  ((resid    3 and name HG2* )) ((resid   47 and name HN   ))   5.50  3.70  0.00 ! #SUP  2.25
assign  ((resid   47 and name HN   )) ((resid   48 and name HN   ))   5.45  3.65  0.00 ! #SUP  4.07
assign  ((resid   55 and name HN   )) ((resid   56 and name HN   ))   3.57  1.77  0.00 ! #SUP  6.07
assign  ((resid   53 and name HN   )) ((resid   55 and name HN   ))   5.00  3.20  0.00 ! #SUP  6.86
assign  ((resid   55 and name HN   )) ((resid   57 and name HN   ))   4.92  3.12  0.00 ! #SUP  3.14
assign  ((resid   54 and name HN   )) ((resid   55 and name HN   ))   3.50  1.70  0.00 ! #SUP 10.00
assign  ((resid   53 and name HA   )) ((resid   55 and name HN   ))   5.11  3.31  0.00 ! #SUP  8.52
assign  ((resid   54 and name HB1  )) ((resid   55 and name HN   ))   3.63  1.83  0.00 ! #SUP  7.21
assign  ((resid   55 and name HN   )) ((resid   56 and name HB2  ))   5.50  3.70  0.00 ! #SUP  4.55
assign  ((resid   53 and name HB2  )) ((resid   55 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.87
assign  ((resid   54 and name HB2  )) ((resid   55 and name HN   ))   3.91  2.11  0.00 ! #SUP  6.87
assign  ((resid   54 and name HD2* )) ((resid   55 and name HN   ))   5.43  3.63  0.00 ! #SUP  7.31
assign  ((resid   27 and name HD2* )) ((resid   55 and name HN   ))   4.26  2.46  0.00 ! #SUP  1.46
assign  ((resid   52 and name HG2* )) ((resid   55 and name HN   ))   5.43  3.63  0.00 ! #SUP  7.19
assign  ((resid   54 and name HD1* )) ((resid   55 and name HN   ))   4.94  3.14  0.00 ! #SUP  8.31
assign  ((resid   30 and name HD2* )) ((resid   55 and name HN   ))   5.50  3.70  0.00 ! #SUP  2.41
assign  ((resid   26 and name HB1  )) ((resid   29 and name HN   ))   5.50  3.70  0.00 ! #SUP  5.47
assign  ((resid   27 and name HN   )) ((resid   29 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.69
assign  ((resid   29 and name HN   )) ((resid   31 and name HN   ))   4.62  2.82  0.00 ! #SUP  5.35
assign  ((resid   27 and name HA   )) ((resid   29 and name HN   ))   4.63  2.83  0.00 ! #SUP  5.37
assign  ((resid   26 and name HB2  )) ((resid   29 and name HN   ))   5.50  3.70  0.00 ! #SUP  2.64
assign  ((resid   28 and name HB1  )) ((resid   29 and name HN   ))   4.38  2.58  0.00 ! #SUP  5.43
assign  ((resid   28 and name HB2  )) ((resid   29 and name HN   ))   4.40  2.60  0.00 ! #SUP  4.05
assign  ((resid   29 and name HN   )) ((resid   30 and name HB1  ))   4.93  3.13  0.00 ! #SUP  4.65
assign  ((resid    8 and name HD1  )) ((resid   29 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.32
assign  ((resid   25 and name HG12 )) ((resid   29 and name HN   ))   5.50  3.70  0.00 ! #SUP  5.73
assign  ((resid   29 and name HN   )) ((resid   30 and name HB2  ))   4.81  3.01  0.00 ! #SUP  4.13
assign  ((resid   25 and name HD1* )) ((resid   29 and name HN   ))   5.50  3.70  0.00 ! #SUP  5.56
assign  ((resid   11 and name HN   )) ((resid   26 and name HB2  ))   5.14  3.34  0.00 ! #SUP  2.36
assign  ((resid   46 and name HG2  )) ((resid   51 and name HN   ))   5.50  3.70  0.00 ! #SUP  2.96
assign  ((resid   49 and name HA   )) ((resid   51 and name HN   ))   4.91  3.11  0.00 ! #SUP  5.27
assign  ((resid   46 and name HG1  )) ((resid   51 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.00
assign  ((resid   11 and name HN   )) ((resid   24 and name HA   ))   5.33  3.53  0.00 ! #SUP  4.52
assign  ((resid   10 and name HA   )) ((resid   11 and name HN   ))   3.41  1.61  0.00 ! #SUP  1.93
assign  ((resid   10 and name HB2  )) ((resid   11 and name HN   ))   4.07  2.27  0.00 ! #SUP  2.64
assign  ((resid   11 and name HN   )) ((resid   11 and name HG2  ))   5.50  3.70  0.00 ! #SUP  4.99
assign  ((resid   11 and name HN   )) ((resid   24 and name HG2* ))   5.17  3.37  0.00 ! #SUP  4.67
assign  ((resid   11 and name HN   )) ((resid   52 and name HG2* ))   5.38  3.58  0.00 ! #SUP  2.59
assign  ((resid   11 and name HN   )) ((resid   52 and name HD1* ))   5.37  3.57  0.00 ! #SUP  3.26
assign  ((resid   11 and name HN   )) ((resid   26 and name HA   ))   5.37  3.57  0.00 ! #SUP  1.00
assign  ((resid   34 and name HN   )) ((resid   35 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.50
assign  ((resid   34 and name HN   )) ((resid   35 and name HA2  ))   5.50  3.70  0.00 ! #SUP  3.75
assign  ((resid   33 and name HA   )) ((resid   34 and name HN   ))   3.60  1.80  0.00 ! #SUP  4.26
assign  ((resid   33 and name HB2  )) ((resid   34 and name HN   ))   4.14  2.34  0.00 ! #SUP  4.77
assign  ((resid   34 and name HN   )) ((resid   34 and name HB1  ))   4.16  2.36  0.00 ! #SUP  5.79
assign  ((resid   34 and name HN   )) ((resid   34 and name HB2  ))   4.09  2.29  0.00 ! #SUP  5.81
assign  ((resid   47 and name HN   )) ((resid   51 and name HN   ))   4.17  2.37  0.00 ! #SUP  6.26
assign  ((resid   51 and name HN   )) ((resid   52 and name HN   ))   3.43  1.63  0.00 ! #SUP  8.91
assign  ((resid   50 and name HN   )) ((resid   51 and name HN   ))   3.27  1.47  0.00 ! #SUP  7.48
assign  ((resid   48 and name HA   )) ((resid   51 and name HN   ))   4.37  2.57  0.00 ! #SUP  3.59
assign  ((resid   50 and name HG1  )) ((resid   51 and name HN   ))   4.34  2.54  0.00 ! #SUP  5.02
assign  ((resid   50 and name HB1  )) ((resid   51 and name HN   ))   3.76  1.96  0.00 ! #SUP  5.22
assign  ((resid   50 and name HB2  )) ((resid   51 and name HN   ))   3.91  2.11  0.00 ! #SUP  5.38
assign  ((resid   51 and name HN   )) ((resid   51 and name HB*  ))   3.21  1.41  0.00 ! #SUP  5.78
assign  ((resid   51 and name HN   )) ((resid   52 and name HG11 ))   5.50  3.70  0.00 ! #SUP  6.21
assign  ((resid   27 and name HD2* )) ((resid   51 and name HN   ))   4.90  3.10  0.00 ! #SUP  7.02
assign  ((resid   27 and name HD1* )) ((resid   51 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.15
assign  ((resid   30 and name HG   )) ((resid   59 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.18
assign  ((resid   58 and name HN   )) ((resid   59 and name HN   ))   3.72  1.92  0.00 ! #SUP  5.69
assign  ((resid   59 and name HN   )) ((resid   61 and name HN   ))   5.08  3.28  0.00 ! #SUP  5.57
assign  ((resid   59 and name HN   )) ((resid   60 and name HN   ))   3.44  1.64  0.00 ! #SUP  8.99
assign  ((resid   58 and name HD1  )) ((resid   59 and name HN   ))   5.21  3.41  0.00 ! #SUP  9.79
assign  ((resid   59 and name HN   )) ((resid   60 and name HA   ))   4.90  3.10  0.00 ! #SUP  6.80
assign  ((resid   55 and name HA2  )) ((resid   59 and name HN   ))   5.04  3.24  0.00 ! #SUP  4.00
assign  ((resid   58 and name HB1  )) ((resid   59 and name HN   ))   4.10  2.30  0.00 ! #SUP  6.16
assign  ((resid   58 and name HB2  )) ((resid   59 and name HN   ))   3.58  1.78  0.00 ! #SUP  6.16
assign  ((resid   59 and name HN   )) ((resid   59 and name HE2  ))   5.50  3.70  0.00 ! #SUP  8.58
assign  ((resid   59 and name HN   )) ((resid   59 and name HB2  ))   3.78  1.98  0.00 ! #SUP  8.80
assign  ((resid   59 and name HN   )) ((resid   59 and name HB1  ))   3.17  1.37  0.00 ! #SUP  7.61
assign  ((resid   59 and name HN   )) ((resid   59 and name HG2  ))   3.70  1.90  0.00 ! #SUP  9.68
assign  ((resid   59 and name HN   )) ((resid   59 and name HG1  ))   3.63  1.83  0.00 ! #SUP  9.53
assign  ((resid   59 and name HN   )) ((resid   61 and name HD1* ))   5.13  3.33  0.00 ! #SUP  4.63
assign  ((resid   30 and name HD2* )) ((resid   59 and name HN   ))   4.96  3.16  0.00 ! #SUP  6.93
assign  ((resid   39 and name HN   )) ((resid   41 and name HN   ))   4.73  2.93  0.00 ! #SUP  7.27
assign  ((resid   40 and name HN   )) ((resid   41 and name HN   ))   3.32  1.52  0.00 ! #SUP  7.71
assign  ((resid   39 and name HA   )) ((resid   41 and name HN   ))   4.79  2.99  0.00 ! #SUP  6.22
assign  ((resid   39 and name HB2  )) ((resid   41 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.94
assign  ((resid   38 and name HA   )) ((resid   41 and name HN   ))   4.62  2.82  0.00 ! #SUP  5.44
assign  ((resid   40 and name HB   )) ((resid   41 and name HN   ))   4.90  3.10  0.00 ! #SUP  5.93
assign  ((resid   41 and name HN   )) ((resid   42 and name HA2  ))   4.77  2.97  0.00 ! #SUP  2.33
assign  ((resid   41 and name HN   )) ((resid   54 and name HD2* ))   5.50  3.70  0.00 ! #SUP  6.37
assign  ((resid   41 and name HN   )) ((resid   54 and name HD1* ))   5.01  3.21  0.00 ! #SUP  6.86
assign  ((resid   40 and name HG1* )) ((resid   41 and name HN   ))   4.96  3.16  0.00 ! #SUP  7.07
assign  ((resid   40 and name HG2* )) ((resid   41 and name HN   ))   4.55  2.75  0.00 ! #SUP  8.06
assign  ((resid   71 and name HN   )) ((resid   72 and name HN   ))   4.98  3.18  0.00 ! #SUP  5.24
assign  ((resid   70 and name HA   )) ((resid   72 and name HN   ))   5.38  3.58  0.00 ! #SUP  1.60
assign  ((resid   66 and name HA   )) ((resid   72 and name HN   ))   5.20  3.40  0.00 ! #SUP  6.58
assign  ((resid   72 and name HN   )) ((resid   72 and name HD1* ))   5.50  3.70  0.00 ! #SUP  5.69
assign  ((resid   72 and name HN   )) ((resid   72 and name HD2* ))   5.47  3.67  0.00 ! #SUP  7.05
assign  ((resid   71 and name HB2  )) ((resid   72 and name HN   ))   5.40  3.60  0.00 ! #SUP  5.68
assign  ((resid    3 and name HN   )) ((resid   46 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.00
assign  ((resid    2 and name HA   )) ((resid    3 and name HN   ))   3.19  1.39  0.00 ! #SUP  5.20
assign  ((resid    3 and name HN   )) ((resid   44 and name HA2  ))   4.57  2.77  0.00 ! #SUP  2.64
assign  ((resid    3 and name HN   )) ((resid   44 and name HA1  ))   4.31  2.51  0.00 ! #SUP  2.29
assign  ((resid    2 and name HB2  )) ((resid    3 and name HN   ))   4.92  3.12  0.00 ! #SUP  3.03
assign  ((resid    3 and name HN   )) ((resid    3 and name HB   ))   3.18  1.38  0.00 ! #SUP  4.38
assign  ((resid    3 and name HN   )) ((resid    3 and name HG2* ))   3.75  1.95  0.00 ! #SUP  4.68
assign  ((resid    2 and name HB1  )) ((resid    3 and name HN   ))   5.29  3.49  0.00 ! #SUP  4.08
assign  ((resid   31 and name HN   )) ((resid   32 and name HN   ))   4.72  2.92  0.00 ! #SUP  4.91
assign  ((resid   28 and name HN   )) ((resid   31 and name HN   ))   5.18  3.38  0.00 ! #SUP  2.96
assign  ((resid   31 and name HN   )) ((resid   31 and name HD1  ))   5.02  3.22  0.00 ! #SUP  6.86
assign  ((resid   28 and name HA   )) ((resid   31 and name HN   ))   4.53  2.73  0.00 ! #SUP  2.96
assign  ((resid   31 and name HN   )) ((resid   31 and name HB1  ))   4.17  2.37  0.00 ! #SUP  6.19
assign  ((resid   31 and name HN   )) ((resid   31 and name HB2  ))   3.63  1.83  0.00 ! #SUP  6.79
assign  ((resid   30 and name HB1  )) ((resid   31 and name HN   ))   3.66  1.86  0.00 ! #SUP  7.62
assign  ((resid   30 and name HB2  )) ((resid   31 and name HN   ))   4.48  2.68  0.00 ! #SUP  6.31
assign  ((resid   30 and name HD2* )) ((resid   31 and name HN   ))   5.35  3.55  0.00 ! #SUP  5.60
assign  ((resid   64 and name HA   )) ((resid   67 and name HN   ))   5.28  3.48  0.00 ! #SUP  4.28
assign  ((resid   66 and name HB2  )) ((resid   67 and name HN   ))   5.50  3.70  0.00 ! #SUP  5.80
assign  ((resid   31 and name HN   )) ((resid   32 and name HA   ))   5.50  3.70  0.00 ! #SUP  3.99
assign  ((resid   65 and name HN   )) ((resid   67 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.96
assign  ((resid   64 and name HG1  )) ((resid   65 and name HN   ))   5.20  3.40  0.00 ! #SUP  3.63
assign  ((resid   61 and name HB1  )) ((resid   65 and name HN   ))   5.42  3.62  0.00 ! #SUP  2.52
assign  ((resid   65 and name HN   )) ((resid   71 and name HD2* ))   5.50  3.70  0.00 ! #SUP  3.59
assign  ((resid   20 and name HN   )) ((resid   21 and name HN   ))   4.84  3.04  0.00 ! #SUP  4.94
assign  ((resid   18 and name HA   )) ((resid   20 and name HN   ))   4.59  2.79  0.00 ! #SUP  1.22
assign  ((resid    2 and name HN   )) ((resid    5 and name HB1  ))   4.99  3.19  0.00 ! #SUP  2.14
assign  ((resid   19 and name HB2  )) ((resid   20 and name HN   ))   5.49  3.69  0.00 ! #SUP  2.66
assign  ((resid   15 and name HB1  )) ((resid   20 and name HN   ))   5.47  3.67  0.00 ! #SUP  4.23
assign  ((resid   15 and name HG2  )) ((resid   20 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.22
assign  ((resid   15 and name HB2  )) ((resid   20 and name HN   ))   5.29  3.49  0.00 ! #SUP  3.42
assign  ((resid   20 and name HN   )) ((resid   20 and name HB1  ))   3.17  1.37  0.00 ! #SUP  4.40
assign  ((resid   20 and name HN   )) ((resid   20 and name HD2* ))   4.87  3.07  0.00 ! #SUP  6.07
assign  ((resid   67 and name HN   )) ((resid   67 and name HB   ))   4.14  2.34  0.00 ! #SUP  5.55
assign  ((resid   67 and name HN   )) ((resid   67 and name HG1* ))   4.33  2.53  0.00 ! #SUP  7.99
assign  ((resid   67 and name HN   )) ((resid   67 and name HG2* ))   5.34  3.54  0.00 ! #SUP  6.17
assign  ((resid   64 and name HN   )) ((resid   65 and name HN   ))   3.50  1.70  0.00 ! #SUP  5.63
assign  ((resid   64 and name HA   )) ((resid   65 and name HN   ))   3.63  1.83  0.00 ! #SUP  4.94
assign  ((resid   62 and name HA   )) ((resid   65 and name HN   ))   4.74  2.94  0.00 ! #SUP  2.83
assign  ((resid   64 and name HB1  )) ((resid   65 and name HN   ))   3.67  1.87  0.00 ! #SUP  4.61
assign  ((resid   65 and name HN   )) ((resid   65 and name HB*  ))   3.45  1.65  0.00 ! #SUP  4.10
assign  ((resid   56 and name HD2* )) ((resid   65 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.75
assign  ((resid   65 and name HB*  )) ((resid   67 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.12
assign  ((resid   14 and name HN   )) ((resid   70 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.27
assign  ((resid   13 and name HA   )) ((resid   14 and name HN   ))   3.60  1.80  0.00 ! #SUP  4.25
assign  ((resid   14 and name HN   )) ((resid   15 and name HD2  ))   5.50  3.70  0.00 ! #SUP  5.07
assign  ((resid   14 and name HN   )) ((resid   70 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.99
assign  ((resid   13 and name HB1  )) ((resid   14 and name HN   ))   4.77  2.97  0.00 ! #SUP  4.21
assign  ((resid   14 and name HN   )) ((resid   14 and name HB1  ))   3.86  2.06  0.00 ! #SUP  4.90
assign  ((resid   47 and name HB1  )) ((resid   48 and name HN   ))   4.10  2.30  0.00 ! #SUP  6.64
assign  ((resid   47 and name HB2  )) ((resid   48 and name HN   ))   4.55  2.75  0.00 ! #SUP  4.56
assign  ((resid   46 and name HG2  )) ((resid   48 and name HN   ))   3.75  1.95  0.00 ! #SUP  3.55
assign  ((resid   48 and name HN   )) ((resid   49 and name HB1  ))   5.39  3.59  0.00 ! #SUP  3.02
assign  ((resid   65 and name HN   )) ((resid   66 and name HN   ))   3.64  1.84  0.00 ! #SUP  5.37
assign  ((resid   66 and name HN   )) ((resid   68 and name HN   ))   5.32  3.52  0.00 ! #SUP  4.43
assign  ((resid   66 and name HN   )) ((resid   67 and name HN   ))   3.67  1.87  0.00 ! #SUP  7.34
assign  ((resid   64 and name HA   )) ((resid   66 and name HN   ))   4.34  2.54  0.00 ! #SUP  4.70
assign  ((resid   62 and name HA   )) ((resid   66 and name HN   ))   5.20  3.40  0.00 ! #SUP  1.50
assign  ((resid   66 and name HN   )) ((resid   66 and name HD1  ))   5.00  3.20  0.00 ! #SUP  5.47
assign  ((resid   66 and name HN   )) ((resid   66 and name HB2  ))   3.49  1.69  0.00 ! #SUP  5.49
assign  ((resid   65 and name HB*  )) ((resid   66 and name HN   ))   3.63  1.83  0.00 ! #SUP  5.72
assign  ((resid   66 and name HN   )) ((resid   66 and name HB1  ))   3.59  1.79  0.00 ! #SUP  6.05
assign  ((resid   66 and name HN   )) ((resid   67 and name HG1* ))   5.31  3.51  0.00 ! #SUP  6.30
assign  ((resid   66 and name HN   )) ((resid   71 and name HD2* ))   4.52  2.72  0.00 ! #SUP  5.23
assign  ((resid   30 and name HD2* )) ((resid   58 and name HE1  ))   5.40  3.60  0.00 ! #SUP  4.88
assign  ((resid   31 and name HD1  )) ((resid   37 and name HA   ))   5.21  3.41  0.00 ! #SUP  0.98
assign  ((resid   57 and name HG2  )) ((resid   62 and name HD1  ))   5.46  3.66  0.00 ! #SUP  2.04
assign  ((resid   62 and name HD1  )) ((resid   65 and name HB*  ))   5.50  3.70  0.00 ! #SUP  2.18
assign  ((resid   62 and name HD1  )) ((resid   71 and name HD2* ))   5.07  3.27  0.00 ! #SUP  1.35
assign  ((resid   53 and name HB1  )) ((resid   62 and name HE1  ))   5.38  3.58  0.00 ! #SUP  3.00
assign  ((resid   53 and name HA   )) ((resid   62 and name HE1  ))   5.50  3.70  0.00 ! #SUP  2.49
assign  ((resid   53 and name HD2* )) ((resid   62 and name HE1  ))   4.04  2.24  0.00 ! #SUP  4.46
assign  ((resid   58 and name HE1  )) ((resid   59 and name HE2  ))   4.64  2.84  0.00 ! #SUP  4.72
assign  ((resid   58 and name HE1  )) ((resid   59 and name HD1  ))   5.32  3.52  0.00 ! #SUP  5.52
assign  ((resid    3 and name HG1* )) ((resid    4 and name HE3  ))   5.47  3.67  0.00 ! #SUP  3.85
assign  ((resid    4 and name HE3  )) ((resid   38 and name HD1* ))   4.75  2.95  0.00 ! #SUP  2.00
assign  ((resid    4 and name HE3  )) ((resid   37 and name HE1  ))   4.63  2.83  0.00 ! #SUP  1.91
assign  ((resid    4 and name HZ3  )) ((resid   38 and name HG11 ))   5.46  3.66  0.00 ! #SUP  0.86
assign  ((resid    4 and name HZ3  )) ((resid   38 and name HD1* ))   5.36  3.56  0.00 ! #SUP  2.47
assign  ((resid   58 and name HA   )) ((resid   58 and name HD1  ))   4.44  2.64  0.00 ! #SUP  6.18
assign  ((resid   58 and name HD1  )) ((resid   59 and name HG2  ))   4.92  3.12  0.00 ! #SUP  8.37
assign  ((resid   58 and name HD1  )) ((resid   59 and name HD1  ))   4.71  2.91  0.00 ! #SUP  8.86
assign  ((resid   30 and name HD2* )) ((resid   58 and name HD1  ))   4.88  3.08  0.00 ! #SUP  6.13
assign  ((resid   20 and name HD1* )) ((resid   69 and name HD1  ))   5.50  3.70  0.00 ! #SUP  1.82
assign  ((resid   64 and name HA   )) ((resid   67 and name HB   ))   4.64  2.84  0.00 ! #SUP  0.02
assign  ((resid   11 and name HG2  )) ((resid   52 and name HG2* ))   5.50  3.70  0.00 ! #SUP  3.22
assign  ((resid   11 and name HG1  )) ((resid   52 and name HG2* ))   5.50  3.70  0.00 ! #SUP  3.16
assign  ((resid   11 and name HG2  )) ((resid   52 and name HD1* ))   5.50  3.70  0.00 ! #SUP  3.87
assign  ((resid   11 and name HG1  )) ((resid   52 and name HD1* ))   5.50  3.70  0.00 ! #SUP  3.25
assign  ((resid   25 and name HD1* )) ((resid   29 and name HB1  ))   4.37  2.57  0.00 ! #SUP  4.55
assign  ((resid    3 and name HB   )) ((resid   46 and name HB2  ))   5.16  3.36  0.00 ! #SUP  2.49
assign  ((resid   47 and name HA   )) ((resid   48 and name HB1  ))   4.47  2.67  0.00 ! #SUP  2.39
assign  ((resid   59 and name HB1  )) ((resid   61 and name HD1* ))   5.26  3.46  0.00 ! #SUP  5.64
assign  ((resid   12 and name HB   )) ((resid   24 and name HG2* ))   5.50  3.70  0.00 ! #SUP  3.33
assign  ((resid   59 and name HB2  )) ((resid   59 and name HD1  ))   4.13  2.33  0.00 ! #SUP  8.35
assign  ((resid   30 and name HD2* )) ((resid   59 and name HB2  ))   5.50  3.70  0.00 ! #SUP  4.23
assign  ((resid   13 and name HE1  )) ((resid   52 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.75
assign  ((resid   26 and name HA   )) ((resid   52 and name HD1* ))   5.10  3.30  0.00 ! #SUP  3.44
assign  ((resid   27 and name HA   )) ((resid   52 and name HD1* ))   5.03  3.23  0.00 ! #SUP  4.43
assign  ((resid   27 and name HG   )) ((resid   52 and name HD1* ))   4.82  3.02  0.00 ! #SUP  4.43
assign  ((resid   27 and name HD2* )) ((resid   52 and name HD1* ))   4.19  2.39  0.00 ! #SUP  9.75
assign  ((resid   52 and name HG2* )) ((resid   52 and name HD1* ))   3.81  2.01  0.00 ! #SUP  6.67
assign  ((resid   27 and name HD1* )) ((resid   52 and name HD1* ))   5.00  3.20  0.00 ! #SUP  6.38
assign  ((resid   15 and name HD2  )) ((resid   22 and name HB1  ))   3.95  2.15  0.00 ! #SUP  7.15
assign  ((resid   15 and name HD2  )) ((resid   22 and name HD2  ))   5.00  3.20  0.00 ! #SUP  7.11
assign  ((resid   14 and name HG2  )) ((resid   15 and name HD2  ))   5.13  3.33  0.00 ! #SUP  6.07
assign  ((resid   15 and name HD2  )) ((resid   22 and name HG2  ))   3.94  2.14  0.00 ! #SUP  7.70
assign  ((resid   54 and name HA   )) ((resid   55 and name HA2  ))   5.45  3.65  0.00 ! #SUP  4.02
assign  ((resid   30 and name HB1  )) ((resid   55 and name HA2  ))   4.84  3.04  0.00 ! #SUP  3.87
assign  ((resid   30 and name HG   )) ((resid   55 and name HA2  ))   3.79  1.99  0.00 ! #SUP  3.87
assign  ((resid   30 and name HD2* )) ((resid   55 and name HA2  ))   5.50  3.70  0.00 ! #SUP  4.97
assign  ((resid   55 and name HA2  )) ((resid   58 and name HD1  ))   4.97  3.17  0.00 ! #SUP  2.49
assign  ((resid   55 and name HA2  )) ((resid   58 and name HB2  ))   4.13  2.33  0.00 ! #SUP  4.13
assign  ((resid   55 and name HA2  )) ((resid   59 and name HG1  ))   5.50  3.70  0.00 ! #SUP  1.80
assign  ((resid   54 and name HA   )) ((resid   55 and name HA1  ))   5.37  3.57  0.00 ! #SUP  4.02
assign  ((resid   30 and name HB1  )) ((resid   55 and name HA1  ))   4.75  2.95  0.00 ! #SUP  2.96
assign  ((resid   12 and name HG2* )) ((resid   15 and name HD1  ))   5.50  3.70  0.00 ! #SUP  1.66
assign  ((resid   14 and name HA   )) ((resid   15 and name HD2  ))   3.59  1.79  0.00 ! #SUP 10.00
assign  ((resid   55 and name HA1  )) ((resid   58 and name HB2  ))   4.58  2.78  0.00 ! #SUP  0.75
assign  ((resid   14 and name HB2  )) ((resid   15 and name HD1  ))   4.26  2.46  0.00 ! #SUP  6.15
assign  ((resid   15 and name HD1  )) ((resid   22 and name HG1  ))   4.29  2.49  0.00 ! #SUP  4.79
assign  ((resid   14 and name HA   )) ((resid   15 and name HD1  ))   3.59  1.79  0.00 ! #SUP  9.27
assign  ((resid   15 and name HD1  )) ((resid   22 and name HB1  ))   4.43  2.63  0.00 ! #SUP  6.58
assign  ((resid   15 and name HD1  )) ((resid   22 and name HD2  ))   5.31  3.51  0.00 ! #SUP  5.95
assign  ((resid   46 and name HG1  )) ((resid   50 and name HB1  ))   5.50  3.70  0.00 ! #SUP  2.96
assign  ((resid   46 and name HG1  )) ((resid   50 and name HB2  ))   5.50  3.70  0.00 ! #SUP  2.96
assign  ((resid   15 and name HD2  )) ((resid   22 and name HG1  ))   4.27  2.47  0.00 ! #SUP  5.92
assign  ((resid   49 and name HD2  )) ((resid   72 and name HD1* ))   5.50  3.70  0.00 ! #SUP  3.88
assign  ((resid   48 and name HD2  )) ((resid   49 and name HD2  ))   5.50  3.70  0.00 ! #SUP  5.27
assign  ((resid   49 and name HA   )) ((resid   49 and name HD2  ))   5.50  3.70  0.00 ! #SUP  6.76
assign  ((resid   48 and name HD2  )) ((resid   49 and name HD1  ))   5.50  3.70  0.00 ! #SUP  4.94
assign  ((resid   38 and name HD1* )) ((resid   43 and name HA   ))   4.45  2.65  0.00 ! #SUP  1.46
assign  ((resid   60 and name HA   )) ((resid   60 and name HD1  ))   5.46  3.66  0.00 ! #SUP  7.91
assign  ((resid   53 and name HD1* )) ((resid   66 and name HB2  ))   5.34  3.54  0.00 ! #SUP  2.11
assign  ((resid   16 and name HB2  )) ((resid   16 and name HD*  ))   3.99  2.19  0.00 ! #SUP  6.17
assign  ((resid   25 and name HG12 )) ((resid   29 and name HG2  ))   5.50  3.70  0.00 ! #SUP  2.90
assign  ((resid   25 and name HG2* )) ((resid   25 and name HG12 ))   4.20  2.40  0.00 ! #SUP  3.77
assign  ((resid   25 and name HG12 )) ((resid   30 and name HD2* ))   5.36  3.56  0.00 ! #SUP  3.95
assign  ((resid   25 and name HG12 )) ((resid   29 and name HB1  ))   5.50  3.70  0.00 ! #SUP  4.61
assign  ((resid   25 and name HG12 )) ((resid   30 and name HB2  ))   4.90  3.10  0.00 ! #SUP  4.50
assign  ((resid   66 and name HB1  )) ((resid   71 and name HD2* ))   5.50  3.70  0.00 ! #SUP  5.41
assign  ((resid   37 and name HD1  )) ((resid   38 and name HD1* ))   4.96  3.16  0.00 ! #SUP  6.72
assign  ((resid   37 and name HE1  )) ((resid   38 and name HD1* ))   5.24  3.44  0.00 ! #SUP  3.88
assign  ((resid   38 and name HG2* )) ((resid   38 and name HD1* ))   4.14  2.34  0.00 ! #SUP  6.95
assign  ((resid   16 and name HA   )) ((resid   16 and name HD*  ))   5.50  3.70  0.00 ! #SUP  5.88
assign  ((resid   66 and name HB2  )) ((resid   71 and name HD2* ))   5.50  3.70  0.00 ! #SUP  6.48
assign  ((resid   26 and name HA   )) ((resid   52 and name HG12 ))   5.50  3.70  0.00 ! #SUP  1.27
assign  ((resid   27 and name HD2* )) ((resid   52 and name HG12 ))   5.29  3.49  0.00 ! #SUP  6.03
assign  ((resid   27 and name HD2* )) ((resid   52 and name HG11 ))   5.08  3.28  0.00 ! #SUP  5.16
assign  ((resid   12 and name HG2* )) ((resid   14 and name HB1  ))   5.27  3.47  0.00 ! #SUP  2.41
assign  ((resid   14 and name HA   )) ((resid   22 and name HG2  ))   5.50  3.70  0.00 ! #SUP  5.43
assign  ((resid   21 and name HA   )) ((resid   22 and name HG1  ))   5.50  3.70  0.00 ! #SUP  3.06
assign  ((resid   58 and name HD1  )) ((resid   59 and name HD2  ))   5.50  3.70  0.00 ! #SUP  7.39
assign  ((resid    3 and name HB   )) ((resid   44 and name HA2  ))   4.52  2.72  0.00 ! #SUP  3.15
assign  ((resid   44 and name HA2  )) ((resid   45 and name HG1  ))   5.45  3.65  0.00 ! #SUP  3.95
assign  ((resid   43 and name HA   )) ((resid   44 and name HA2  ))   5.15  3.35  0.00 ! #SUP  4.25
assign  ((resid   43 and name HA   )) ((resid   44 and name HA1  ))   4.95  3.15  0.00 ! #SUP  3.34
assign  ((resid   43 and name HB2  )) ((resid   44 and name HA1  ))   4.71  2.91  0.00 ! #SUP  4.51
assign  ((resid   21 and name HA   )) ((resid   22 and name HG2  ))   5.50  3.70  0.00 ! #SUP  5.15
assign  ((resid   15 and name HD1  )) ((resid   22 and name HG2  ))   5.09  3.29  0.00 ! #SUP  6.52
assign  ((resid   30 and name HD2* )) ((resid   59 and name HD2  ))   5.46  3.66  0.00 ! #SUP  4.59
assign  ((resid   44 and name HA1  )) ((resid   45 and name HG1  ))   5.20  3.40  0.00 ! #SUP  3.95
assign  ((resid    8 and name HA   )) ((resid   26 and name HB1  ))   5.31  3.51  0.00 ! #SUP  0.75
assign  ((resid    9 and name HN   )) ((resid   26 and name HB2  ))   4.99  3.19  0.00 ! #SUP  1.38
assign  ((resid   10 and name HB2  )) ((resid   26 and name HB2  ))   3.89  2.09  0.00 ! #SUP  1.87
assign  ((resid   26 and name HB2  )) ((resid   27 and name HG   ))   5.50  3.70  0.00 ! #SUP  3.31
assign  ((resid    9 and name HN   )) ((resid   26 and name HB1  ))   5.46  3.66  0.00 ! #SUP  2.00
assign  ((resid   37 and name HD1  )) ((resid   38 and name HG12 ))   5.50  3.70  0.00 ! #SUP  6.42
assign  ((resid   14 and name HA   )) ((resid   15 and name HG2  ))   5.15  3.35  0.00 ! #SUP  7.16
assign  ((resid   14 and name HA   )) ((resid   15 and name HG1  ))   5.48  3.68  0.00 ! #SUP  6.82
assign  ((resid   13 and name HD1  )) ((resid   23 and name HG   ))   5.32  3.52  0.00 ! #SUP  1.50
assign  ((resid   23 and name HG   )) ((resid   25 and name HB   ))   5.50  3.70  0.00 ! #SUP  4.56
assign  ((resid   30 and name HG   )) ((resid   55 and name HA1  ))   4.02  2.22  0.00 ! #SUP  2.96
assign  ((resid   15 and name HG2  )) ((resid   18 and name HA   ))   5.36  3.56  0.00 ! #SUP  1.10
assign  ((resid   15 and name HG2  )) ((resid   20 and name HB1  ))   4.62  2.82  0.00 ! #SUP  4.22
assign  ((resid   15 and name HG1  )) ((resid   20 and name HB1  ))   4.69  2.89  0.00 ! #SUP  3.04
assign  ((resid   35 and name HA1  )) ((resid   38 and name HD1* ))   5.50  3.70  0.00 ! #SUP  3.99
assign  ((resid   35 and name HA1  )) ((resid   38 and name HG11 ))   5.36  3.56  0.00 ! #SUP  5.89
assign  ((resid   34 and name HB2  )) ((resid   35 and name HA1  ))   5.50  3.70  0.00 ! #SUP  3.67
assign  ((resid   35 and name HA2  )) ((resid   36 and name HA   ))   5.44  3.64  0.00 ! #SUP  3.43
assign  ((resid   35 and name HA2  )) ((resid   38 and name HB   ))   4.37  2.57  0.00 ! #SUP  4.75
assign  ((resid   35 and name HA2  )) ((resid   38 and name HG12 ))   5.15  3.35  0.00 ! #SUP  4.75
assign  ((resid   35 and name HA2  )) ((resid   38 and name HG2* ))   5.50  3.70  0.00 ! #SUP  3.00
assign  ((resid   35 and name HA2  )) ((resid   38 and name HG11 ))   5.50  3.70  0.00 ! #SUP  4.75
assign  ((resid   35 and name HA1  )) ((resid   38 and name HB   ))   4.08  2.28  0.00 ! #SUP  5.89
assign  ((resid   35 and name HA1  )) ((resid   38 and name HG12 ))   5.05  3.25  0.00 ! #SUP  6.47
assign  ((resid   54 and name HA   )) ((resid   54 and name HD1* ))   5.50  3.70  0.00 ! #SUP  8.33
assign  ((resid   53 and name HG   )) ((resid   54 and name HD1* ))   5.05  3.25  0.00 ! #SUP  6.24
assign  ((resid   66 and name HG2  )) ((resid   72 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.54
assign  ((resid   60 and name HA   )) ((resid   61 and name HG   ))   5.31  3.51  0.00 ! #SUP  4.62
assign  ((resid   54 and name HB1  )) ((resid   54 and name HD1* ))   4.23  2.43  0.00 ! #SUP  7.08
assign  ((resid   40 and name HG2* )) ((resid   54 and name HD1* ))   4.74  2.94  0.00 ! #SUP  6.10
assign  ((resid   56 and name HD1* )) ((resid   62 and name HD1  ))   4.88  3.08  0.00 ! #SUP  4.29
assign  ((resid   56 and name HA   )) ((resid   56 and name HD1* ))   4.44  2.64  0.00 ! #SUP  5.00
assign  ((resid   53 and name HA   )) ((resid   56 and name HD1* ))   4.07  2.27  0.00 ! #SUP  7.72
assign  ((resid   56 and name HD1* )) ((resid   62 and name HA   ))   5.06  3.26  0.00 ! #SUP  5.17
assign  ((resid   56 and name HB2  )) ((resid   56 and name HD1* ))   3.90  2.10  0.00 ! #SUP  5.26
assign  ((resid   53 and name HG   )) ((resid   56 and name HD1* ))   3.06  1.26  0.00 ! #SUP  6.54
assign  ((resid   56 and name HB1  )) ((resid   56 and name HD1* ))   4.08  2.28  0.00 ! #SUP  5.12
assign  ((resid   53 and name HD1* )) ((resid   56 and name HD1* ))   4.36  2.56  0.00 ! #SUP  4.87
assign  ((resid   53 and name HD2* )) ((resid   56 and name HD1* ))   3.74  1.94  0.00 ! #SUP  4.55
assign  ((resid   56 and name HD1* )) ((resid   71 and name HD2* ))   4.68  2.88  0.00 ! #SUP  0.75
assign  ((resid   43 and name HB2  )) ((resid   44 and name HA2  ))   5.50  3.70  0.00 ! #SUP  5.10
assign  ((resid   51 and name HA   )) ((resid   54 and name HD1* ))   5.03  3.23  0.00 ! #SUP  2.90
assign  ((resid   42 and name HA2  )) ((resid   54 and name HD1* ))   5.23  3.43  0.00 ! #SUP  2.67
assign  ((resid   53 and name HD2* )) ((resid   54 and name HD1* ))   4.05  2.25  0.00 ! #SUP  5.76
assign  ((resid   43 and name HB1  )) ((resid   44 and name HA2  ))   5.50  3.70  0.00 ! #SUP  4.74
assign  ((resid   16 and name HG2  )) ((resid   69 and name HN   ))   5.50  3.70  0.00 ! #SUP  5.90
assign  ((resid   53 and name HD1* )) ((resid   62 and name HE1  ))   5.50  3.70  0.00 ! #SUP  3.24
assign  ((resid   53 and name HD1* )) ((resid   66 and name HA   ))   4.44  2.64  0.00 ! #SUP  1.19
assign  ((resid   53 and name HB1  )) ((resid   53 and name HD1* ))   3.64  1.84  0.00 ! #SUP  4.74
assign  ((resid   53 and name HD1* )) ((resid   71 and name HB1  ))   3.77  1.97  0.00 ! #SUP  0.75
assign  ((resid   20 and name HB1  )) ((resid   20 and name HD1* ))   3.65  1.85  0.00 ! #SUP  3.76
assign  ((resid   71 and name HD2* )) ((resid   72 and name HD2* ))   5.01  3.21  0.00 ! #SUP  5.54
assign  ((resid   20 and name HD1* )) ((resid   68 and name HE1  ))   5.32  3.52  0.00 ! #SUP  4.17
assign  ((resid   15 and name HB2  )) ((resid   20 and name HD1* ))   5.35  3.55  0.00 ! #SUP  3.79
assign  ((resid   17 and name HB1  )) ((resid   20 and name HD1* ))   4.83  3.03  0.00 ! #SUP  2.46
assign  ((resid   16 and name HB1  )) ((resid   20 and name HD1* ))   5.19  3.39  0.00 ! #SUP  3.10
assign  ((resid   20 and name HD1* )) ((resid   68 and name HG2  ))   4.54  2.74  0.00 ! #SUP  4.27
assign  ((resid   20 and name HD1* )) ((resid   68 and name HB2  ))   4.84  3.04  0.00 ! #SUP  5.75
assign  ((resid   20 and name HD1* )) ((resid   68 and name HB1  ))   4.44  2.64  0.00 ! #SUP  5.72
assign  ((resid   20 and name HD1* )) ((resid   68 and name HG1  ))   4.08  2.28  0.00 ! #SUP  4.56
assign  ((resid    6 and name HB2  )) ((resid    6 and name HD1* ))   4.23  2.43  0.00 ! #SUP  4.78
assign  ((resid   62 and name HE1  )) ((resid   71 and name HD2* ))   5.22  3.42  0.00 ! #SUP  1.39
assign  ((resid    6 and name HB1  )) ((resid    6 and name HD1* ))   3.95  2.15  0.00 ! #SUP  3.97
assign  ((resid   61 and name HB1  )) ((resid   65 and name HB*  ))   4.55  2.75  0.00 ! #SUP  3.47
assign  ((resid   59 and name HB2  )) ((resid   61 and name HB2  ))   5.34  3.54  0.00 ! #SUP  3.31
assign  ((resid   59 and name HB2  )) ((resid   61 and name HD1* ))   4.77  2.97  0.00 ! #SUP  7.15
assign  ((resid   32 and name HB2  )) ((resid   33 and name HB1  ))   4.71  2.91  0.00 ! #SUP  2.43
assign  ((resid   61 and name HB2  )) ((resid   61 and name HD1* ))   3.27  1.47  0.00 ! #SUP  4.71
assign  ((resid   56 and name HB1  )) ((resid   61 and name HB1  ))   5.40  3.60  0.00 ! #SUP  8.11
assign  ((resid   61 and name HB1  )) ((resid   61 and name HD2* ))   3.91  2.11  0.00 ! #SUP  4.64
assign  ((resid   56 and name HD2* )) ((resid   61 and name HB1  ))   4.12  2.32  0.00 ! #SUP  6.71
assign  ((resid   60 and name HA   )) ((resid   60 and name HG1  ))   3.93  2.13  0.00 ! #SUP  7.70
assign  ((resid   59 and name HA   )) ((resid   60 and name HG2  ))   4.85  3.05  0.00 ! #SUP  5.90
assign  ((resid    8 and name HA   )) ((resid    8 and name HG2  ))   4.10  2.30  0.00 ! #SUP  6.75
assign  ((resid   13 and name HD1  )) ((resid   23 and name HD1* ))   4.34  2.54  0.00 ! #SUP  3.60
assign  ((resid   23 and name HA   )) ((resid   23 and name HD1* ))   5.45  3.65  0.00 ! #SUP  6.26
assign  ((resid   13 and name HB2  )) ((resid   23 and name HD1* ))   4.93  3.13  0.00 ! #SUP  5.99
assign  ((resid   23 and name HD1* )) ((resid   25 and name HB   ))   5.18  3.38  0.00 ! #SUP  3.35
assign  ((resid   48 and name HD2  )) ((resid   49 and name HG2  ))   5.21  3.41  0.00 ! #SUP  5.94
assign  ((resid   49 and name HG2  )) ((resid   72 and name HD1* ))   4.87  3.07  0.00 ! #SUP  6.88
assign  ((resid   46 and name HG2  )) ((resid   47 and name HB1  ))   5.50  3.70  0.00 ! #SUP  4.15
assign  ((resid   48 and name HD2  )) ((resid   49 and name HG1  ))   5.16  3.36  0.00 ! #SUP  5.95
assign  ((resid   49 and name HG2  )) ((resid   72 and name HD2* ))   5.50  3.70  0.00 ! #SUP  3.58
assign  ((resid   27 and name HA   )) ((resid   27 and name HD1* ))   5.06  3.26  0.00 ! #SUP  5.00
assign  ((resid   47 and name HB1  )) ((resid   49 and name HB1  ))   5.50  3.70  0.00 ! #SUP  3.02
assign  ((resid   47 and name HB2  )) ((resid   49 and name HN   ))   4.37  2.57  0.00 ! #SUP  3.67
assign  ((resid   59 and name HG2  )) ((resid   61 and name HD1* ))   3.91  2.11  0.00 ! #SUP  2.83
assign  ((resid   49 and name HG1  )) ((resid   72 and name HD1* ))   4.22  2.42  0.00 ! #SUP  5.18
assign  ((resid   58 and name HD1  )) ((resid   59 and name HG1  ))   5.30  3.50  0.00 ! #SUP  8.12
assign  ((resid   30 and name HD2* )) ((resid   59 and name HG1  ))   5.43  3.63  0.00 ! #SUP  5.11
assign  ((resid   30 and name HB2  )) ((resid   55 and name HA2  ))   5.18  3.38  0.00 ! #SUP  3.37
assign  ((resid    4 and name HA   )) ((resid   27 and name HD1* ))   4.94  3.14  0.00 ! #SUP  1.73
assign  ((resid    7 and name HA   )) ((resid   27 and name HD1* ))   4.58  2.78  0.00 ! #SUP  5.27
assign  ((resid    7 and name HB2  )) ((resid   27 and name HD1* ))   5.09  3.29  0.00 ! #SUP  7.26
assign  ((resid   27 and name HD1* )) ((resid   51 and name HB*  ))   4.34  2.54  0.00 ! #SUP  4.15
assign  ((resid   27 and name HB2  )) ((resid   27 and name HD1* ))   4.14  2.34  0.00 ! #SUP  5.00
assign  ((resid   27 and name HB1  )) ((resid   27 and name HD1* ))   4.08  2.28  0.00 ! #SUP  5.00
assign  ((resid   30 and name HB1  )) ((resid   31 and name HD1  ))   5.16  3.36  0.00 ! #SUP  4.22
assign  ((resid   41 and name HA1  )) ((resid   54 and name HD1* ))   5.01  3.21  0.00 ! #SUP  4.96
assign  ((resid   41 and name HA2  )) ((resid   54 and name HD2* ))   5.11  3.31  0.00 ! #SUP  4.90
assign  ((resid   41 and name HA2  )) ((resid   54 and name HD1* ))   5.21  3.41  0.00 ! #SUP  4.36
assign  ((resid   41 and name HA1  )) ((resid   54 and name HD2* ))   4.86  3.06  0.00 ! #SUP  5.38
assign  ((resid   40 and name HG2* )) ((resid   41 and name HA1  ))   5.50  3.70  0.00 ! #SUP  3.94
assign  ((resid    2 and name HA   )) ((resid    3 and name HA   ))   4.58  2.78  0.00 ! #SUP  4.13
assign  ((resid    3 and name HA   )) ((resid   51 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.75
assign  ((resid    3 and name HA   )) ((resid   46 and name HN   ))   5.03  3.23  0.00 ! #SUP  3.00
assign  ((resid    3 and name HA   )) ((resid    6 and name HB2  ))   4.01  2.21  0.00 ! #SUP  2.85
assign  ((resid    3 and name HA   )) ((resid    3 and name HG1* ))   3.16  1.36  0.00 ! #SUP  3.14
assign  ((resid   10 and name HB1  )) ((resid   24 and name HA   ))   5.34  3.54  0.00 ! #SUP  2.28
assign  ((resid   42 and name HA1  )) ((resid   54 and name HG   ))   5.26  3.46  0.00 ! #SUP  1.77
assign  ((resid   37 and name HE1  )) ((resid   42 and name HA1  ))   3.93  2.13  0.00 ! #SUP  2.96
assign  ((resid   42 and name HA1  )) ((resid   54 and name HD1* ))   4.01  2.21  0.00 ! #SUP  5.22
assign  ((resid   38 and name HD1* )) ((resid   42 and name HA1  ))   5.50  3.70  0.00 ! #SUP  5.27
assign  ((resid   42 and name HA1  )) ((resid   43 and name HB2  ))   5.50  3.70  0.00 ! #SUP  2.53
assign  ((resid   37 and name HD1  )) ((resid   42 and name HA1  ))   5.50  3.70  0.00 ! #SUP  2.95
assign  ((resid   37 and name HE1  )) ((resid   42 and name HA2  ))   4.05  2.25  0.00 ! #SUP  3.37
assign  ((resid   38 and name HA   )) ((resid   42 and name HA2  ))   4.25  2.45  0.00 ! #SUP  4.31
assign  ((resid   38 and name HD1* )) ((resid   42 and name HA2  ))   5.07  3.27  0.00 ! #SUP  6.31
assign  ((resid   37 and name HD1  )) ((resid   42 and name HA2  ))   5.50  3.70  0.00 ! #SUP  3.86
assign  ((resid   10 and name HB1  )) ((resid   24 and name HG2* ))   3.94  2.14  0.00 ! #SUP  3.02
assign  ((resid   42 and name HA1  )) ((resid   54 and name HD2* ))   5.44  3.64  0.00 ! #SUP  5.13
assign  ((resid   31 and name HA   )) ((resid   32 and name HB2  ))   5.24  3.44  0.00 ! #SUP  4.80
assign  ((resid   31 and name HB1  )) ((resid   36 and name HB1  ))   5.01  3.21  0.00 ! #SUP  4.27
assign  ((resid    2 and name HB1  )) ((resid    5 and name HB1  ))   5.50  3.70  0.00 ! #SUP  3.84
assign  ((resid    2 and name HB2  )) ((resid    5 and name HB1  ))   5.43  3.63  0.00 ! #SUP  3.49
assign  ((resid   27 and name HD2* )) ((resid   51 and name HA   ))   5.44  3.64  0.00 ! #SUP  3.63
assign  ((resid   27 and name HA   )) ((resid   27 and name HD2* ))   3.51  1.71  0.00 ! #SUP  4.99
assign  ((resid   27 and name HD2* )) ((resid   52 and name HB   ))   5.42  3.62  0.00 ! #SUP  4.65
assign  ((resid   27 and name HD2* )) ((resid   51 and name HB*  ))   3.89  2.09  0.00 ! #SUP  5.96
assign  ((resid   27 and name HB1  )) ((resid   27 and name HD2* ))   3.80  2.00  0.00 ! #SUP  4.99
assign  ((resid   31 and name HB1  )) ((resid   37 and name HN   ))   4.27  2.47  0.00 ! #SUP  2.25
assign  ((resid   31 and name HB1  )) ((resid   37 and name HB2  ))   5.04  3.24  0.00 ! #SUP  1.29
assign  ((resid   54 and name HB1  )) ((resid   54 and name HD2* ))   4.21  2.41  0.00 ! #SUP  6.00
assign  ((resid   27 and name HD2* )) ((resid   54 and name HD2* ))   3.09  1.29  0.00 ! #SUP  1.39
assign  ((resid   40 and name HG1* )) ((resid   54 and name HD2* ))   4.36  2.56  0.00 ! #SUP  3.70
assign  ((resid   40 and name HG2* )) ((resid   54 and name HD2* ))   4.53  2.73  0.00 ! #SUP  5.27
assign  ((resid   20 and name HD2* )) ((resid   68 and name HD2  ))   4.30  2.50  0.00 ! #SUP  2.79
assign  ((resid   20 and name HD2* )) ((resid   68 and name HB2  ))   4.01  2.21  0.00 ! #SUP  3.64
assign  ((resid   53 and name HB1  )) ((resid   53 and name HD2* ))   3.53  1.73  0.00 ! #SUP  5.34
assign  ((resid   53 and name HD2* )) ((resid   71 and name HB1  ))   3.89  2.09  0.00 ! #SUP  3.33
assign  ((resid   53 and name HD2* )) ((resid   62 and name HD1  ))   4.35  2.55  0.00 ! #SUP  0.75
assign  ((resid   53 and name HD2* )) ((resid   71 and name HD2* ))   4.20  2.40  0.00 ! #SUP  1.69
assign  ((resid   31 and name HB1  )) ((resid   36 and name HB2  ))   5.50  3.70  0.00 ! #SUP  3.21
assign  ((resid   15 and name HB1  )) ((resid   20 and name HB2  ))   4.46  2.66  0.00 ! #SUP  3.52
assign  ((resid   20 and name HA   )) ((resid   20 and name HD2* ))   3.61  1.81  0.00 ! #SUP  4.95
assign  ((resid   17 and name HD*  )) ((resid   20 and name HD2* ))   4.53  2.73  0.00 ! #SUP  2.11
assign  ((resid   20 and name HD2* )) ((resid   68 and name HB1  ))   4.59  2.79  0.00 ! #SUP  3.53
assign  ((resid   66 and name HG1  )) ((resid   67 and name HA   ))   5.50  3.70  0.00 ! #SUP  4.50
assign  ((resid    2 and name HA   )) ((resid   45 and name HD2  ))   5.39  3.59  0.00 ! #SUP  0.99
assign  ((resid    2 and name HA   )) ((resid   45 and name HD1  ))   5.50  3.70  0.00 ! #SUP  1.55
assign  ((resid   57 and name HB2  )) ((resid   57 and name HD1  ))   4.07  2.27  0.00 ! #SUP  3.42
assign  ((resid   62 and name HE1  )) ((resid   66 and name HD1  ))   4.02  2.22  0.00 ! #SUP  1.57
assign  ((resid   66 and name HA   )) ((resid   66 and name HD2  ))   4.66  2.86  0.00 ! #SUP  5.95
assign  ((resid   66 and name HB1  )) ((resid   66 and name HD1  ))   4.01  2.21  0.00 ! #SUP  6.70
assign  ((resid   66 and name HD1  )) ((resid   71 and name HD2* ))   5.50  3.70  0.00 ! #SUP  6.12
assign  ((resid   66 and name HD2  )) ((resid   72 and name HN   ))   5.50  3.70  0.00 ! #SUP  5.01
assign  ((resid   20 and name HB2  )) ((resid   69 and name HE1  ))   5.50  3.70  0.00 ! #SUP  0.54
assign  ((resid   17 and name HA   )) ((resid   20 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.49
assign  ((resid   67 and name HA   )) ((resid   67 and name HG1* ))   3.64  1.84  0.00 ! #SUP  6.42
assign  ((resid   67 and name HA   )) ((resid   67 and name HG2* ))   3.75  1.95  0.00 ! #SUP  4.88
assign  ((resid   27 and name HA   )) ((resid   52 and name HA   ))   5.25  3.45  0.00 ! #SUP  3.87
assign  ((resid   51 and name HB*  )) ((resid   52 and name HA   ))   5.50  3.70  0.00 ! #SUP  5.58
assign  ((resid   27 and name HG   )) ((resid   52 and name HA   ))   5.50  3.70  0.00 ! #SUP  3.87
assign  ((resid   45 and name HA   )) ((resid   45 and name HD2  ))   5.03  3.23  0.00 ! #SUP  6.31
assign  ((resid   45 and name HB2  )) ((resid   45 and name HD2  ))   4.10  2.30  0.00 ! #SUP  6.31
assign  ((resid   45 and name HB2  )) ((resid   45 and name HD1  ))   4.17  2.37  0.00 ! #SUP  5.31
assign  ((resid   45 and name HA   )) ((resid   45 and name HD1  ))   5.02  3.22  0.00 ! #SUP  6.28
assign  ((resid   23 and name HD2* )) ((resid   25 and name HB   ))   4.80  3.00  0.00 ! #SUP  5.62
assign  ((resid   56 and name HA   )) ((resid   56 and name HD2* ))   3.39  1.59  0.00 ! #SUP  4.44
assign  ((resid   53 and name HA   )) ((resid   56 and name HD2* ))   5.39  3.59  0.00 ! #SUP  4.64
assign  ((resid   56 and name HD2* )) ((resid   65 and name HB*  ))   5.20  3.40  0.00 ! #SUP  2.00
assign  ((resid   53 and name HD1* )) ((resid   56 and name HD2* ))   4.46  2.66  0.00 ! #SUP  2.14
assign  ((resid   56 and name HD2* )) ((resid   61 and name HD2* ))   3.75  1.95  0.00 ! #SUP  4.69
assign  ((resid   56 and name HD2* )) ((resid   71 and name HD2* ))   4.30  2.50  0.00 ! #SUP  0.75
assign  ((resid   51 and name HN   )) ((resid   52 and name HA   ))   5.50  3.70  0.00 ! #SUP  6.79
assign  ((resid   52 and name HA   )) ((resid   52 and name HG11 ))   4.08  2.28  0.00 ! #SUP  7.31
assign  ((resid   27 and name HD2* )) ((resid   52 and name HA   ))   3.58  1.78  0.00 ! #SUP 10.00
assign  ((resid   52 and name HA   )) ((resid   52 and name HG2* ))   3.69  1.89  0.00 ! #SUP  7.39
assign  ((resid   52 and name HA   )) ((resid   52 and name HD1* ))   3.86  2.06  0.00 ! #SUP  6.60
assign  ((resid   27 and name HD1* )) ((resid   52 and name HA   ))   5.50  3.70  0.00 ! #SUP  6.98
assign  ((resid   72 and name HA   )) ((resid   72 and name HD2* ))   3.69  1.89  0.00 ! #SUP  6.56
assign  ((resid   66 and name HA   )) ((resid   72 and name HD2* ))   4.59  2.79  0.00 ! #SUP  4.49
assign  ((resid   66 and name HG2  )) ((resid   72 and name HD2* ))   4.13  2.33  0.00 ! #SUP  2.76
assign  ((resid   72 and name HB1  )) ((resid   72 and name HD2* ))   4.06  2.26  0.00 ! #SUP  5.24
assign  ((resid    5 and name HB1  )) ((resid    6 and name HB2  ))   5.50  3.70  0.00 ! #SUP  5.05
assign  ((resid    2 and name HA   )) ((resid    5 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   23 and name HA   )) ((resid   23 and name HD2* ))   3.53  1.73  0.00 ! #SUP  6.23
assign  ((resid   23 and name HD2* )) ((resid   25 and name HG2* ))   3.95  2.15  0.00 ! #SUP  1.82
assign  ((resid   23 and name HB1  )) ((resid   23 and name HD2* ))   4.21  2.41  0.00 ! #SUP  5.98
assign  ((resid   60 and name HB2  )) ((resid   60 and name HE1  ))   5.27  3.47  0.00 ! #SUP  6.95
assign  ((resid    3 and name HG1* )) ((resid   44 and name HA1  ))   3.62  1.82  0.00 ! #SUP  1.28
assign  ((resid    3 and name HG1* )) ((resid   27 and name HD1* ))   4.91  3.11  0.00 ! #SUP  1.68
assign  ((resid    3 and name HG1* )) ((resid   45 and name HD1  ))   5.48  3.68  0.00 ! #SUP  0.93
assign  ((resid    3 and name HG1* )) ((resid   46 and name HG2  ))   5.06  3.26  0.00 ! #SUP  0.24
assign  ((resid   30 and name HD2* )) ((resid   55 and name HA1  ))   5.03  3.23  0.00 ! #SUP  4.00
assign  ((resid   30 and name HB1  )) ((resid   30 and name HD2* ))   3.41  1.61  0.00 ! #SUP  5.15
assign  ((resid   30 and name HD2* )) ((resid   59 and name HG2  ))   4.01  2.21  0.00 ! #SUP  5.05
assign  ((resid   30 and name HB2  )) ((resid   30 and name HD2* ))   3.22  1.42  0.00 ! #SUP  4.58
assign  ((resid   25 and name HG2* )) ((resid   30 and name HD2* ))   4.16  2.36  0.00 ! #SUP  2.53
assign  ((resid    6 and name HA   )) ((resid    6 and name HD2* ))   3.32  1.52  0.00 ! #SUP  4.77
assign  ((resid    5 and name HB1  )) ((resid    6 and name HD2* ))   4.50  2.70  0.00 ! #SUP  4.39
assign  ((resid    6 and name HB2  )) ((resid    6 and name HD2* ))   3.29  1.49  0.00 ! #SUP  6.39
assign  ((resid    6 and name HB1  )) ((resid    6 and name HD2* ))   3.61  1.81  0.00 ! #SUP  5.25
assign  ((resid   15 and name HA   )) ((resid   69 and name HB2  ))   5.50  3.70  0.00 ! #SUP  2.25
assign  ((resid   60 and name HB1  )) ((resid   60 and name HE1  ))   5.27  3.47  0.00 ! #SUP  6.65
assign  ((resid   60 and name HA   )) ((resid   60 and name HE2  ))   5.20  3.40  0.00 ! #SUP  7.40
assign  ((resid   60 and name HB2  )) ((resid   60 and name HE2  ))   5.45  3.65  0.00 ! #SUP  6.05
assign  ((resid   14 and name HB1  )) ((resid   70 and name HB1  ))   5.39  3.59  0.00 ! #SUP  0.75
assign  ((resid   14 and name HB1  )) ((resid   70 and name HB2  ))   5.35  3.55  0.00 ! #SUP  2.00
assign  ((resid   16 and name HB1  )) ((resid   17 and name HE1  ))   4.54  2.74  0.00 ! #SUP  2.94
assign  ((resid   49 and name HE*  )) ((resid   72 and name HD1* ))   5.00  3.20  0.00 ! #SUP  4.86
assign  ((resid   49 and name HE*  )) ((resid   72 and name HD2* ))   5.50  3.70  0.00 ! #SUP  3.08
assign  ((resid   10 and name HB2  )) ((resid   24 and name HG2* ))   3.62  1.82  0.00 ! #SUP  4.88
assign  ((resid   24 and name HG2* )) ((resid   25 and name HB   ))   5.50  3.70  0.00 ! #SUP  5.70
assign  ((resid   11 and name HG1  )) ((resid   24 and name HG2* ))   5.50  3.70  0.00 ! #SUP  2.94
assign  ((resid   12 and name HG2* )) ((resid   14 and name HN   ))   4.61  2.81  0.00 ! #SUP  3.62
assign  ((resid   12 and name HG2* )) ((resid   24 and name HA   ))   5.07  3.27  0.00 ! #SUP  4.25
assign  ((resid   12 and name HG2* )) ((resid   22 and name HB1  ))   3.86  2.06  0.00 ! #SUP  4.74
assign  ((resid   12 and name HG2* )) ((resid   22 and name HG2  ))   4.88  3.08  0.00 ! #SUP  2.95
assign  ((resid   12 and name HG2* )) ((resid   22 and name HG1  ))   4.99  3.19  0.00 ! #SUP  2.49
assign  ((resid   12 and name HG2* )) ((resid   22 and name HB2  ))   3.75  1.95  0.00 ! #SUP  4.72
assign  ((resid   59 and name HB2  )) ((resid   61 and name HD2* ))   4.78  2.98  0.00 ! #SUP  7.68
assign  ((resid   59 and name HB1  )) ((resid   61 and name HD2* ))   4.73  2.93  0.00 ! #SUP  5.56
assign  ((resid   59 and name HG1  )) ((resid   61 and name HD2* ))   4.98  3.18  0.00 ! #SUP  2.91
assign  ((resid   61 and name HD2* )) ((resid   65 and name HB*  ))   5.18  3.38  0.00 ! #SUP  2.27
assign  ((resid   56 and name HB1  )) ((resid   62 and name HA   ))   4.42  2.62  0.00 ! #SUP  8.28
assign  ((resid   62 and name HA   )) ((resid   62 and name HD1  ))   4.42  2.62  0.00 ! #SUP  3.85
assign  ((resid   62 and name HA   )) ((resid   62 and name HE1  ))   5.50  3.70  0.00 ! #SUP  2.20
assign  ((resid   56 and name HB2  )) ((resid   62 and name HA   ))   5.09  3.29  0.00 ! #SUP  5.22
assign  ((resid   56 and name HD2* )) ((resid   62 and name HA   ))   5.50  3.70  0.00 ! #SUP  4.82
assign  ((resid   48 and name HD2  )) ((resid   49 and name HE*  ))   4.69  2.89  0.00 ! #SUP  4.62
assign  ((resid   58 and name HD1  )) ((resid   59 and name HE2  ))   4.87  3.07  0.00 ! #SUP  8.11
assign  ((resid    8 and name HA   )) ((resid    8 and name HE2  ))   5.50  3.70  0.00 ! #SUP  4.73
assign  ((resid   30 and name HD2* )) ((resid   59 and name HE2  ))   4.94  3.14  0.00 ! #SUP  7.07
assign  ((resid   16 and name HE1  )) ((resid   69 and name HA   ))   5.50  3.70  0.00 ! #SUP  3.76
assign  ((resid   16 and name HE1  )) ((resid   70 and name HB2  ))   5.04  3.24  0.00 ! #SUP  4.33
assign  ((resid   16 and name HB2  )) ((resid   16 and name HE2  ))   4.66  2.86  0.00 ! #SUP  6.87
assign  ((resid   16 and name HG1  )) ((resid   16 and name HE2  ))   3.88  2.08  0.00 ! #SUP  6.70
assign  ((resid   16 and name HG2  )) ((resid   16 and name HE1  ))   3.82  2.02  0.00 ! #SUP  6.07
assign  ((resid   16 and name HE1  )) ((resid   70 and name HA   ))   3.89  2.09  0.00 ! #SUP  2.97
assign  ((resid   16 and name HD*  )) ((resid   70 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.92
assign  ((resid   57 and name HA   )) ((resid   62 and name HA   ))   5.16  3.36  0.00 ! #SUP  4.10
assign  ((resid   62 and name HA   )) ((resid   65 and name HB*  ))   4.46  2.66  0.00 ! #SUP  4.13
assign  ((resid   58 and name HE1  )) ((resid   59 and name HE1  ))   4.48  2.68  0.00 ! #SUP  4.72
assign  ((resid   56 and name HB1  )) ((resid   62 and name HB1  ))   4.82  3.02  0.00 ! #SUP  4.31
assign  ((resid   56 and name HB1  )) ((resid   62 and name HD1  ))   5.14  3.34  0.00 ! #SUP  6.59
assign  ((resid   56 and name HB1  )) ((resid   61 and name HD2* ))   4.70  2.90  0.00 ! #SUP  6.87
assign  ((resid   38 and name HB   )) ((resid   39 and name HA   ))   5.41  3.61  0.00 ! #SUP  5.43
assign  ((resid   39 and name HA   )) ((resid   40 and name HG1* ))   5.50  3.70  0.00 ! #SUP  6.74
assign  ((resid   56 and name HB2  )) ((resid   62 and name HD1  ))   5.14  3.34  0.00 ! #SUP  4.32
assign  ((resid   53 and name HG   )) ((resid   56 and name HB2  ))   4.74  2.94  0.00 ! #SUP  2.51
assign  ((resid   38 and name HG2* )) ((resid   39 and name HA   ))   4.76  2.96  0.00 ! #SUP  7.16
assign  ((resid   51 and name HA   )) ((resid   54 and name HB1  ))   4.54  2.74  0.00 ! #SUP  1.74
assign  ((resid    7 and name HA   )) ((resid   27 and name HB2  ))   4.45  2.65  0.00 ! #SUP  4.00
assign  ((resid   13 and name HD1  )) ((resid   24 and name HA   ))   5.50  3.70  0.00 ! #SUP  3.83
assign  ((resid   27 and name HD2* )) ((resid   54 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.36
assign  ((resid   66 and name HB1  )) ((resid   67 and name HG1* ))   4.33  2.53  0.00 ! #SUP  6.32
assign  ((resid    3 and name HG2* )) ((resid   27 and name HD1* ))   5.34  3.54  0.00 ! #SUP  2.88
assign  ((resid    3 and name HG2* )) ((resid   37 and name HE1  ))   4.34  2.54  0.00 ! #SUP  1.40
assign  ((resid    3 and name HG2* )) ((resid   46 and name HA   ))   4.34  2.54  0.00 ! #SUP  2.25
assign  ((resid    3 and name HG2* )) ((resid    4 and name HA   ))   5.47  3.67  0.00 ! #SUP  4.34
assign  ((resid    3 and name HG2* )) ((resid   46 and name HB2  ))   4.63  2.83  0.00 ! #SUP  3.64
assign  ((resid    3 and name HG2* )) ((resid   51 and name HB*  ))   4.13  2.33  0.00 ! #SUP  0.64
assign  ((resid    3 and name HG2* )) ((resid    6 and name HB2  ))   5.48  3.68  0.00 ! #SUP  1.75
assign  ((resid    3 and name HG2* )) ((resid   42 and name HA2  ))   4.66  2.86  0.00 ! #SUP  1.07
assign  ((resid   24 and name HA   )) ((resid   24 and name HG2* ))   3.87  2.07  0.00 ! #SUP  5.07
assign  ((resid   24 and name HA   )) ((resid   25 and name HG2* ))   5.21  3.41  0.00 ! #SUP  4.93
assign  ((resid   24 and name HA   )) ((resid   25 and name HA   ))   4.97  3.17  0.00 ! #SUP  4.82
assign  ((resid   10 and name HB2  )) ((resid   24 and name HA   ))   5.50  3.70  0.00 ! #SUP  4.30
assign  ((resid   37 and name HD1  )) ((resid   38 and name HA   ))   5.26  3.46  0.00 ! #SUP  5.74
assign  ((resid   38 and name HA   )) ((resid   38 and name HG2* ))   3.61  1.81  0.00 ! #SUP  6.63
assign  ((resid   38 and name HA   )) ((resid   38 and name HD1* ))   3.71  1.91  0.00 ! #SUP  7.31
assign  ((resid   15 and name HA   )) ((resid   69 and name HB1  ))   5.50  3.70  0.00 ! #SUP  2.68
assign  ((resid   66 and name HN   )) ((resid   69 and name HB1  ))   5.43  3.63  0.00 ! #SUP  0.23
assign  ((resid   68 and name HB1  )) ((resid   69 and name HB1  ))   5.50  3.70  0.00 ! #SUP  3.73
assign  ((resid    7 and name HB2  )) ((resid   28 and name HB1  ))   5.20  3.40  0.00 ! #SUP  4.63
assign  ((resid    8 and name HG2  )) ((resid   28 and name HB1  ))   5.05  3.25  0.00 ! #SUP  4.63
assign  ((resid    8 and name HA   )) ((resid   28 and name HB1  ))   4.80  3.00  0.00 ! #SUP  5.37
assign  ((resid    8 and name HD1  )) ((resid   28 and name HB1  ))   5.42  3.62  0.00 ! #SUP  5.00
assign  ((resid    8 and name HA   )) ((resid   28 and name HB2  ))   4.98  3.18  0.00 ! #SUP  4.51
assign  ((resid   26 and name HB1  )) ((resid   28 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.50
assign  ((resid    8 and name HG2  )) ((resid   28 and name HB2  ))   4.83  3.03  0.00 ! #SUP  3.71
assign  ((resid    6 and name HA   )) ((resid    9 and name HG2* ))   5.10  3.30  0.00 ! #SUP  1.38
assign  ((resid    8 and name HB1  )) ((resid    9 and name HG2* ))   4.62  2.82  0.00 ! #SUP  1.60
assign  ((resid    6 and name HD1* )) ((resid    9 and name HG2* ))   4.28  2.48  0.00 ! #SUP  1.13
assign  ((resid   71 and name HB1  )) ((resid   72 and name HD2* ))   5.29  3.49  0.00 ! #SUP  6.80
assign  ((resid   67 and name HG1* )) ((resid   68 and name HG2  ))   4.69  2.89  0.00 ! #SUP  5.35
assign  ((resid   24 and name HA   )) ((resid   25 and name HB   ))   5.50  3.70  0.00 ! #SUP  7.45
assign  ((resid   23 and name HG   )) ((resid   24 and name HA   ))   5.50  3.70  0.00 ! #SUP  4.39
assign  ((resid   23 and name HA   )) ((resid   24 and name HA   ))   5.35  3.55  0.00 ! #SUP  5.86
assign  ((resid   69 and name HB1  )) ((resid   71 and name HD2* ))   5.50  3.70  0.00 ! #SUP  1.71
assign  ((resid    8 and name HD1  )) ((resid   28 and name HB2  ))   5.50  3.70  0.00 ! #SUP  4.64
assign  ((resid   71 and name HB2  )) ((resid   72 and name HD2* ))   5.50  3.70  0.00 ! #SUP  6.23
assign  ((resid   71 and name HB1  )) ((resid   72 and name HA   ))   5.50  3.70  0.00 ! #SUP  5.08
assign  ((resid   12 and name HA   )) ((resid   24 and name HA   ))   3.32  1.52  0.00 ! #SUP  7.45
assign  ((resid   11 and name HA   )) ((resid   12 and name HA   ))   4.55  2.75  0.00 ! #SUP  4.66
assign  ((resid   11 and name HG1  )) ((resid   12 and name HA   ))   5.26  3.46  0.00 ! #SUP  4.93
assign  ((resid   57 and name HA   )) ((resid   57 and name HD1  ))   5.06  3.26  0.00 ! #SUP  4.28
assign  ((resid   57 and name HA   )) ((resid   62 and name HB1  ))   5.15  3.35  0.00 ! #SUP  2.52
assign  ((resid   13 and name HB1  )) ((resid   13 and name HD1  ))   3.74  1.94  0.00 ! #SUP  2.88
assign  ((resid   13 and name HB1  )) ((resid   13 and name HE1  ))   4.68  2.88  0.00 ! #SUP  1.90
assign  ((resid   13 and name HB1  )) ((resid   23 and name HB2  ))   4.40  2.60  0.00 ! #SUP  5.88
assign  ((resid   13 and name HB1  )) ((resid   23 and name HD1* ))   5.11  3.31  0.00 ! #SUP  6.97
assign  ((resid   13 and name HB1  )) ((resid   23 and name HB1  ))   5.31  3.51  0.00 ! #SUP  5.91
assign  ((resid   13 and name HB2  )) ((resid   23 and name HB2  ))   4.55  2.75  0.00 ! #SUP  4.95
assign  ((resid   13 and name HB2  )) ((resid   14 and name HN   ))   5.01  3.21  0.00 ! #SUP  3.88
assign  ((resid   13 and name HB2  )) ((resid   23 and name HB1  ))   5.40  3.60  0.00 ! #SUP  4.97
assign  ((resid   12 and name HA   )) ((resid   52 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.56
assign  ((resid   12 and name HA   )) ((resid   24 and name HG2* ))   4.65  2.85  0.00 ! #SUP  5.03
assign  ((resid   12 and name HA   )) ((resid   12 and name HG2* ))   3.74  1.94  0.00 ! #SUP  3.59
assign  ((resid   40 and name HA   )) ((resid   40 and name HG1* ))   3.51  1.71  0.00 ! #SUP  4.56
assign  ((resid   40 and name HA   )) ((resid   40 and name HG2* ))   4.07  2.27  0.00 ! #SUP  4.56
assign  ((resid   40 and name HA   )) ((resid   54 and name HD1* ))   5.32  3.52  0.00 ! #SUP  2.67
assign  ((resid   53 and name HB2  )) ((resid   62 and name HE1  ))   5.50  3.70  0.00 ! #SUP  3.00
assign  ((resid   53 and name HB2  )) ((resid   53 and name HD1* ))   4.18  2.38  0.00 ! #SUP  5.64
assign  ((resid   50 and name HA   )) ((resid   53 and name HB2  ))   5.36  3.56  0.00 ! #SUP  2.33
assign  ((resid   50 and name HA   )) ((resid   53 and name HD1* ))   5.50  3.70  0.00 ! #SUP  1.72
assign  ((resid   37 and name HA   )) ((resid   41 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.15
assign  ((resid   37 and name HA   )) ((resid   37 and name HD1  ))   5.50  3.70  0.00 ! #SUP  5.20
assign  ((resid   53 and name HB2  )) ((resid   56 and name HD1* ))   5.50  3.70  0.00 ! #SUP  4.96
assign  ((resid   53 and name HD1* )) ((resid   62 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.24
assign  ((resid    7 and name HB1  )) ((resid   27 and name HB2  ))   4.70  2.90  0.00 ! #SUP  4.09
assign  ((resid    7 and name HB1  )) ((resid   27 and name HB1  ))   4.92  3.12  0.00 ! #SUP  3.05
assign  ((resid    7 and name HB1  )) ((resid   27 and name HD1* ))   5.45  3.65  0.00 ! #SUP  5.37
assign  ((resid    4 and name HA   )) ((resid    7 and name HB2  ))   4.88  3.08  0.00 ! #SUP  0.75
assign  ((resid   48 and name HD2  )) ((resid   49 and name HA   ))   5.25  3.45  0.00 ! #SUP  5.32
assign  ((resid   49 and name HA   )) ((resid   49 and name HG2  ))   3.41  1.61  0.00 ! #SUP  7.89
assign  ((resid   49 and name HA   )) ((resid   52 and name HD1* ))   5.39  3.59  0.00 ! #SUP  3.35
assign  ((resid   49 and name HA   )) ((resid   52 and name HG11 ))   5.13  3.33  0.00 ! #SUP  2.87
assign  ((resid   49 and name HA   )) ((resid   72 and name HD1* ))   5.39  3.59  0.00 ! #SUP  5.67
assign  ((resid   49 and name HA   )) ((resid   52 and name HG2* ))   4.87  3.07  0.00 ! #SUP  2.94
assign  ((resid    7 and name HB2  )) ((resid   27 and name HB2  ))   4.88  3.08  0.00 ! #SUP  5.23
assign  ((resid    7 and name HB2  )) ((resid   27 and name HB1  ))   5.19  3.39  0.00 ! #SUP  4.11
assign  ((resid   40 and name HG2* )) ((resid   54 and name HG   ))   5.50  3.70  0.00 ! #SUP  1.50
assign  ((resid   37 and name HA   )) ((resid   40 and name HG2* ))   5.50  3.70  0.00 ! #SUP  6.20
assign  ((resid   52 and name HG2* )) ((resid   53 and name HA   ))   4.79  2.99  0.00 ! #SUP  6.87
assign  ((resid   52 and name HB   )) ((resid   53 and name HA   ))   5.08  3.28  0.00 ! #SUP  5.43
assign  ((resid   53 and name HB2  )) ((resid   54 and name HA   ))   5.50  3.70  0.00 ! #SUP  6.49
assign  ((resid   54 and name HA   )) ((resid   54 and name HD2* ))   4.34  2.54  0.00 ! #SUP  7.04
assign  ((resid   37 and name HB1  )) ((resid   37 and name HE1  ))   5.50  3.70  0.00 ! #SUP  3.16
assign  ((resid   27 and name HA   )) ((resid   30 and name HB1  ))   4.80  3.00  0.00 ! #SUP  1.27
assign  ((resid    4 and name HA   )) ((resid    4 and name HE3  ))   4.98  3.18  0.00 ! #SUP  4.72
assign  ((resid   37 and name HB2  )) ((resid   37 and name HE1  ))   5.50  3.70  0.00 ! #SUP  2.99
assign  ((resid   46 and name HG2  )) ((resid   48 and name HA   ))   4.69  2.89  0.00 ! #SUP  1.22
assign  ((resid   48 and name HA   )) ((resid   51 and name HB*  ))   5.48  3.68  0.00 ! #SUP  2.13
assign  ((resid   17 and name HA   )) ((resid   18 and name HB*  ))   5.50  3.70  0.00 ! #SUP  2.30
assign  ((resid   17 and name HB2  )) ((resid   18 and name HB*  ))   4.68  2.88  0.00 ! #SUP  2.20
assign  ((resid   65 and name HB*  )) ((resid   69 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.66
assign  ((resid   64 and name HN   )) ((resid   65 and name HB*  ))   5.09  3.29  0.00 ! #SUP  3.79
assign  ((resid   65 and name HB*  )) ((resid   69 and name HE1  ))   5.43  3.63  0.00 ! #SUP  0.25
assign  ((resid   56 and name HD1* )) ((resid   65 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.27
assign  ((resid   65 and name HB*  )) ((resid   71 and name HD2* ))   5.09  3.29  0.00 ! #SUP  3.47
assign  ((resid   60 and name HA   )) ((resid   60 and name HD2  ))   4.36  2.56  0.00 ! #SUP  8.17
assign  ((resid   66 and name HA   )) ((resid   66 and name HD1  ))   5.50  3.70  0.00 ! #SUP  6.57
assign  ((resid   66 and name HA   )) ((resid   71 and name HD2* ))   4.75  2.95  0.00 ! #SUP  8.35
assign  ((resid   64 and name HA   )) ((resid   67 and name HG1* ))   5.12  3.32  0.00 ! #SUP  4.19
assign  ((resid   29 and name HB2  )) ((resid   29 and name HG2  ))   2.44  0.64  0.00 ! #SUP  1.93
assign  ((resid   56 and name HA   )) ((resid   61 and name HD1* ))   4.33  2.53  0.00 ! #SUP  3.17
assign  ((resid   56 and name HA   )) ((resid   61 and name HD2* ))   5.03  3.23  0.00 ! #SUP  5.64
assign  ((resid   56 and name HA   )) ((resid   59 and name HB1  ))   5.01  3.21  0.00 ! #SUP  0.73
assign  ((resid   56 and name HA   )) ((resid   61 and name HG   ))   3.71  1.91  0.00 ! #SUP  5.46
assign  ((resid   16 and name HA   )) ((resid   16 and name HG1  ))   3.70  1.90  0.00 ! #SUP  6.80
assign  ((resid   16 and name HA   )) ((resid   16 and name HG2  ))   4.19  2.39  0.00 ! #SUP  7.39
assign  ((resid   16 and name HA   )) ((resid   16 and name HE2  ))   5.50  3.70  0.00 ! #SUP  6.81
assign  ((resid   13 and name HE1  )) ((resid   52 and name HG2* ))   4.50  2.70  0.00 ! #SUP  1.84
assign  ((resid   52 and name HG2* )) ((resid   53 and name HB2  ))   5.14  3.34  0.00 ! #SUP  7.73
assign  ((resid   13 and name HD1  )) ((resid   25 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   25 and name HG2* )) ((resid   30 and name HB2  ))   3.74  1.94  0.00 ! #SUP  3.33
assign  ((resid   31 and name HA   )) ((resid   31 and name HE1  ))   5.21  3.41  0.00 ! #SUP  3.87
assign  ((resid   31 and name HA   )) ((resid   36 and name HB1  ))   5.50  3.70  0.00 ! #SUP  2.61
assign  ((resid   36 and name HA   )) ((resid   36 and name HG1  ))   3.89  2.09  0.00 ! #SUP  4.61
assign  ((resid   36 and name HG1  )) ((resid   40 and name HG1* ))   5.50  3.70  0.00 ! #SUP  2.00
assign  ((resid   31 and name HD1  )) ((resid   36 and name HG1  ))   5.25  3.45  0.00 ! #SUP  3.10
assign  ((resid   36 and name HG2  )) ((resid   40 and name HG1* ))   5.50  3.70  0.00 ! #SUP  2.00
assign  ((resid   31 and name HA   )) ((resid   31 and name HD1  ))   4.65  2.85  0.00 ! #SUP  5.70
assign  ((resid   31 and name HA   )) ((resid   32 and name HA   ))   4.47  2.67  0.00 ! #SUP  5.85
assign  ((resid   29 and name HA   )) ((resid   29 and name HG1  ))   3.12  1.32  0.00 ! #SUP  2.72
assign  ((resid   36 and name HG1  )) ((resid   37 and name HN   ))   5.50  3.70  0.00 ! #SUP  5.64
assign  ((resid   36 and name HG1  )) ((resid   37 and name HA   ))   5.50  3.70  0.00 ! #SUP  2.00
assign  ((resid   36 and name HG1  )) ((resid   40 and name HG2* ))   5.50  3.70  0.00 ! #SUP  3.77
assign  ((resid   31 and name HD1  )) ((resid   36 and name HG2  ))   5.19  3.39  0.00 ! #SUP  1.01
assign  ((resid   36 and name HG2  )) ((resid   40 and name HG2* ))   5.50  3.70  0.00 ! #SUP  2.74
assign  ((resid   45 and name HA   )) ((resid   45 and name HG1  ))   4.10  2.30  0.00 ! #SUP  7.37
assign  ((resid   30 and name HA   )) ((resid   30 and name HD2* ))   3.82  2.02  0.00 ! #SUP  4.44
assign  ((resid   30 and name HA   )) ((resid   59 and name HE2  ))   4.76  2.96  0.00 ! #SUP  1.43
assign  ((resid   71 and name HA   )) ((resid   72 and name HD2* ))   5.44  3.64  0.00 ! #SUP  6.11
assign  ((resid   16 and name HG2  )) ((resid   69 and name HA   ))   5.39  3.59  0.00 ! #SUP  5.20
assign  ((resid    8 and name HA   )) ((resid    8 and name HD1  ))   4.94  3.14  0.00 ! #SUP  6.16
assign  ((resid   71 and name HA   )) ((resid   71 and name HD1* ))   5.50  3.70  0.00 ! #SUP  4.15
assign  ((resid   11 and name HB2  )) ((resid   52 and name HB   ))   4.52  2.72  0.00 ! #SUP  1.50
assign  ((resid   11 and name HB2  )) ((resid   52 and name HG12 ))   2.56  0.76  0.00 ! #SUP  1.50
assign  ((resid   11 and name HB2  )) ((resid   52 and name HD1* ))   4.20  2.40  0.00 ! #SUP  4.97
assign  ((resid   68 and name HB2  )) ((resid   69 and name HE1  ))   5.50  3.70  0.00 ! #SUP  3.90
assign  ((resid   68 and name HB1  )) ((resid   69 and name HE1  ))   5.50  3.70  0.00 ! #SUP  4.31
assign  ((resid   71 and name HA   )) ((resid   71 and name HD2* ))   5.50  3.70  0.00 ! #SUP  4.68
assign  ((resid   11 and name HA   )) ((resid   24 and name HG2* ))   5.50  3.70  0.00 ! #SUP  6.60
assign  ((resid   11 and name HA   )) ((resid   12 and name HB   ))   4.89  3.09  0.00 ! #SUP  4.06
assign  ((resid   11 and name HA   )) ((resid   11 and name HG2  ))   4.21  2.41  0.00 ! #SUP  5.99
assign  ((resid   11 and name HA   )) ((resid   11 and name HG1  ))   3.68  1.88  0.00 ! #SUP  5.53
assign  ((resid   64 and name HN   )) ((resid   65 and name HA   ))   4.83  3.03  0.00 ! #SUP  3.59
assign  ((resid   65 and name HA   )) ((resid   68 and name HG2  ))   5.31  3.51  0.00 ! #SUP  2.05
assign  ((resid   65 and name HA   )) ((resid   68 and name HB1  ))   5.34  3.54  0.00 ! #SUP  2.37
assign  ((resid   65 and name HA   )) ((resid   71 and name HD2* ))   5.50  3.70  0.00 ! #SUP  3.48
assign  ((resid   65 and name HA   )) ((resid   69 and name HN   ))   5.32  3.52  0.00 ! #SUP  2.97
assign  ((resid   25 and name HA   )) ((resid   25 and name HD1* ))   5.15  3.35  0.00 ! #SUP  3.67
assign  ((resid   25 and name HD1* )) ((resid   29 and name HG2  ))   5.35  3.55  0.00 ! #SUP  3.49
assign  ((resid   25 and name HD1* )) ((resid   30 and name HB1  ))   5.12  3.32  0.00 ! #SUP  2.99
assign  ((resid   24 and name HG2* )) ((resid   25 and name HD1* ))   5.50  3.70  0.00 ! #SUP  3.81
assign  ((resid   25 and name HD1* )) ((resid   30 and name HD2* ))   4.51  2.71  0.00 ! #SUP  3.40
assign  ((resid   23 and name HG   )) ((resid   25 and name HD1* ))   5.50  3.70  0.00 ! #SUP  3.06
assign  ((resid   23 and name HD2* )) ((resid   25 and name HD1* ))   4.54  2.74  0.00 ! #SUP  3.37
assign  ((resid   72 and name HA   )) ((resid   73 and name HG2  ))   4.73  2.93  0.00 ! #SUP  2.92
assign  ((resid   72 and name HA   )) ((resid   72 and name HD1* ))   5.50  3.70  0.00 ! #SUP  6.58
assign  ((resid   59 and name HA   )) ((resid   59 and name HE2  ))   4.98  3.18  0.00 ! #SUP  8.55
assign  ((resid   59 and name HA   )) ((resid   59 and name HD2  ))   3.91  2.11  0.00 ! #SUP  7.67
assign  ((resid   59 and name HA   )) ((resid   59 and name HD1  ))   4.26  2.46  0.00 ! #SUP  8.88
assign  ((resid   15 and name HD2  )) ((resid   21 and name HA   ))   4.88  3.08  0.00 ! #SUP  3.53
assign  ((resid   61 and name HA   )) ((resid   65 and name HN   ))   4.99  3.19  0.00 ! #SUP  0.87
assign  ((resid   13 and name HB1  )) ((resid   23 and name HA   ))   5.50  3.70  0.00 ! #SUP  3.42
assign  ((resid   15 and name HB2  )) ((resid   18 and name HA   ))   4.77  2.97  0.00 ! #SUP  2.00
assign  ((resid   13 and name HN   )) ((resid   14 and name HA   ))   5.32  3.52  0.00 ! #SUP  4.37
assign  ((resid   13 and name HA   )) ((resid   14 and name HA   ))   5.43  3.63  0.00 ! #SUP  4.47
assign  ((resid   14 and name HA   )) ((resid   22 and name HB2  ))   5.13  3.33  0.00 ! #SUP  6.52
assign  ((resid   12 and name HG2* )) ((resid   14 and name HA   ))   5.49  3.69  0.00 ! #SUP  4.08
assign  ((resid   15 and name HB1  )) ((resid   20 and name HB1  ))   4.42  2.62  0.00 ! #SUP  5.83
assign  ((resid   15 and name HB1  )) ((resid   20 and name HD1* ))   5.50  3.70  0.00 ! #SUP  4.78
assign  ((resid   14 and name HA   )) ((resid   15 and name HB1  ))   5.50  3.70  0.00 ! #SUP  7.38
assign  ((resid   15 and name HB2  )) ((resid   17 and name HA   ))   5.50  3.70  0.00 ! #SUP  2.19
assign  ((resid   15 and name HB2  )) ((resid   20 and name HB1  ))   4.56  2.76  0.00 ! #SUP  4.82
assign  ((resid   15 and name HD2  )) ((resid   22 and name HB2  ))   5.07  3.27  0.00 ! #SUP  7.15
assign  ((resid   14 and name HG1  )) ((resid   15 and name HD2  ))   5.50  3.70  0.00 ! #SUP  6.21
assign  ((resid   14 and name HA   )) ((resid   22 and name HB1  ))   4.54  2.74  0.00 ! #SUP  6.54
assign  ((resid   15 and name HD1  )) ((resid   22 and name HB2  ))   5.50  3.70  0.00 ! #SUP  6.58
assign  ((resid   16 and name HB1  )) ((resid   16 and name HE2  ))   5.50  3.70  0.00 ! #SUP  7.26
assign  ((resid   14 and name HG1  )) ((resid   15 and name HD1  ))   5.50  3.70  0.00 ! #SUP  5.91

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   SER   1           HT1      SER   1  -0.544  16.355   7.092
    2    H2   SER   1           HT2      SER   1   0.787  16.936   7.960
    3    H3   SER   1           HT3      SER   1  -0.738  16.881   8.689
    4    HA   SER   1           HA       SER   1   0.655  15.094   9.489
    5    HB2  SER   1           HB2      SER   1  -0.893  13.225   9.006
    6    HB3  SER   1           HB1      SER   1  -1.761  14.715   9.373
    7    HG   SER   1           HG       SER   1  -1.532  13.327   6.965
    8    H    ASP   2           HN       ASP   2   1.767  13.109   9.115
    9    HA   ASP   2           HA       ASP   2   2.936  13.014   6.369
   10    HB2  ASP   2           HB2      ASP   2   4.439  13.487   8.364
   11    HB3  ASP   2           HB1      ASP   2   4.111  11.844   8.906
   12    H    VAL   3           HN       VAL   3   3.532  10.910   5.502
   13    HA   VAL   3           HA       VAL   3   1.367   9.084   5.539
   14    HB   VAL   3           HB       VAL   3   2.994   9.291   3.682
   15   HG11  VAL   3          HG11      VAL   3   5.141   8.186   3.773
   16   HG12  VAL   3          HG12      VAL   3   4.847   7.687   5.438
   17   HG13  VAL   3          HG13      VAL   3   5.042   9.396   5.052
   18   HG21  VAL   3          HG21      VAL   3   1.519   7.358   3.805
   19   HG22  VAL   3          HG22      VAL   3   2.704   6.502   4.791
   20   HG23  VAL   3          HG23      VAL   3   3.080   6.912   3.118
   21    H    TRP   4           HN       TRP   4   4.409   9.125   7.371
   22    HA   TRP   4           HA       TRP   4   3.971   6.466   8.473
   23    HB2  TRP   4           HB2      TRP   4   6.111   8.323   8.371
   24    HB3  TRP   4           HB1      TRP   4   5.765   8.039  10.075
   25    HD1  TRP   4           HD1      TRP   4   5.326   5.111  10.429
   26    HE1  TRP   4           HE1      TRP   4   7.045   3.278   9.780
   27    HE3  TRP   4           HE3      TRP   4   8.048   7.800   7.031
   28    HZ2  TRP   4           HZ2      TRP   4   9.259   3.069   8.036
   29    HZ3  TRP   4           HZ3      TRP   4   9.952   6.708   5.921
   30    HH2  TRP   4           HH2      TRP   4  10.544   4.392   6.414
   31    H    SER   5           HN       SER   5   3.448   9.834   9.540
   32    HA   SER   5           HA       SER   5   2.720   9.281  12.213
   33    HB2  SER   5           HB2      SER   5   1.598  11.418  10.378
   34    HB3  SER   5           HB1      SER   5   1.513  11.425  12.139
   35    HG   SER   5           HG       SER   5   3.402  12.319  12.107
   36    H    LEU   6           HN       LEU   6   0.620   9.626   9.327
   37    HA   LEU   6           HA       LEU   6  -1.581   8.338  10.836
   38    HB2  LEU   6           HB2      LEU   6  -1.476   9.796   8.198
   39    HB3  LEU   6           HB1      LEU   6  -2.905   8.949   8.757
   40    HG   LEU   6           HG       LEU   6  -1.593  11.283  10.156
   41   HD11  LEU   6          HD11      LEU   6  -4.159  11.101   8.585
   42   HD12  LEU   6          HD12      LEU   6  -2.690  11.942   8.090
   43   HD13  LEU   6          HD13      LEU   6  -3.602  12.510   9.488
   44   HD21  LEU   6          HD21      LEU   6  -2.633   9.783  11.749
   45   HD22  LEU   6          HD22      LEU   6  -4.111   9.749  10.788
   46   HD23  LEU   6          HD23      LEU   6  -3.606  11.244  11.575
   47    H    SER   7           HN       SER   7   0.079   6.434  10.677
   48    HA   SER   7           HA       SER   7  -0.274   4.979   8.116
   49    HB2  SER   7           HB2      SER   7   1.461   3.465   8.987
   50    HB3  SER   7           HB1      SER   7   2.007   5.140   9.005
   51    HG   SER   7           HG       SER   7   2.514   4.168  10.966
   52    H    LYS   8           HN       LYS   8  -2.130   5.319  10.744
   53    HA   LYS   8           HA       LYS   8  -2.740   2.431  11.008
   54    HB2  LYS   8           HB2      LYS   8  -3.715   4.807  12.605
   55    HB3  LYS   8           HB1      LYS   8  -4.093   3.125  12.945
   56    HG2  LYS   8           HG2      LYS   8  -1.362   4.390  13.039
   57    HG3  LYS   8           HG1      LYS   8  -2.352   3.928  14.424
   58    HD2  LYS   8           HD2      LYS   8  -1.309   2.018  12.331
   59    HD3  LYS   8           HD1      LYS   8  -0.570   2.285  13.910
   60    HE2  LYS   8           HE2      LYS   8  -3.413   1.364  13.520
   61    HE3  LYS   8           HE1      LYS   8  -2.053   0.271  13.756
   62    HZ1  LYS   8           HZ1      LYS   8  -1.636   1.303  15.900
   63    HZ2  LYS   8           HZ2      LYS   8  -3.214   0.699  15.828
   64    HZ3  LYS   8           HZ3      LYS   8  -2.939   2.360  15.673
   65    H    THR   9           HN       THR   9  -3.440   4.215   8.640
   66    HA   THR   9           HA       THR   9  -6.405   3.942   8.798
   67    HB   THR   9           HB       THR   9  -6.440   5.515   6.843
   68    HG1  THR   9           HG1      THR   9  -4.605   6.139   5.996
   69   HG21  THR   9          HG21      THR   9  -5.958   7.533   8.177
   70   HG22  THR   9          HG22      THR   9  -5.155   6.526   9.382
   71   HG23  THR   9          HG23      THR   9  -6.883   6.338   9.086
   72    H    SER  10           HN       SER  10  -7.220   2.223   7.825
   73    HA   SER  10           HA       SER  10  -5.688   1.036   5.568
   74    HB2  SER  10           HB2      SER  10  -7.073  -0.984   5.977
   75    HB3  SER  10           HB1      SER  10  -6.159  -0.498   7.403
   76    HG   SER  10           HG       SER  10  -8.905  -0.418   6.927
   77    H    MET  11           HN       MET  11  -7.112  -0.114   3.893
   78    HA   MET  11           HA       MET  11  -9.544   1.484   3.295
   79    HB2  MET  11           HB2      MET  11  -7.599   2.453   2.053
   80    HB3  MET  11           HB1      MET  11  -7.384   0.897   1.260
   81    HG2  MET  11           HG2      MET  11  -8.555   2.387  -0.206
   82    HG3  MET  11           HG1      MET  11  -9.641   1.096   0.305
   83    HE1  MET  11           HE1      MET  11 -11.723   2.520  -0.565
   84    HE2  MET  11           HE2      MET  11 -10.616   3.793  -1.076
   85    HE3  MET  11           HE3      MET  11 -12.022   4.193  -0.089
   86    H    THR  12           HN       THR  12 -11.182   0.388   2.279
   87    HA   THR  12           HA       THR  12 -10.846  -2.534   2.238
   88    HB   THR  12           HB       THR  12 -13.328  -0.885   1.711
   89    HG1  THR  12           HG1      THR  12 -12.357  -2.141   4.084
   90   HG21  THR  12          HG21      THR  12 -14.531  -2.975   2.163
   91   HG22  THR  12          HG22      THR  12 -12.995  -3.825   2.335
   92   HG23  THR  12          HG23      THR  12 -13.457  -3.145   0.775
   93    H    PHE  13           HN       PHE  13 -10.426  -3.701   0.521
   94    HA   PHE  13           HA       PHE  13 -10.841  -2.471  -2.162
   95    HB2  PHE  13           HB2      PHE  13  -8.953  -4.608  -1.170
   96    HB3  PHE  13           HB1      PHE  13  -9.242  -4.341  -2.882
   97    HD1  PHE  13           HD2      PHE  13  -9.404  -1.370  -2.935
   98    HD2  PHE  13           HD1      PHE  13  -6.738  -3.992  -0.904
   99    HE1  PHE  13           HE2      PHE  13  -7.679   0.384  -2.946
  100    HE2  PHE  13           HE1      PHE  13  -5.011  -2.246  -0.914
  101    HZ   PHE  13           HZ       PHE  13  -5.477  -0.053  -1.935
  102    H    GLN  14           HN       GLN  14 -11.932  -3.575  -3.784
  103    HA   GLN  14           HA       GLN  14 -13.425  -5.971  -2.818
  104    HB2  GLN  14           HB2      GLN  14 -14.876  -4.025  -3.125
  105    HB3  GLN  14           HB1      GLN  14 -14.318  -3.854  -4.783
  106    HG2  GLN  14           HG2      GLN  14 -15.289  -6.032  -5.330
  107    HG3  GLN  14           HG1      GLN  14 -15.856  -6.192  -3.669
  108   HE21  GLN  14          HE21      GLN  14 -17.353  -6.183  -6.189
  109   HE22  GLN  14          HE22      GLN  14 -18.529  -4.832  -6.035
  110    HA   PRO  15           HA       PRO  15 -11.394  -8.130  -6.124
  111    HB2  PRO  15           HB2      PRO  15 -12.914 -10.378  -6.081
  112    HB3  PRO  15           HB1      PRO  15 -11.672 -10.031  -4.875
  113    HG2  PRO  15           HG2      PRO  15 -14.633  -9.690  -4.701
  114    HG3  PRO  15           HG1      PRO  15 -13.498 -10.289  -3.477
  115    HD2  PRO  15           HD2      PRO  15 -14.491  -7.758  -3.471
  116    HD3  PRO  15           HD1      PRO  15 -12.893  -8.171  -2.824
  117    H    LYS  16           HN       LYS  16 -11.643  -8.592  -8.283
  118    HA   LYS  16           HA       LYS  16 -13.888  -7.333  -9.595
  119    HB2  LYS  16           HB2      LYS  16 -11.688  -9.092 -10.693
  120    HB3  LYS  16           HB1      LYS  16 -12.823  -8.179 -11.673
  121    HG2  LYS  16           HG2      LYS  16 -10.869  -6.976  -9.726
  122    HG3  LYS  16           HG1      LYS  16 -10.625  -7.095 -11.468
  123    HD2  LYS  16           HD2      LYS  16 -12.607  -5.704 -11.835
  124    HD3  LYS  16           HD1      LYS  16 -12.848  -5.589 -10.090
  125    HE2  LYS  16           HE2      LYS  16 -10.630  -4.528  -9.887
  126    HE3  LYS  16           HE1      LYS  16 -10.467  -4.579 -11.641
  127    HZ1  LYS  16           HZ1      LYS  16 -11.217  -2.415 -10.866
  128    HZ2  LYS  16           HZ2      LYS  16 -12.582  -3.115 -10.155
  129    HZ3  LYS  16           HZ3      LYS  16 -12.394  -3.146 -11.836
  130    H    LYS  17           HN       LYS  17 -12.932 -10.666  -8.884
  131    HA   LYS  17           HA       LYS  17 -15.558 -11.555  -9.988
  132    HB2  LYS  17           HB2      LYS  17 -14.546 -13.713 -10.453
  133    HB3  LYS  17           HB1      LYS  17 -13.625 -12.439 -11.239
  134    HG2  LYS  17           HG2      LYS  17 -12.060 -12.529  -9.249
  135    HG3  LYS  17           HG1      LYS  17 -12.897 -14.010  -8.785
  136    HD2  LYS  17           HD2      LYS  17 -10.964 -14.647 -10.022
  137    HD3  LYS  17           HD1      LYS  17 -12.364 -14.919 -11.060
  138    HE2  LYS  17           HE2      LYS  17 -10.623 -13.900 -12.365
  139    HE3  LYS  17           HE1      LYS  17 -11.921 -12.728 -12.143
  140    HZ1  LYS  17           HZ1      LYS  17  -9.663 -11.802 -11.836
  141    HZ2  LYS  17           HZ2      LYS  17  -9.454 -12.807 -10.491
  142    HZ3  LYS  17           HZ3      LYS  17 -10.651 -11.612 -10.476
  143    H    ALA  18           HN       ALA  18 -16.474 -13.518  -8.950
  144    HA   ALA  18           HA       ALA  18 -16.748 -13.093  -6.146
  145    HB1  ALA  18           HB1      ALA  18 -17.479 -15.545  -7.743
  146    HB2  ALA  18           HB2      ALA  18 -18.484 -14.108  -7.548
  147    HB3  ALA  18           HB3      ALA  18 -18.098 -15.111  -6.150
  148    H    SER  19           HN       SER  19 -14.625 -15.202  -8.016
  149    HA   SER  19           HA       SER  19 -13.876 -16.997  -5.961
  150    HB2  SER  19           HB2      SER  19 -12.229 -15.949  -8.275
  151    HB3  SER  19           HB1      SER  19 -11.822 -17.361  -7.301
  152    HG   SER  19           HG       SER  19 -13.094 -17.565  -9.410
  153    H    LEU  20           HN       LEU  20 -12.500 -13.825  -6.871
  154    HA   LEU  20           HA       LEU  20 -10.399 -13.923  -4.911
  155    HB2  LEU  20           HB2      LEU  20 -11.672 -11.619  -6.376
  156    HB3  LEU  20           HB1      LEU  20 -10.255 -11.467  -5.366
  157    HG   LEU  20           HG       LEU  20 -10.439 -13.134  -7.876
  158   HD11  LEU  20          HD11      LEU  20  -9.058 -10.506  -7.350
  159   HD12  LEU  20          HD12      LEU  20 -10.489 -10.749  -8.351
  160   HD13  LEU  20          HD13      LEU  20  -8.946 -11.451  -8.834
  161   HD21  LEU  20          HD21      LEU  20  -8.011 -13.369  -7.627
  162   HD22  LEU  20          HD22      LEU  20  -8.879 -14.088  -6.270
  163   HD23  LEU  20          HD23      LEU  20  -8.091 -12.521  -6.083
  164    H    GLN  21           HN       GLN  21 -10.146 -12.508  -3.047
  165    HA   GLN  21           HA       GLN  21 -12.762 -12.028  -1.691
  166    HB2  GLN  21           HB2      GLN  21 -11.561 -13.951  -0.734
  167    HB3  GLN  21           HB1      GLN  21 -10.158 -12.932  -0.446
  168    HG2  GLN  21           HG2      GLN  21 -11.433 -11.587   1.125
  169    HG3  GLN  21           HG1      GLN  21 -12.869 -12.561   0.811
  170   HE21  GLN  21          HE21      GLN  21  -9.722 -12.424   2.325
  171   HE22  GLN  21          HE22      GLN  21  -9.932 -13.900   3.330
  172    HA   PRO  22           HA       PRO  22 -11.649  -7.745  -1.388
  173    HB2  PRO  22           HB2      PRO  22 -13.009  -7.906   1.257
  174    HB3  PRO  22           HB1      PRO  22 -13.291  -6.797  -0.088
  175    HG2  PRO  22           HG2      PRO  22 -14.987  -8.785   0.395
  176    HG3  PRO  22           HG1      PRO  22 -14.563  -8.337  -1.268
  177    HD2  PRO  22           HD2      PRO  22 -13.624 -10.653   0.372
  178    HD3  PRO  22           HD1      PRO  22 -14.005 -10.576  -1.361
  179    H    LEU  23           HN       LEU  23 -10.186  -6.384  -0.384
  180    HA   LEU  23           HA       LEU  23  -8.598  -7.657   1.803
  181    HB2  LEU  23           HB2      LEU  23  -7.760  -6.900  -0.737
  182    HB3  LEU  23           HB1      LEU  23  -7.202  -5.605   0.303
  183    HG   LEU  23           HG       LEU  23  -6.193  -7.452   1.769
  184   HD11  LEU  23          HD11      LEU  23  -6.654  -9.006  -0.771
  185   HD12  LEU  23          HD12      LEU  23  -7.385  -9.329   0.801
  186   HD13  LEU  23          HD13      LEU  23  -5.646  -9.526   0.580
  187   HD21  LEU  23          HD21      LEU  23  -4.854  -5.938   0.425
  188   HD22  LEU  23          HD22      LEU  23  -5.110  -6.946  -0.999
  189   HD23  LEU  23          HD23      LEU  23  -4.185  -7.568   0.367
  190    H    THR  24           HN       THR  24  -7.712  -6.331   3.436
  191    HA   THR  24           HA       THR  24  -8.439  -3.504   3.466
  192    HB   THR  24           HB       THR  24  -9.636  -5.329   5.560
  193    HG1  THR  24           HG1      THR  24 -11.131  -5.443   4.040
  194   HG21  THR  24          HG21      THR  24  -8.938  -3.183   6.493
  195   HG22  THR  24          HG22      THR  24 -10.698  -3.280   6.409
  196   HG23  THR  24          HG23      THR  24  -9.809  -2.332   5.217
  197    H    ILE  25           HN       ILE  25  -6.194  -3.166   3.616
  198    HA   ILE  25           HA       ILE  25  -5.131  -3.792   6.329
  199    HB   ILE  25           HB       ILE  25  -4.243  -5.315   4.481
  200   HG12  ILE  25          HG12      ILE  25  -1.978  -3.850   5.769
  201   HG13  ILE  25          HG11      ILE  25  -3.187  -4.610   6.801
  202   HG21  ILE  25          HG21      ILE  25  -3.961  -3.472   2.823
  203   HG22  ILE  25          HG22      ILE  25  -2.536  -4.488   3.032
  204   HG23  ILE  25          HG23      ILE  25  -2.597  -2.891   3.779
  205   HD11  ILE  25          HD11      ILE  25  -1.528  -5.987   4.706
  206   HD12  ILE  25          HD12      ILE  25  -2.755  -6.753   5.713
  207   HD13  ILE  25          HD13      ILE  25  -1.301  -6.081   6.452
  208    H    SER  26           HN       SER  26  -3.302  -2.444   7.021
  209    HA   SER  26           HA       SER  26  -3.476   0.270   5.788
  210    HB2  SER  26           HB2      SER  26  -4.566   0.103   8.009
  211    HB3  SER  26           HB1      SER  26  -3.032  -0.415   8.702
  212    HG   SER  26           HG       SER  26  -2.455   1.593   8.790
  213    H    LEU  27           HN       LEU  27  -1.602   1.710   6.578
  214    HA   LEU  27           HA       LEU  27   0.827   0.781   5.453
  215    HB2  LEU  27           HB2      LEU  27   0.382   3.024   7.405
  216    HB3  LEU  27           HB1      LEU  27   1.811   2.801   6.415
  217    HG   LEU  27           HG       LEU  27  -0.974   3.397   5.413
  218   HD11  LEU  27          HD11      LEU  27   0.142   5.489   4.605
  219   HD12  LEU  27          HD12      LEU  27   1.538   5.046   5.588
  220   HD13  LEU  27          HD13      LEU  27  -0.019   5.358   6.356
  221   HD21  LEU  27          HD21      LEU  27  -0.006   3.490   3.204
  222   HD22  LEU  27          HD22      LEU  27   0.283   1.900   3.905
  223   HD23  LEU  27          HD23      LEU  27   1.584   3.088   3.847
  224    H    ASP  28           HN       ASP  28   0.259   1.567   8.900
  225    HA   ASP  28           HA       ASP  28   2.707   0.404   9.786
  226    HB2  ASP  28           HB2      ASP  28   1.345   2.075  11.048
  227    HB3  ASP  28           HB1      ASP  28   0.169   0.811  11.383
  228    H    GLU  29           HN       GLU  29  -0.506  -0.917   9.254
  229    HA   GLU  29           HA       GLU  29   0.059  -3.403  10.644
  230    HB2  GLU  29           HB2      GLU  29  -2.184  -2.410   8.911
  231    HB3  GLU  29           HB1      GLU  29  -2.104  -4.093   9.409
  232    HG2  GLU  29           HG2      GLU  29  -3.552  -2.710  10.846
  233    HG3  GLU  29           HG1      GLU  29  -2.231  -3.481  11.721
  234    H    LEU  30           HN       LEU  30   1.272  -2.254   7.746
  235    HA   LEU  30           HA       LEU  30   1.556  -5.054   6.799
  236    HB2  LEU  30           HB2      LEU  30  -0.162  -3.812   5.475
  237    HB3  LEU  30           HB1      LEU  30   1.094  -2.697   4.975
  238    HG   LEU  30           HG       LEU  30   2.231  -4.405   3.735
  239   HD11  LEU  30          HD11      LEU  30   0.274  -6.285   5.028
  240   HD12  LEU  30          HD12      LEU  30   2.035  -6.317   5.108
  241   HD13  LEU  30          HD13      LEU  30   1.213  -6.709   3.599
  242   HD21  LEU  30          HD21      LEU  30   0.561  -4.966   2.074
  243   HD22  LEU  30          HD22      LEU  30   0.312  -3.319   2.654
  244   HD23  LEU  30          HD23      LEU  30  -0.730  -4.622   3.225
  245    H    PHE  31           HN       PHE  31   3.292  -2.746   8.130
  246    HA   PHE  31           HA       PHE  31   5.590  -3.534   6.500
  247    HB2  PHE  31           HB2      PHE  31   5.024  -0.645   7.202
  248    HB3  PHE  31           HB1      PHE  31   6.570  -1.203   6.573
  249    HD1  PHE  31           HD1      PHE  31   6.356  -2.632   4.344
  250    HD2  PHE  31           HD2      PHE  31   3.512   0.221   5.709
  251    HE1  PHE  31           HE1      PHE  31   5.524  -2.371   2.050
  252    HE2  PHE  31           HE2      PHE  31   2.670   0.485   3.412
  253    HZ   PHE  31           HZ       PHE  31   3.677  -0.814   1.579
  254    H    SER  32           HN       SER  32   7.580  -3.737   7.588
  255    HA   SER  32           HA       SER  32   7.499  -3.098  10.483
  256    HB2  SER  32           HB2      SER  32   8.366  -5.726   9.291
  257    HB3  SER  32           HB1      SER  32   8.507  -5.290  10.994
  258    HG   SER  32           HG       SER  32   6.371  -5.443  11.233
  259    H    SER  33           HN       SER  33   8.864  -1.717   8.253
  260    HA   SER  33           HA       SER  33  11.530  -1.671   9.394
  261    HB2  SER  33           HB2      SER  33  11.881  -3.600   7.994
  262    HB3  SER  33           HB1      SER  33  11.163  -2.784   6.609
  263    HG   SER  33           HG       SER  33  13.307  -2.538   6.323
  264    H    ARG  34           HN       ARG  34  12.635   0.212   8.993
  265    HA   ARG  34           HA       ARG  34  11.103   2.390   7.931
  266    HB2  ARG  34           HB2      ARG  34  14.081   2.268   8.459
  267    HB3  ARG  34           HB1      ARG  34  13.124   3.729   8.265
  268    HG2  ARG  34           HG2      ARG  34  12.859   1.720  10.494
  269    HG3  ARG  34           HG1      ARG  34  13.618   3.308  10.603
  270    HD2  ARG  34           HD2      ARG  34  10.723   2.821   9.905
  271    HD3  ARG  34           HD1      ARG  34  11.312   3.252  11.508
  272    HE   ARG  34           HE       ARG  34  12.191   5.150   9.528
  273   HH11  ARG  34          HH11      ARG  34   9.394   4.186  11.476
  274   HH12  ARG  34          HH12      ARG  34   8.678   5.762  11.444
  275   HH21  ARG  34          HH21      ARG  34  11.212   7.208   9.511
  276   HH22  ARG  34          HH22      ARG  34   9.709   7.477  10.330
  277    H    GLY  35           HN       GLY  35  14.059   0.750   6.712
  278    HA2  GLY  35           HA2      GLY  35  14.161   2.165   4.243
  279    HA3  GLY  35           HA1      GLY  35  14.886   0.595   4.555
  280    H    GLU  36           HN       GLU  36  12.421  -0.762   5.215
  281    HA   GLU  36           HA       GLU  36  11.649  -1.673   2.662
  282    HB2  GLU  36           HB2      GLU  36  11.294  -2.966   4.694
  283    HB3  GLU  36           HB1      GLU  36  10.152  -1.770   5.288
  284    HG2  GLU  36           HG2      GLU  36   8.613  -2.315   3.496
  285    HG3  GLU  36           HG1      GLU  36   9.770  -3.470   2.834
  286    H    PHE  37           HN       PHE  37  10.142   0.723   4.821
  287    HA   PHE  37           HA       PHE  37   7.857   1.250   3.220
  288    HB2  PHE  37           HB2      PHE  37   8.539   2.003   5.654
  289    HB3  PHE  37           HB1      PHE  37   9.163   3.420   4.818
  290    HD1  PHE  37           HD2      PHE  37   6.142   1.489   5.616
  291    HD2  PHE  37           HD1      PHE  37   7.694   5.057   3.893
  292    HE1  PHE  37           HE2      PHE  37   3.883   2.461   5.606
  293    HE2  PHE  37           HE1      PHE  37   5.439   6.037   3.882
  294    HZ   PHE  37           HZ       PHE  37   3.529   4.739   4.739
  295    H    ILE  38           HN       ILE  38  11.138   2.644   3.210
  296    HA   ILE  38           HA       ILE  38  10.745   4.743   1.408
  297    HB   ILE  38           HB       ILE  38  13.166   2.947   1.620
  298   HG12  ILE  38          HG12      ILE  38  12.683   3.883   3.774
  299   HG13  ILE  38          HG11      ILE  38  14.006   4.818   3.088
  300   HG21  ILE  38          HG21      ILE  38  13.268   4.226  -0.417
  301   HG22  ILE  38          HG22      ILE  38  14.396   4.914   0.751
  302   HG23  ILE  38          HG23      ILE  38  12.849   5.705   0.446
  303   HD11  ILE  38          HD11      ILE  38  11.109   5.634   3.171
  304   HD12  ILE  38          HD12      ILE  38  12.416   6.569   2.447
  305   HD13  ILE  38          HD13      ILE  38  12.408   6.265   4.184
  306    H    SER  39           HN       SER  39  11.808   1.382   0.579
  307    HA   SER  39           HA       SER  39  11.840   1.768  -2.212
  308    HB2  SER  39           HB2      SER  39  11.143  -0.767  -0.683
  309    HB3  SER  39           HB1      SER  39  11.602  -0.699  -2.385
  310    HG   SER  39           HG       SER  39  13.162  -0.421  -0.104
  311    H    VAL  40           HN       VAL  40   9.233   0.005  -0.435
  312    HA   VAL  40           HA       VAL  40   7.369  -0.278  -2.303
  313    HB   VAL  40           HB       VAL  40   5.577   0.085  -0.628
  314   HG11  VAL  40          HG11      VAL  40   7.164  -1.964  -0.874
  315   HG12  VAL  40          HG12      VAL  40   6.087  -1.848   0.514
  316   HG13  VAL  40          HG13      VAL  40   7.791  -1.430   0.685
  317   HG21  VAL  40          HG21      VAL  40   6.611   1.969   0.566
  318   HG22  VAL  40          HG22      VAL  40   7.856   0.882   1.177
  319   HG23  VAL  40          HG23      VAL  40   6.175   0.652   1.653
  320    H    GLY  41           HN       GLY  41   8.019   2.999  -0.912
  321    HA2  GLY  41           HA2      GLY  41   7.556   4.677  -2.766
  322    HA3  GLY  41           HA1      GLY  41   5.941   3.985  -2.802
  323    H    GLY  42           HN       GLY  42   8.043   4.716   0.009
  324    HA2  GLY  42           HA2      GLY  42   5.902   6.604   0.899
  325    HA3  GLY  42           HA1      GLY  42   6.720   5.507   1.991
  326    H    ASP  43           HN       ASP  43   6.915   8.458   0.153
  327    HA   ASP  43           HA       ASP  43   9.600   9.083   1.167
  328    HB2  ASP  43           HB2      ASP  43   7.562  10.690  -0.391
  329    HB3  ASP  43           HB1      ASP  43   9.113  11.347   0.122
  330    H    GLY  44           HN       GLY  44   6.623  11.107   1.354
  331    HA2  GLY  44           HA2      GLY  44   6.863  11.097   4.300
  332    HA3  GLY  44           HA1      GLY  44   7.150  12.630   3.499
  333    H    ARG  45           HN       ARG  45   5.381  13.377   1.972
  334    HA   ARG  45           HA       ARG  45   2.840  13.018   3.426
  335    HB2  ARG  45           HB2      ARG  45   3.679  14.975   1.285
  336    HB3  ARG  45           HB1      ARG  45   2.072  14.927   2.000
  337    HG2  ARG  45           HG2      ARG  45   3.006  15.413   4.187
  338    HG3  ARG  45           HG1      ARG  45   4.632  15.412   3.504
  339    HD2  ARG  45           HD2      ARG  45   2.401  17.300   2.764
  340    HD3  ARG  45           HD1      ARG  45   3.774  17.686   3.799
  341    HE   ARG  45           HE       ARG  45   5.022  16.877   1.535
  342   HH11  ARG  45          HH11      ARG  45   2.361  19.151   2.078
  343   HH12  ARG  45          HH12      ARG  45   2.758  20.128   0.706
  344   HH21  ARG  45          HH21      ARG  45   5.508  18.194  -0.261
  345   HH22  ARG  45          HH22      ARG  45   4.542  19.586  -0.622
  346    H    MET  46           HN       MET  46   1.712  11.297   2.858
  347    HA   MET  46           HA       MET  46   1.674  10.427   0.052
  348    HB2  MET  46           HB2      MET  46   1.665   8.992   2.275
  349    HB3  MET  46           HB1      MET  46  -0.074   9.218   2.152
  350    HG2  MET  46           HG2      MET  46   0.069   7.313   0.967
  351    HG3  MET  46           HG1      MET  46   0.426   8.425  -0.347
  352    HE1  MET  46           HE1      MET  46   3.400   9.372   0.253
  353    HE2  MET  46           HE2      MET  46   2.786   8.877  -1.324
  354    HE3  MET  46           HE3      MET  46   4.281   8.179  -0.701
  355    H    SER  47           HN       SER  47  -0.442   9.887  -1.008
  356    HA   SER  47           HA       SER  47  -2.167  12.249  -0.781
  357    HB2  SER  47           HB2      SER  47  -1.410  11.413  -2.994
  358    HB3  SER  47           HB1      SER  47  -2.320   9.928  -2.720
  359    HG   SER  47           HG       SER  47  -3.349  11.734  -3.959
  360    H    HIS  48           HN       HIS  48  -2.951   8.798  -1.262
  361    HA   HIS  48           HA       HIS  48  -4.614   8.386   1.002
  362    HB2  HIS  48           HB2      HIS  48  -6.051  10.144   0.140
  363    HB3  HIS  48           HB1      HIS  48  -6.062   9.388  -1.448
  364    HD1  HIS  48           HD1      HIS  48  -7.504   9.101   2.015
  365    HD2  HIS  48           HD2      HIS  48  -7.791   7.196  -1.710
  366    HE1  HIS  48           HE1      HIS  48  -9.514   7.560   2.151
  367    HE2  HIS  48           HE2      HIS  48  -9.753   6.488  -0.141
  368    H    LYS  49           HN       LYS  49  -4.952   7.837  -2.544
  369    HA   LYS  49           HA       LYS  49  -5.396   5.011  -2.125
  370    HB2  LYS  49           HB2      LYS  49  -5.112   6.873  -4.422
  371    HB3  LYS  49           HB1      LYS  49  -4.756   5.184  -4.735
  372    HG2  LYS  49           HG2      LYS  49  -7.261   5.747  -3.283
  373    HG3  LYS  49           HG1      LYS  49  -7.196   6.253  -4.971
  374    HD2  LYS  49           HD2      LYS  49  -8.108   4.017  -4.826
  375    HD3  LYS  49           HD1      LYS  49  -6.527   3.963  -5.605
  376    HE2  LYS  49           HE2      LYS  49  -6.659   2.142  -4.060
  377    HE3  LYS  49           HE1      LYS  49  -5.539   3.334  -3.406
  378    HZ1  LYS  49           HZ1      LYS  49  -8.380   3.019  -2.593
  379    HZ2  LYS  49           HZ2      LYS  49  -7.283   4.130  -1.944
  380    HZ3  LYS  49           HZ3      LYS  49  -7.042   2.472  -1.714
  381    H    GLU  50           HN       GLU  50  -2.614   7.074  -2.645
  382    HA   GLU  50           HA       GLU  50  -0.782   5.120  -3.607
  383    HB2  GLU  50           HB2      GLU  50  -0.744   7.826  -3.125
  384    HB3  GLU  50           HB1      GLU  50   0.346   7.214  -1.891
  385    HG2  GLU  50           HG2      GLU  50   0.579   6.702  -4.847
  386    HG3  GLU  50           HG1      GLU  50   1.523   7.864  -3.917
  387    H    ALA  51           HN       ALA  51  -1.484   6.287  -0.291
  388    HA   ALA  51           HA       ALA  51   0.509   4.849   1.052
  389    HB1  ALA  51           HB1      ALA  51  -0.940   5.004   3.049
  390    HB2  ALA  51           HB2      ALA  51  -2.279   5.501   2.017
  391    HB3  ALA  51           HB3      ALA  51  -0.854   6.527   2.168
  392    H    ILE  52           HN       ILE  52  -2.926   3.725   0.662
  393    HA   ILE  52           HA       ILE  52  -2.313   1.205   1.786
  394    HB   ILE  52           HB       ILE  52  -4.473   1.787  -0.274
  395   HG12  ILE  52          HG12      ILE  52  -4.731   3.273   1.608
  396   HG13  ILE  52          HG11      ILE  52  -5.935   2.007   1.742
  397   HG21  ILE  52          HG21      ILE  52  -4.220  -0.461   1.720
  398   HG22  ILE  52          HG22      ILE  52  -4.079  -0.595  -0.033
  399   HG23  ILE  52          HG23      ILE  52  -5.622  -0.153   0.696
  400   HD11  ILE  52          HD11      ILE  52  -4.521   0.857   3.385
  401   HD12  ILE  52          HD12      ILE  52  -4.991   2.477   3.899
  402   HD13  ILE  52          HD13      ILE  52  -3.364   2.184   3.283
  403    H    LEU  53           HN       LEU  53  -2.356   2.277  -1.638
  404    HA   LEU  53           HA       LEU  53  -1.978  -0.244  -2.811
  405    HB2  LEU  53           HB2      LEU  53  -2.425   1.901  -4.020
  406    HB3  LEU  53           HB1      LEU  53  -0.774   2.419  -3.754
  407    HG   LEU  53           HG       LEU  53  -0.003   0.453  -5.094
  408   HD11  LEU  53          HD11      LEU  53  -2.946   0.175  -5.688
  409   HD12  LEU  53          HD12      LEU  53  -1.938  -0.984  -4.821
  410   HD13  LEU  53          HD13      LEU  53  -1.646  -0.667  -6.531
  411   HD21  LEU  53          HD21      LEU  53  -1.862   2.398  -6.455
  412   HD22  LEU  53          HD22      LEU  53  -0.625   1.432  -7.259
  413   HD23  LEU  53          HD23      LEU  53  -0.158   2.662  -6.084
  414    H    LEU  54           HN       LEU  54   0.448   1.752  -1.105
  415    HA   LEU  54           HA       LEU  54   2.833   0.712  -2.130
  416    HB2  LEU  54           HB2      LEU  54   1.917   1.989   0.325
  417    HB3  LEU  54           HB1      LEU  54   3.098   0.762   0.721
  418    HG   LEU  54           HG       LEU  54   4.680   1.804  -0.873
  419   HD11  LEU  54          HD11      LEU  54   2.966   2.834  -2.331
  420   HD12  LEU  54          HD12      LEU  54   4.216   3.967  -1.819
  421   HD13  LEU  54          HD13      LEU  54   2.629   4.004  -1.054
  422   HD21  LEU  54          HD21      LEU  54   3.615   3.745   1.173
  423   HD22  LEU  54          HD22      LEU  54   5.254   3.671   0.527
  424   HD23  LEU  54          HD23      LEU  54   4.648   2.366   1.545
  425    H    GLY  55           HN       GLY  55   0.402  -0.914  -0.079
  426    HA2  GLY  55           HA2      GLY  55   1.854  -3.013   1.026
  427    HA3  GLY  55           HA1      GLY  55   0.195  -3.147   0.477
  428    H    LEU  56           HN       LEU  56   0.568  -2.833  -2.313
  429    HA   LEU  56           HA       LEU  56   1.094  -5.450  -3.110
  430    HB2  LEU  56           HB2      LEU  56   1.611  -3.030  -4.831
  431    HB3  LEU  56           HB1      LEU  56   1.226  -4.653  -5.374
  432    HG   LEU  56           HG       LEU  56  -0.603  -2.665  -4.045
  433   HD11  LEU  56          HD11      LEU  56  -1.952  -3.038  -6.056
  434   HD12  LEU  56          HD12      LEU  56  -0.722  -4.142  -6.670
  435   HD13  LEU  56          HD13      LEU  56  -0.341  -2.435  -6.445
  436   HD21  LEU  56          HD21      LEU  56  -2.327  -4.500  -4.221
  437   HD22  LEU  56          HD22      LEU  56  -1.124  -4.696  -2.947
  438   HD23  LEU  56          HD23      LEU  56  -0.985  -5.623  -4.439
  439    H    ARG  57           HN       ARG  57   3.395  -2.715  -2.998
  440    HA   ARG  57           HA       ARG  57   5.583  -4.143  -4.139
  441    HB2  ARG  57           HB2      ARG  57   5.470  -1.801  -2.238
  442    HB3  ARG  57           HB1      ARG  57   6.980  -2.425  -2.882
  443    HG2  ARG  57           HG2      ARG  57   4.735  -1.531  -4.661
  444    HG3  ARG  57           HG1      ARG  57   5.957  -0.418  -4.046
  445    HD2  ARG  57           HD2      ARG  57   6.762  -1.059  -6.145
  446    HD3  ARG  57           HD1      ARG  57   7.672  -2.048  -5.004
  447    HE   ARG  57           HE       ARG  57   5.253  -3.311  -6.049
  448   HH11  ARG  57          HH11      ARG  57   8.731  -2.807  -6.489
  449   HH12  ARG  57          HH12      ARG  57   8.931  -4.213  -7.478
  450   HH21  ARG  57          HH21      ARG  57   5.562  -5.149  -7.360
  451   HH22  ARG  57          HH22      ARG  57   7.133  -5.541  -7.975
  452    H    TYR  58           HN       TYR  58   4.334  -3.897  -0.843
  453    HA   TYR  58           HA       TYR  58   6.523  -5.163   0.480
  454    HB2  TYR  58           HB2      TYR  58   4.840  -3.898   1.698
  455    HB3  TYR  58           HB1      TYR  58   3.586  -5.016   1.192
  456    HD1  TYR  58           HD2      TYR  58   6.527  -4.599   3.373
  457    HD2  TYR  58           HD1      TYR  58   3.255  -7.100   2.310
  458    HE1  TYR  58           HE2      TYR  58   6.907  -5.947   5.394
  459    HE2  TYR  58           HE1      TYR  58   3.624  -8.454   4.328
  460    HH   TYR  58           HH       TYR  58   5.544  -8.966   5.880
  461    H    LYS  59           HN       LYS  59   3.406  -6.435  -0.695
  462    HA   LYS  59           HA       LYS  59   4.101  -9.181  -0.063
  463    HB2  LYS  59           HB2      LYS  59   1.825  -7.960  -1.613
  464    HB3  LYS  59           HB1      LYS  59   1.958  -9.673  -1.248
  465    HG2  LYS  59           HG2      LYS  59   1.845  -7.496   0.826
  466    HG3  LYS  59           HG1      LYS  59   0.456  -8.436   0.280
  467    HD2  LYS  59           HD2      LYS  59   1.506 -10.485   1.062
  468    HD3  LYS  59           HD1      LYS  59   2.946  -9.585   1.542
  469    HE2  LYS  59           HE2      LYS  59   1.634  -8.335   3.171
  470    HE3  LYS  59           HE1      LYS  59   0.178  -9.195   2.677
  471    HZ1  LYS  59           HZ1      LYS  59   1.239 -11.267   3.405
  472    HZ2  LYS  59           HZ2      LYS  59   1.073 -10.161   4.674
  473    HZ3  LYS  59           HZ3      LYS  59   2.582 -10.391   3.947
  474    H    LYS  60           HN       LYS  60   4.917  -7.111  -2.629
  475    HA   LYS  60           HA       LYS  60   5.945  -7.480  -4.629
  476    HB2  LYS  60           HB2      LYS  60   6.221 -10.339  -3.675
  477    HB3  LYS  60           HB1      LYS  60   7.060  -9.644  -5.052
  478    HG2  LYS  60           HG2      LYS  60   7.379  -8.840  -2.168
  479    HG3  LYS  60           HG1      LYS  60   8.529  -9.754  -3.143
  480    HD2  LYS  60           HD2      LYS  60   7.641  -6.928  -3.721
  481    HD3  LYS  60           HD1      LYS  60   9.136  -7.364  -2.895
  482    HE2  LYS  60           HE2      LYS  60   9.967  -7.179  -4.999
  483    HE3  LYS  60           HE1      LYS  60   9.433  -8.857  -5.084
  484    HZ1  LYS  60           HZ1      LYS  60   7.700  -6.604  -5.915
  485    HZ2  LYS  60           HZ2      LYS  60   7.518  -8.246  -6.273
  486    HZ3  LYS  60           HZ3      LYS  60   8.769  -7.361  -6.984
  487    H    LEU  61           HN       LEU  61   3.683  -7.028  -5.317
  488    HA   LEU  61           HA       LEU  61   3.018  -8.838  -7.430
  489    HB2  LEU  61           HB2      LEU  61   0.582  -9.180  -6.523
  490    HB3  LEU  61           HB1      LEU  61   1.869 -10.271  -6.058
  491    HG   LEU  61           HG       LEU  61   2.082  -9.214  -3.901
  492   HD11  LEU  61          HD11      LEU  61  -0.020  -7.273  -4.839
  493   HD12  LEU  61          HD12      LEU  61   1.679  -6.907  -4.553
  494   HD13  LEU  61          HD13      LEU  61   0.638  -7.373  -3.208
  495   HD21  LEU  61          HD21      LEU  61  -0.829  -9.656  -4.547
  496   HD22  LEU  61          HD22      LEU  61  -0.086  -9.734  -2.950
  497   HD23  LEU  61          HD23      LEU  61   0.339 -10.924  -4.179
  498    H    TYR  62           HN       TYR  62   3.541  -5.970  -6.989
  499    HA   TYR  62           HA       TYR  62   1.198  -4.426  -7.184
  500    HB2  TYR  62           HB2      TYR  62   3.453  -3.505  -6.835
  501    HB3  TYR  62           HB1      TYR  62   3.878  -3.919  -8.491
  502    HD1  TYR  62           HD1      TYR  62   1.745  -1.734  -6.406
  503    HD2  TYR  62           HD2      TYR  62   3.267  -2.504 -10.304
  504    HE1  TYR  62           HE1      TYR  62   0.923   0.456  -7.154
  505    HE2  TYR  62           HE2      TYR  62   2.448  -0.312 -11.063
  506    HH   TYR  62           HH       TYR  62   1.457   2.112  -8.960
  507    H    ASN  63           HN       ASN  63   2.602  -6.565  -9.537
  508    HA   ASN  63           HA       ASN  63   1.601  -5.294 -11.890
  509    HB2  ASN  63           HB2      ASN  63   3.399  -7.005 -11.848
  510    HB3  ASN  63           HB1      ASN  63   2.192  -8.227 -11.464
  511   HD21  ASN  63          HD21      ASN  63   0.847  -9.016 -13.025
  512   HD22  ASN  63          HD22      ASN  63   1.044  -8.602 -14.763
  513    H    GLN  64           HN       GLN  64   0.379  -8.375 -10.436
  514    HA   GLN  64           HA       GLN  64  -2.181  -7.828 -11.797
  515    HB2  GLN  64           HB2      GLN  64  -0.835 -10.255 -10.762
  516    HB3  GLN  64           HB1      GLN  64  -2.592 -10.253 -10.749
  517    HG2  GLN  64           HG2      GLN  64  -2.637  -9.834 -13.136
  518    HG3  GLN  64           HG1      GLN  64  -0.878  -9.746 -13.171
  519   HE21  GLN  64          HE21      GLN  64   0.364 -11.615 -12.939
  520   HE22  GLN  64          HE22      GLN  64  -0.369 -13.242 -13.154
  521    H    ALA  65           HN       ALA  65  -0.962  -7.163  -8.703
  522    HA   ALA  65           HA       ALA  65  -3.324  -7.996  -7.236
  523    HB1  ALA  65           HB1      ALA  65  -2.368  -6.750  -5.380
  524    HB2  ALA  65           HB2      ALA  65  -1.163  -6.047  -6.459
  525    HB3  ALA  65           HB3      ALA  65  -1.156  -7.781  -6.138
  526    H    ARG  66           HN       ARG  66  -2.198  -5.033  -8.804
  527    HA   ARG  66           HA       ARG  66  -4.443  -3.469  -7.782
  528    HB2  ARG  66           HB2      ARG  66  -2.130  -2.570  -8.314
  529    HB3  ARG  66           HB1      ARG  66  -2.549  -2.737 -10.013
  530    HG2  ARG  66           HG2      ARG  66  -4.360  -1.164  -9.766
  531    HG3  ARG  66           HG1      ARG  66  -4.072  -1.062  -8.029
  532    HD2  ARG  66           HD2      ARG  66  -3.086   0.856  -9.049
  533    HD3  ARG  66           HD1      ARG  66  -1.783  -0.211  -8.531
  534    HE   ARG  66           HE       ARG  66  -2.066  -0.992 -11.089
  535   HH11  ARG  66          HH11      ARG  66  -1.915   2.250  -9.671
  536   HH12  ARG  66          HH12      ARG  66  -1.205   2.963 -11.078
  537   HH21  ARG  66          HH21      ARG  66  -1.124  -0.013 -12.917
  538   HH22  ARG  66          HH22      ARG  66  -0.755   1.679 -12.921
  539    H    VAL  67           HN       VAL  67  -3.863  -5.594 -10.434
  540    HA   VAL  67           HA       VAL  67  -5.995  -4.390 -12.079
  541    HB   VAL  67           HB       VAL  67  -4.349  -6.869 -12.611
  542   HG11  VAL  67          HG11      VAL  67  -6.417  -6.824 -13.874
  543   HG12  VAL  67          HG12      VAL  67  -5.046  -6.524 -14.943
  544   HG13  VAL  67          HG13      VAL  67  -6.070  -5.185 -14.424
  545   HG21  VAL  67          HG21      VAL  67  -2.937  -4.869 -12.406
  546   HG22  VAL  67          HG22      VAL  67  -3.925  -4.056 -13.621
  547   HG23  VAL  67          HG23      VAL  67  -2.978  -5.478 -14.060
  548    H    LYS  68           HN       LYS  68  -5.283  -7.454 -10.364
  549    HA   LYS  68           HA       LYS  68  -7.776  -8.698 -11.036
  550    HB2  LYS  68           HB2      LYS  68  -5.804  -9.211  -8.812
  551    HB3  LYS  68           HB1      LYS  68  -7.231 -10.201  -9.074
  552    HG2  LYS  68           HG2      LYS  68  -5.007  -9.776 -11.062
  553    HG3  LYS  68           HG1      LYS  68  -5.224 -11.202 -10.047
  554    HD2  LYS  68           HD2      LYS  68  -7.397 -11.616 -11.120
  555    HD3  LYS  68           HD1      LYS  68  -7.146 -10.206 -12.152
  556    HE2  LYS  68           HE2      LYS  68  -5.125 -11.265 -13.072
  557    HE3  LYS  68           HE1      LYS  68  -5.424 -12.683 -12.068
  558    HZ1  LYS  68           HZ1      LYS  68  -6.223 -13.019 -14.315
  559    HZ2  LYS  68           HZ2      LYS  68  -7.221 -11.658 -14.200
  560    HZ3  LYS  68           HZ3      LYS  68  -7.522 -13.011 -13.230
  561    H    TYR  69           HN       TYR  69  -6.884  -6.357  -8.604
  562    HA   TYR  69           HA       TYR  69  -9.631  -6.621  -7.472
  563    HB2  TYR  69           HB2      TYR  69  -7.031  -5.929  -6.113
  564    HB3  TYR  69           HB1      TYR  69  -8.595  -5.568  -5.393
  565    HD1  TYR  69           HD2      TYR  69 -10.055  -7.360  -4.618
  566    HD2  TYR  69           HD1      TYR  69  -6.223  -8.210  -6.258
  567    HE1  TYR  69           HE2      TYR  69 -10.171  -9.633  -3.695
  568    HE2  TYR  69           HE1      TYR  69  -6.329 -10.489  -5.339
  569    HH   TYR  69           HH       TYR  69  -7.515 -11.668  -3.458
  570    H    SER  70           HN       SER  70 -10.577  -4.622  -6.615
  571    HA   SER  70           HA       SER  70 -10.147  -2.467  -8.534
  572    HB2  SER  70           HB2      SER  70 -12.419  -3.096  -7.859
  573    HB3  SER  70           HB1      SER  70 -12.051  -2.677  -6.187
  574    HG   SER  70           HG       SER  70 -13.025  -1.089  -7.981
  575    H    LEU  71           HN       LEU  71  -8.147  -1.567  -8.150
  576    HA   LEU  71           HA       LEU  71  -7.881  -0.192  -5.514
  577    HB2  LEU  71           HB2      LEU  71  -5.800  -1.348  -7.355
  578    HB3  LEU  71           HB1      LEU  71  -5.390  -0.150  -6.142
  579    HG   LEU  71           HG       LEU  71  -6.398  -1.750  -4.431
  580   HD11  LEU  71          HD11      LEU  71  -6.224  -3.595  -6.802
  581   HD12  LEU  71          HD12      LEU  71  -7.652  -3.204  -5.844
  582   HD13  LEU  71          HD13      LEU  71  -6.342  -4.142  -5.130
  583   HD21  LEU  71          HD21      LEU  71  -3.928  -2.563  -5.956
  584   HD22  LEU  71          HD22      LEU  71  -4.350  -3.100  -4.330
  585   HD23  LEU  71          HD23      LEU  71  -4.011  -1.398  -4.635
  586    H    LEU  72           HN       LEU  72  -6.350   0.167  -8.746
  587    HA   LEU  72           HA       LEU  72  -7.090   3.054  -8.601
  588    HB2  LEU  72           HB2      LEU  72  -4.670   1.657  -9.690
  589    HB3  LEU  72           HB1      LEU  72  -5.125   3.238 -10.291
  590    HG   LEU  72           HG       LEU  72  -3.404   3.416  -8.574
  591   HD11  LEU  72          HD11      LEU  72  -5.026   5.225  -8.792
  592   HD12  LEU  72          HD12      LEU  72  -4.494   5.037  -7.121
  593   HD13  LEU  72          HD13      LEU  72  -6.075   4.432  -7.616
  594   HD21  LEU  72          HD21      LEU  72  -3.781   2.761  -6.291
  595   HD22  LEU  72          HD22      LEU  72  -4.017   1.359  -7.334
  596   HD23  LEU  72          HD23      LEU  72  -5.411   2.213  -6.674
  597    H    GLU  73           HN       GLU  73  -8.602   3.692  -9.950
  598    HA   GLU  73           HA       GLU  73  -8.672   2.470 -12.656
  599    HB2  GLU  73           HB2      GLU  73 -11.094   2.850 -10.883
  600    HB3  GLU  73           HB1      GLU  73 -11.128   2.319 -12.559
  601    HG2  GLU  73           HG2      GLU  73  -9.690   0.371 -11.831
  602    HG3  GLU  73           HG1      GLU  73 -10.041   0.858 -10.174
  Start of MODEL    2
    1    H1   SER   1           HT1      SER   1   0.347  13.377  10.443
    2    H2   SER   1           HT2      SER   1  -0.917  13.842   9.421
    3    H3   SER   1           HT3      SER   1  -0.676  14.650  10.887
    4    HA   SER   1           HA       SER   1   0.110  15.998   9.083
    5    HB2  SER   1           HB2      SER   1   2.352  14.814  10.745
    6    HB3  SER   1           HB1      SER   1   2.439  16.341   9.867
    7    HG   SER   1           HG       SER   1   1.032  17.241  11.257
    8    H    ASP   2           HN       ASP   2   2.083  12.997   9.320
    9    HA   ASP   2           HA       ASP   2   2.555  13.265   6.386
   10    HB2  ASP   2           HB2      ASP   2   4.378  12.306   8.580
   11    HB3  ASP   2           HB1      ASP   2   4.665  11.899   6.890
   12    H    VAL   3           HN       VAL   3   3.379  11.052   5.479
   13    HA   VAL   3           HA       VAL   3   1.142   9.263   5.658
   14    HB   VAL   3           HB       VAL   3   2.483   9.537   3.612
   15   HG11  VAL   3          HG11      VAL   3   4.655   8.438   3.384
   16   HG12  VAL   3          HG12      VAL   3   4.625   8.016   5.097
   17   HG13  VAL   3          HG13      VAL   3   4.700   9.708   4.606
   18   HG21  VAL   3          HG21      VAL   3   2.601   7.151   2.995
   19   HG22  VAL   3          HG22      VAL   3   1.107   7.565   3.834
   20   HG23  VAL   3          HG23      VAL   3   2.396   6.724   4.693
   21    H    TRP   4           HN       TRP   4   4.340   9.319   7.172
   22    HA   TRP   4           HA       TRP   4   4.142   6.600   8.167
   23    HB2  TRP   4           HB2      TRP   4   6.143   8.611   8.036
   24    HB3  TRP   4           HB1      TRP   4   5.946   8.190   9.734
   25    HD1  TRP   4           HD1      TRP   4   5.603   5.139   9.704
   26    HE1  TRP   4           HE1      TRP   4   7.472   3.534   8.886
   27    HE3  TRP   4           HE3      TRP   4   8.230   8.450   6.825
   28    HZ2  TRP   4           HZ2      TRP   4   9.754   3.719   7.226
   29    HZ3  TRP   4           HZ3      TRP   4  10.246   7.657   5.658
   30    HH2  TRP   4           HH2      TRP   4  10.992   5.341   5.857
   31    H    SER   5           HN       SER   5   3.382   9.845   9.396
   32    HA   SER   5           HA       SER   5   2.916   9.098  12.100
   33    HB2  SER   5           HB2      SER   5   3.090  11.446  11.335
   34    HB3  SER   5           HB1      SER   5   1.556  11.273  10.482
   35    HG   SER   5           HG       SER   5   0.773  11.950  12.321
   36    H    LEU   6           HN       LEU   6   0.662   9.390   9.328
   37    HA   LEU   6           HA       LEU   6  -1.395   7.961  10.913
   38    HB2  LEU   6           HB2      LEU   6  -1.472   9.507   8.331
   39    HB3  LEU   6           HB1      LEU   6  -2.803   8.479   8.823
   40    HG   LEU   6           HG       LEU   6  -3.276  10.781   9.396
   41   HD11  LEU   6          HD11      LEU   6  -2.638   9.157  11.855
   42   HD12  LEU   6          HD12      LEU   6  -4.110   9.039  10.890
   43   HD13  LEU   6          HD13      LEU   6  -3.749  10.525  11.771
   44   HD21  LEU   6          HD21      LEU   6  -0.903  11.505   9.576
   45   HD22  LEU   6          HD22      LEU   6  -0.828  10.715  11.150
   46   HD23  LEU   6          HD23      LEU   6  -1.925  12.070  10.898
   47    H    SER   7           HN       SER   7  -0.360   5.921  10.924
   48    HA   SER   7           HA       SER   7  -0.432   4.553   8.267
   49    HB2  SER   7           HB2      SER   7   1.349   4.044  10.659
   50    HB3  SER   7           HB1      SER   7   1.257   2.982   9.257
   51    HG   SER   7           HG       SER   7   2.196   5.641   9.395
   52    H    LYS   8           HN       LYS   8  -2.319   4.891  10.862
   53    HA   LYS   8           HA       LYS   8  -2.924   2.003  11.121
   54    HB2  LYS   8           HB2      LYS   8  -3.637   4.435  12.725
   55    HB3  LYS   8           HB1      LYS   8  -4.556   2.949  12.904
   56    HG2  LYS   8           HG2      LYS   8  -1.585   3.230  13.321
   57    HG3  LYS   8           HG1      LYS   8  -2.803   3.156  14.596
   58    HD2  LYS   8           HD2      LYS   8  -2.264   0.985  12.567
   59    HD3  LYS   8           HD1      LYS   8  -1.686   0.987  14.233
   60    HE2  LYS   8           HE2      LYS   8  -4.004   1.009  15.030
   61    HE3  LYS   8           HE1      LYS   8  -4.577   1.001  13.363
   62    HZ1  LYS   8           HZ1      LYS   8  -3.442  -1.147  13.070
   63    HZ2  LYS   8           HZ2      LYS   8  -4.653  -1.211  14.249
   64    HZ3  LYS   8           HZ3      LYS   8  -3.026  -1.144  14.710
   65    H    THR   9           HN       THR   9  -3.892   4.616   9.227
   66    HA   THR   9           HA       THR   9  -6.736   3.955   9.143
   67    HB   THR   9           HB       THR   9  -6.785   5.573   7.231
   68    HG1  THR   9           HG1      THR   9  -4.938   6.029   6.318
   69   HG21  THR   9          HG21      THR   9  -5.420   6.576   9.735
   70   HG22  THR   9          HG22      THR   9  -7.156   6.326   9.539
   71   HG23  THR   9          HG23      THR   9  -6.330   7.559   8.585
   72    H    SER  10           HN       SER  10  -7.098   1.892   8.449
   73    HA   SER  10           HA       SER  10  -5.644   0.802   6.177
   74    HB2  SER  10           HB2      SER  10  -8.127  -0.269   7.540
   75    HB3  SER  10           HB1      SER  10  -7.055  -1.163   6.465
   76    HG   SER  10           HG       SER  10  -5.938  -1.615   8.171
   77    H    MET  11           HN       MET  11  -6.861  -0.250   4.341
   78    HA   MET  11           HA       MET  11  -9.142   1.442   3.453
   79    HB2  MET  11           HB2      MET  11  -7.020   2.257   2.419
   80    HB3  MET  11           HB1      MET  11  -6.797   0.665   1.709
   81    HG2  MET  11           HG2      MET  11  -7.697   2.111   0.046
   82    HG3  MET  11           HG1      MET  11  -8.945   0.954   0.507
   83    HE1  MET  11           HE1      MET  11 -10.673   2.585  -0.772
   84    HE2  MET  11           HE2      MET  11  -9.393   3.755  -1.094
   85    HE3  MET  11           HE3      MET  11 -10.900   4.281  -0.346
   86    H    THR  12           HN       THR  12 -10.751   0.385   2.388
   87    HA   THR  12           HA       THR  12 -10.466  -2.556   2.310
   88    HB   THR  12           HB       THR  12 -12.926  -0.839   1.923
   89    HG1  THR  12           HG1      THR  12 -12.729  -0.714   4.035
   90   HG21  THR  12          HG21      THR  12 -14.157  -2.957   2.267
   91   HG22  THR  12          HG22      THR  12 -12.623  -3.827   2.259
   92   HG23  THR  12          HG23      THR  12 -13.167  -2.986   0.808
   93    H    PHE  13           HN       PHE  13  -9.917  -3.572   0.530
   94    HA   PHE  13           HA       PHE  13 -10.321  -2.240  -2.082
   95    HB2  PHE  13           HB2      PHE  13  -8.650  -4.550  -1.136
   96    HB3  PHE  13           HB1      PHE  13  -8.980  -4.328  -2.849
   97    HD1  PHE  13           HD2      PHE  13  -8.871  -1.349  -3.005
   98    HD2  PHE  13           HD1      PHE  13  -6.370  -4.148  -1.001
   99    HE1  PHE  13           HE2      PHE  13  -6.989   0.227  -3.160
  100    HE2  PHE  13           HE1      PHE  13  -4.487  -2.580  -1.154
  101    HZ   PHE  13           HZ       PHE  13  -4.791  -0.388  -2.235
  102    H    GLN  14           HN       GLN  14 -11.508  -3.096  -3.761
  103    HA   GLN  14           HA       GLN  14 -13.439  -5.183  -2.881
  104    HB2  GLN  14           HB2      GLN  14 -13.696  -3.145  -5.094
  105    HB3  GLN  14           HB1      GLN  14 -14.932  -4.292  -4.602
  106    HG2  GLN  14           HG2      GLN  14 -15.122  -3.222  -2.444
  107    HG3  GLN  14           HG1      GLN  14 -13.812  -2.114  -2.852
  108   HE21  GLN  14          HE21      GLN  14 -16.571  -1.549  -2.061
  109   HE22  GLN  14          HE22      GLN  14 -17.269  -0.594  -3.416
  110    HA   PRO  15           HA       PRO  15 -11.178  -7.867  -5.685
  111    HB2  PRO  15           HB2      PRO  15 -13.528  -9.613  -5.211
  112    HB3  PRO  15           HB1      PRO  15 -11.811  -9.950  -4.989
  113    HG2  PRO  15           HG2      PRO  15 -13.430  -9.563  -2.899
  114    HG3  PRO  15           HG1      PRO  15 -11.752  -8.994  -2.892
  115    HD2  PRO  15           HD2      PRO  15 -14.276  -7.453  -3.291
  116    HD3  PRO  15           HD1      PRO  15 -12.795  -6.986  -2.433
  117    H    LYS  16           HN       LYS  16 -11.357  -8.451  -7.846
  118    HA   LYS  16           HA       LYS  16 -13.523  -7.146  -9.288
  119    HB2  LYS  16           HB2      LYS  16 -11.160  -8.813 -10.163
  120    HB3  LYS  16           HB1      LYS  16 -12.346  -8.183 -11.297
  121    HG2  LYS  16           HG2      LYS  16 -10.693  -6.493  -9.430
  122    HG3  LYS  16           HG1      LYS  16 -10.313  -6.794 -11.126
  123    HD2  LYS  16           HD2      LYS  16 -12.239  -5.634 -11.862
  124    HD3  LYS  16           HD1      LYS  16 -12.932  -5.605 -10.239
  125    HE2  LYS  16           HE2      LYS  16 -11.179  -4.103  -9.493
  126    HE3  LYS  16           HE1      LYS  16 -10.409  -4.178 -11.075
  127    HZ1  LYS  16           HZ1      LYS  16 -11.717  -2.169 -10.834
  128    HZ2  LYS  16           HZ2      LYS  16 -13.109  -3.073 -10.513
  129    HZ3  LYS  16           HZ3      LYS  16 -12.381  -3.154 -12.038
  130    H    LYS  17           HN       LYS  17 -12.504 -10.481  -8.570
  131    HA   LYS  17           HA       LYS  17 -15.073 -11.438  -9.740
  132    HB2  LYS  17           HB2      LYS  17 -12.611 -13.079  -9.130
  133    HB3  LYS  17           HB1      LYS  17 -14.018 -13.572 -10.063
  134    HG2  LYS  17           HG2      LYS  17 -13.449 -12.073 -11.839
  135    HG3  LYS  17           HG1      LYS  17 -12.149 -11.360 -10.883
  136    HD2  LYS  17           HD2      LYS  17 -11.105 -13.663 -10.826
  137    HD3  LYS  17           HD1      LYS  17 -12.297 -14.137 -12.037
  138    HE2  LYS  17           HE2      LYS  17 -10.304 -13.547 -13.198
  139    HE3  LYS  17           HE1      LYS  17 -11.467 -12.249 -13.461
  140    HZ1  LYS  17           HZ1      LYS  17 -10.359 -10.928 -11.797
  141    HZ2  LYS  17           HZ2      LYS  17  -9.230 -11.425 -12.954
  142    HZ3  LYS  17           HZ3      LYS  17  -9.286 -12.187 -11.446
  143    H    ALA  18           HN       ALA  18 -15.970 -13.436  -8.663
  144    HA   ALA  18           HA       ALA  18 -16.495 -12.833  -5.909
  145    HB1  ALA  18           HB1      ALA  18 -18.126 -13.937  -7.341
  146    HB2  ALA  18           HB2      ALA  18 -17.783 -14.916  -5.915
  147    HB3  ALA  18           HB3      ALA  18 -17.075 -15.346  -7.473
  148    H    SER  19           HN       SER  19 -14.326 -15.120  -7.525
  149    HA   SER  19           HA       SER  19 -13.665 -16.728  -5.300
  150    HB2  SER  19           HB2      SER  19 -11.963 -15.915  -7.667
  151    HB3  SER  19           HB1      SER  19 -11.566 -17.219  -6.548
  152    HG   SER  19           HG       SER  19 -13.436 -17.131  -8.580
  153    H    LEU  20           HN       LEU  20 -12.288 -13.632  -6.401
  154    HA   LEU  20           HA       LEU  20 -10.174 -13.571  -4.473
  155    HB2  LEU  20           HB2      LEU  20 -11.579 -11.374  -5.982
  156    HB3  LEU  20           HB1      LEU  20 -10.151 -11.121  -5.005
  157    HG   LEU  20           HG       LEU  20 -10.265 -12.943  -7.408
  158   HD11  LEU  20          HD11      LEU  20  -9.158 -10.151  -7.152
  159   HD12  LEU  20          HD12      LEU  20 -10.587 -10.624  -8.070
  160   HD13  LEU  20          HD13      LEU  20  -8.995 -11.201  -8.559
  161   HD21  LEU  20          HD21      LEU  20  -7.830 -12.929  -7.233
  162   HD22  LEU  20          HD22      LEU  20  -8.569 -13.574  -5.768
  163   HD23  LEU  20          HD23      LEU  20  -7.934 -11.929  -5.783
  164    H    GLN  21           HN       GLN  21  -9.933 -12.193  -2.618
  165    HA   GLN  21           HA       GLN  21 -12.536 -11.698  -1.238
  166    HB2  GLN  21           HB2      GLN  21  -9.918 -12.655  -0.066
  167    HB3  GLN  21           HB1      GLN  21 -11.317 -12.182   0.888
  168    HG2  GLN  21           HG2      GLN  21 -11.265 -14.433  -1.113
  169    HG3  GLN  21           HG1      GLN  21 -11.098 -14.617   0.632
  170   HE21  GLN  21          HE21      GLN  21 -12.866 -14.257   1.992
  171   HE22  GLN  21          HE22      GLN  21 -14.541 -14.249   1.341
  172    HA   PRO  22           HA       PRO  22 -11.436  -7.409  -1.045
  173    HB2  PRO  22           HB2      PRO  22 -12.804  -7.544   1.601
  174    HB3  PRO  22           HB1      PRO  22 -13.064  -6.430   0.254
  175    HG2  PRO  22           HG2      PRO  22 -14.785  -8.394   0.707
  176    HG3  PRO  22           HG1      PRO  22 -14.318  -7.972  -0.951
  177    HD2  PRO  22           HD2      PRO  22 -13.436 -10.276   0.740
  178    HD3  PRO  22           HD1      PRO  22 -13.784 -10.221  -1.000
  179    H    LEU  23           HN       LEU  23  -9.667  -6.365  -0.422
  180    HA   LEU  23           HA       LEU  23  -8.156  -7.494   1.872
  181    HB2  LEU  23           HB2      LEU  23  -7.127  -7.282  -0.415
  182    HB3  LEU  23           HB1      LEU  23  -7.204  -5.545  -0.219
  183    HG   LEU  23           HG       LEU  23  -5.728  -7.280   1.746
  184   HD11  LEU  23          HD11      LEU  23  -4.824  -7.751  -0.473
  185   HD12  LEU  23          HD12      LEU  23  -3.684  -6.824   0.501
  186   HD13  LEU  23          HD13      LEU  23  -4.620  -6.023  -0.761
  187   HD21  LEU  23          HD21      LEU  23  -5.612  -4.361   1.000
  188   HD22  LEU  23          HD22      LEU  23  -4.457  -5.158   2.067
  189   HD23  LEU  23          HD23      LEU  23  -6.156  -5.056   2.527
  190    H    THR  24           HN       THR  24  -8.113  -6.491   3.763
  191    HA   THR  24           HA       THR  24  -8.540  -3.546   3.746
  192    HB   THR  24           HB       THR  24  -9.672  -5.386   5.857
  193    HG1  THR  24           HG1      THR  24 -11.036  -5.763   4.227
  194   HG21  THR  24          HG21      THR  24 -10.073  -2.449   5.274
  195   HG22  THR  24          HG22      THR  24  -9.222  -3.137   6.658
  196   HG23  THR  24          HG23      THR  24 -10.962  -3.373   6.486
  197    H    ILE  25           HN       ILE  25  -6.403  -2.999   4.024
  198    HA   ILE  25           HA       ILE  25  -5.360  -3.495   6.730
  199    HB   ILE  25           HB       ILE  25  -4.544  -5.339   5.098
  200   HG12  ILE  25          HG12      ILE  25  -2.276  -5.322   6.165
  201   HG13  ILE  25          HG11      ILE  25  -2.633  -3.718   6.792
  202   HG21  ILE  25          HG21      ILE  25  -2.610  -3.174   4.305
  203   HG22  ILE  25          HG22      ILE  25  -3.956  -3.709   3.300
  204   HG23  ILE  25          HG23      ILE  25  -2.667  -4.838   3.721
  205   HD11  ILE  25          HD11      ILE  25  -4.408  -4.574   8.141
  206   HD12  ILE  25          HD12      ILE  25  -2.970  -5.557   8.417
  207   HD13  ILE  25          HD13      ILE  25  -4.270  -6.166   7.393
  208    H    SER  26           HN       SER  26  -3.460  -2.153   7.256
  209    HA   SER  26           HA       SER  26  -3.412   0.295   5.551
  210    HB2  SER  26           HB2      SER  26  -4.540   0.536   7.788
  211    HB3  SER  26           HB1      SER  26  -2.987   0.187   8.543
  212    HG   SER  26           HG       SER  26  -2.987   2.340   8.408
  213    H    LEU  27           HN       LEU  27  -1.442   1.728   6.435
  214    HA   LEU  27           HA       LEU  27   0.932   0.608   5.393
  215    HB2  LEU  27           HB2      LEU  27   0.720   2.847   7.380
  216    HB3  LEU  27           HB1      LEU  27   2.031   2.555   6.255
  217    HG   LEU  27           HG       LEU  27  -0.778   3.424   5.573
  218   HD11  LEU  27          HD11      LEU  27   1.892   4.793   5.303
  219   HD12  LEU  27          HD12      LEU  27   0.611   5.202   6.444
  220   HD13  LEU  27          HD13      LEU  27   0.354   5.423   4.714
  221   HD21  LEU  27          HD21      LEU  27   0.013   1.861   3.885
  222   HD22  LEU  27          HD22      LEU  27   1.517   2.770   3.726
  223   HD23  LEU  27          HD23      LEU  27  -0.012   3.504   3.246
  224    H    ASP  28           HN       ASP  28   0.266   1.376   8.834
  225    HA   ASP  28           HA       ASP  28   2.639   0.076   9.772
  226    HB2  ASP  28           HB2      ASP  28   1.472   1.808  11.057
  227    HB3  ASP  28           HB1      ASP  28   0.083   0.745  11.250
  228    H    GLU  29           HN       GLU  29  -0.631  -1.039   9.136
  229    HA   GLU  29           HA       GLU  29  -0.239  -3.569  10.529
  230    HB2  GLU  29           HB2      GLU  29  -2.413  -2.520   8.729
  231    HB3  GLU  29           HB1      GLU  29  -2.453  -4.116   9.456
  232    HG2  GLU  29           HG2      GLU  29  -2.805  -3.298  11.558
  233    HG3  GLU  29           HG1      GLU  29  -2.059  -1.742  11.203
  234    H    LEU  30           HN       LEU  30   0.862  -2.425   7.525
  235    HA   LEU  30           HA       LEU  30   1.027  -5.247   6.587
  236    HB2  LEU  30           HB2      LEU  30  -0.676  -3.809   5.359
  237    HB3  LEU  30           HB1      LEU  30   0.683  -2.896   4.733
  238    HG   LEU  30           HG       LEU  30   1.552  -5.040   3.736
  239   HD11  LEU  30          HD11      LEU  30   0.459  -6.695   5.027
  240   HD12  LEU  30          HD12      LEU  30  -0.211  -6.806   3.400
  241   HD13  LEU  30          HD13      LEU  30  -1.131  -6.016   4.681
  242   HD21  LEU  30          HD21      LEU  30   0.375  -3.359   2.412
  243   HD22  LEU  30          HD22      LEU  30  -1.166  -4.107   2.825
  244   HD23  LEU  30          HD23      LEU  30   0.009  -4.990   1.851
  245    H    PHE  31           HN       PHE  31   2.901  -3.084   7.891
  246    HA   PHE  31           HA       PHE  31   5.128  -3.852   6.136
  247    HB2  PHE  31           HB2      PHE  31   4.783  -1.001   7.106
  248    HB3  PHE  31           HB1      PHE  31   6.183  -1.606   6.228
  249    HD1  PHE  31           HD1      PHE  31   5.231  -3.059   4.018
  250    HD2  PHE  31           HD2      PHE  31   3.504   0.388   5.817
  251    HE1  PHE  31           HE1      PHE  31   4.121  -2.507   1.893
  252    HE2  PHE  31           HE2      PHE  31   2.392   0.942   3.694
  253    HZ   PHE  31           HZ       PHE  31   2.698  -0.509   1.732
  254    H    SER  32           HN       SER  32   7.112  -4.233   7.134
  255    HA   SER  32           HA       SER  32   7.146  -3.823  10.075
  256    HB2  SER  32           HB2      SER  32   7.907  -6.357   8.626
  257    HB3  SER  32           HB1      SER  32   8.114  -6.074  10.355
  258    HG   SER  32           HG       SER  32   5.795  -6.557   8.889
  259    H    SER  33           HN       SER  33   8.444  -2.204   8.064
  260    HA   SER  33           HA       SER  33  11.139  -2.270   9.056
  261    HB2  SER  33           HB2      SER  33  11.479  -4.113   7.543
  262    HB3  SER  33           HB1      SER  33  10.701  -3.236   6.229
  263    HG   SER  33           HG       SER  33  13.199  -3.297   6.597
  264    H    ARG  34           HN       ARG  34  12.094  -0.334   8.920
  265    HA   ARG  34           HA       ARG  34  10.594   1.878   7.917
  266    HB2  ARG  34           HB2      ARG  34  12.266   2.005   9.747
  267    HB3  ARG  34           HB1      ARG  34  13.544   1.743   8.572
  268    HG2  ARG  34           HG2      ARG  34  13.025   3.828   7.477
  269    HG3  ARG  34           HG1      ARG  34  11.644   4.078   8.548
  270    HD2  ARG  34           HD2      ARG  34  13.085   4.281  10.455
  271    HD3  ARG  34           HD1      ARG  34  14.495   3.833   9.497
  272    HE   ARG  34           HE       ARG  34  13.035   6.414   9.419
  273   HH11  ARG  34          HH11      ARG  34  15.756   4.418   8.326
  274   HH12  ARG  34          HH12      ARG  34  16.635   5.763   7.689
  275   HH21  ARG  34          HH21      ARG  34  14.231   8.148   8.561
  276   HH22  ARG  34          HH22      ARG  34  15.773   7.878   7.820
  277    H    GLY  35           HN       GLY  35  13.537   0.238   6.686
  278    HA2  GLY  35           HA2      GLY  35  13.804   1.855   4.353
  279    HA3  GLY  35           HA1      GLY  35  14.449   0.236   4.560
  280    H    GLU  36           HN       GLU  36  11.915  -1.076   5.021
  281    HA   GLU  36           HA       GLU  36  11.176  -1.685   2.362
  282    HB2  GLU  36           HB2      GLU  36  10.694  -3.211   4.180
  283    HB3  GLU  36           HB1      GLU  36   9.648  -2.028   4.951
  284    HG2  GLU  36           HG2      GLU  36   8.283  -3.673   3.906
  285    HG3  GLU  36           HG1      GLU  36   8.131  -2.172   2.995
  286    H    PHE  37           HN       PHE  37   9.743   0.526   4.754
  287    HA   PHE  37           HA       PHE  37   7.477   1.349   3.309
  288    HB2  PHE  37           HB2      PHE  37   8.144   1.924   5.699
  289    HB3  PHE  37           HB1      PHE  37   9.182   3.169   5.017
  290    HD1  PHE  37           HD2      PHE  37   5.690   2.074   5.432
  291    HD2  PHE  37           HD1      PHE  37   8.291   5.230   4.252
  292    HE1  PHE  37           HE2      PHE  37   3.787   3.631   5.417
  293    HE2  PHE  37           HE1      PHE  37   6.391   6.794   4.240
  294    HZ   PHE  37           HZ       PHE  37   4.136   5.993   4.821
  295    H    ILE  38           HN       ILE  38  10.818   2.610   3.239
  296    HA   ILE  38           HA       ILE  38  10.452   4.718   1.448
  297    HB   ILE  38           HB       ILE  38  12.829   2.866   1.661
  298   HG12  ILE  38          HG12      ILE  38  12.341   3.874   3.796
  299   HG13  ILE  38          HG11      ILE  38  13.727   4.709   3.104
  300   HG21  ILE  38          HG21      ILE  38  14.113   4.757   0.735
  301   HG22  ILE  38          HG22      ILE  38  12.601   5.618   0.450
  302   HG23  ILE  38          HG23      ILE  38  12.934   4.114  -0.408
  303   HD11  ILE  38          HD11      ILE  38  10.886   5.707   3.081
  304   HD12  ILE  38          HD12      ILE  38  12.288   6.547   2.416
  305   HD13  ILE  38          HD13      ILE  38  12.173   6.259   4.152
  306    H    SER  39           HN       SER  39  11.355   1.311   0.619
  307    HA   SER  39           HA       SER  39  11.357   1.736  -2.186
  308    HB2  SER  39           HB2      SER  39  10.739  -0.798  -0.616
  309    HB3  SER  39           HB1      SER  39  11.033  -0.751  -2.353
  310    HG   SER  39           HG       SER  39  12.820  -0.934  -0.440
  311    H    VAL  40           HN       VAL  40   8.786  -0.016  -0.335
  312    HA   VAL  40           HA       VAL  40   6.857  -0.290  -2.129
  313    HB   VAL  40           HB       VAL  40   5.121   0.124  -0.408
  314   HG11  VAL  40          HG11      VAL  40   5.901  -1.625   1.118
  315   HG12  VAL  40          HG12      VAL  40   7.538  -1.433   0.494
  316   HG13  VAL  40          HG13      VAL  40   6.254  -2.017  -0.563
  317   HG21  VAL  40          HG21      VAL  40   5.795   0.733   1.852
  318   HG22  VAL  40          HG22      VAL  40   6.154   2.035   0.718
  319   HG23  VAL  40          HG23      VAL  40   7.448   0.988   1.299
  320    H    GLY  41           HN       GLY  41   7.577   2.993  -0.777
  321    HA2  GLY  41           HA2      GLY  41   7.120   4.664  -2.647
  322    HA3  GLY  41           HA1      GLY  41   5.495   3.996  -2.659
  323    H    GLY  42           HN       GLY  42   7.667   4.779   0.090
  324    HA2  GLY  42           HA2      GLY  42   5.533   6.662   1.008
  325    HA3  GLY  42           HA1      GLY  42   6.417   5.613   2.094
  326    H    ASP  43           HN       ASP  43   6.386   8.573   0.317
  327    HA   ASP  43           HA       ASP  43   9.113   9.262   1.205
  328    HB2  ASP  43           HB2      ASP  43   7.064  10.768  -0.433
  329    HB3  ASP  43           HB1      ASP  43   8.631  11.436   0.012
  330    H    GLY  44           HN       GLY  44   6.223  11.385   1.225
  331    HA2  GLY  44           HA2      GLY  44   6.407  11.520   4.184
  332    HA3  GLY  44           HA1      GLY  44   6.683  12.998   3.282
  333    H    ARG  45           HN       ARG  45   4.926  13.701   1.778
  334    HA   ARG  45           HA       ARG  45   2.359  13.287   3.181
  335    HB2  ARG  45           HB2      ARG  45   3.307  15.340   1.187
  336    HB3  ARG  45           HB1      ARG  45   1.622  15.210   1.676
  337    HG2  ARG  45           HG2      ARG  45   2.620  16.920   2.985
  338    HG3  ARG  45           HG1      ARG  45   2.364  15.528   4.037
  339    HD2  ARG  45           HD2      ARG  45   4.686  14.911   3.867
  340    HD3  ARG  45           HD1      ARG  45   4.975  16.188   2.686
  341    HE   ARG  45           HE       ARG  45   3.920  17.238   5.155
  342   HH11  ARG  45          HH11      ARG  45   6.876  16.048   3.610
  343   HH12  ARG  45          HH12      ARG  45   7.926  16.957   4.644
  344   HH21  ARG  45          HH21      ARG  45   5.340  18.415   6.497
  345   HH22  ARG  45          HH22      ARG  45   7.055  18.298   6.283
  346    H    MET  46           HN       MET  46   1.551  11.372   2.523
  347    HA   MET  46           HA       MET  46   1.557  10.598  -0.271
  348    HB2  MET  46           HB2      MET  46   1.403   9.197   2.003
  349    HB3  MET  46           HB1      MET  46  -0.316   9.323   1.653
  350    HG2  MET  46           HG2      MET  46  -0.032   7.512   0.405
  351    HG3  MET  46           HG1      MET  46   0.730   8.582  -0.766
  352    HE1  MET  46           HE1      MET  46   4.526   8.166   0.135
  353    HE2  MET  46           HE2      MET  46   3.488   9.261   1.047
  354    HE3  MET  46           HE3      MET  46   3.318   9.139  -0.704
  355    H    SER  47           HN       SER  47  -0.622   9.811  -1.259
  356    HA   SER  47           HA       SER  47  -2.348  12.201  -1.279
  357    HB2  SER  47           HB2      SER  47  -1.507  11.255  -3.415
  358    HB3  SER  47           HB1      SER  47  -2.402   9.773  -3.089
  359    HG   SER  47           HG       SER  47  -3.379  12.346  -3.692
  360    H    HIS  48           HN       HIS  48  -3.101   8.727  -1.625
  361    HA   HIS  48           HA       HIS  48  -4.805   8.378   0.611
  362    HB2  HIS  48           HB2      HIS  48  -6.230  10.122  -0.275
  363    HB3  HIS  48           HB1      HIS  48  -6.200   9.380  -1.870
  364    HD1  HIS  48           HD1      HIS  48  -7.783   9.123   1.522
  365    HD2  HIS  48           HD2      HIS  48  -7.892   7.146  -2.175
  366    HE1  HIS  48           HE1      HIS  48  -9.795   7.580   1.593
  367    HE2  HIS  48           HE2      HIS  48  -9.906   6.439  -0.675
  368    H    LYS  49           HN       LYS  49  -4.841   7.795  -2.939
  369    HA   LYS  49           HA       LYS  49  -5.394   4.959  -2.483
  370    HB2  LYS  49           HB2      LYS  49  -4.957   6.731  -4.866
  371    HB3  LYS  49           HB1      LYS  49  -4.916   4.986  -5.047
  372    HG2  LYS  49           HG2      LYS  49  -7.223   6.574  -3.940
  373    HG3  LYS  49           HG1      LYS  49  -7.112   5.927  -5.578
  374    HD2  LYS  49           HD2      LYS  49  -6.977   3.650  -4.649
  375    HD3  LYS  49           HD1      LYS  49  -7.138   4.316  -3.023
  376    HE2  LYS  49           HE2      LYS  49  -9.272   3.467  -3.818
  377    HE3  LYS  49           HE1      LYS  49  -9.336   5.216  -3.610
  378    HZ1  LYS  49           HZ1      LYS  49 -10.386   4.432  -5.681
  379    HZ2  LYS  49           HZ2      LYS  49  -8.889   3.853  -6.210
  380    HZ3  LYS  49           HZ3      LYS  49  -9.114   5.511  -5.966
  381    H    GLU  50           HN       GLU  50  -2.617   7.038  -2.957
  382    HA   GLU  50           HA       GLU  50  -0.790   5.081  -3.952
  383    HB2  GLU  50           HB2      GLU  50  -0.370   7.451  -4.178
  384    HB3  GLU  50           HB1      GLU  50  -0.352   7.655  -2.433
  385    HG2  GLU  50           HG2      GLU  50   1.686   6.430  -2.238
  386    HG3  GLU  50           HG1      GLU  50   1.624   5.958  -3.935
  387    H    ALA  51           HN       ALA  51  -1.217   6.410  -0.629
  388    HA   ALA  51           HA       ALA  51   0.753   4.953   0.668
  389    HB1  ALA  51           HB1      ALA  51  -1.995   5.618   1.729
  390    HB2  ALA  51           HB2      ALA  51  -0.567   6.651   1.797
  391    HB3  ALA  51           HB3      ALA  51  -0.611   5.147   2.714
  392    H    ILE  52           HN       ILE  52  -2.650   3.817   0.178
  393    HA   ILE  52           HA       ILE  52  -2.118   1.346   1.469
  394    HB   ILE  52           HB       ILE  52  -4.175   1.828  -0.716
  395   HG12  ILE  52          HG12      ILE  52  -4.355   3.463   1.127
  396   HG13  ILE  52          HG11      ILE  52  -5.730   2.376   1.081
  397   HG21  ILE  52          HG21      ILE  52  -5.396  -0.018   0.274
  398   HG22  ILE  52          HG22      ILE  52  -4.137  -0.224   1.493
  399   HG23  ILE  52          HG23      ILE  52  -3.782  -0.541  -0.205
  400   HD11  ILE  52          HD11      ILE  52  -3.394   2.207   2.965
  401   HD12  ILE  52          HD12      ILE  52  -4.746   1.077   2.912
  402   HD13  ILE  52          HD13      ILE  52  -5.022   2.761   3.356
  403    H    LEU  53           HN       LEU  53  -1.964   2.309  -1.977
  404    HA   LEU  53           HA       LEU  53  -1.624  -0.258  -3.062
  405    HB2  LEU  53           HB2      LEU  53  -1.916   1.920  -4.314
  406    HB3  LEU  53           HB1      LEU  53  -0.231   2.304  -4.038
  407    HG   LEU  53           HG       LEU  53   0.395   0.260  -5.319
  408   HD11  LEU  53          HD11      LEU  53  -2.559   0.166  -5.908
  409   HD12  LEU  53          HD12      LEU  53  -1.627  -1.036  -5.015
  410   HD13  LEU  53          HD13      LEU  53  -1.322  -0.782  -6.733
  411   HD21  LEU  53          HD21      LEU  53   0.341   2.482  -6.357
  412   HD22  LEU  53          HD22      LEU  53  -1.347   2.225  -6.801
  413   HD23  LEU  53          HD23      LEU  53  -0.087   1.209  -7.501
  414    H    LEU  54           HN       LEU  54   0.784   1.708  -1.300
  415    HA   LEU  54           HA       LEU  54   3.226   0.670  -2.059
  416    HB2  LEU  54           HB2      LEU  54   1.996   1.419   0.591
  417    HB3  LEU  54           HB1      LEU  54   3.543   0.611   0.615
  418    HG   LEU  54           HG       LEU  54   4.532   2.376  -0.737
  419   HD11  LEU  54          HD11      LEU  54   2.649   3.010  -2.101
  420   HD12  LEU  54          HD12      LEU  54   3.242   4.421  -1.226
  421   HD13  LEU  54          HD13      LEU  54   1.782   3.598  -0.682
  422   HD21  LEU  54          HD21      LEU  54   4.454   4.160   0.899
  423   HD22  LEU  54          HD22      LEU  54   4.480   2.597   1.712
  424   HD23  LEU  54          HD23      LEU  54   2.971   3.498   1.584
  425    H    GLY  55           HN       GLY  55   0.664  -0.990  -0.135
  426    HA2  GLY  55           HA2      GLY  55   2.015  -3.158   0.934
  427    HA3  GLY  55           HA1      GLY  55   0.366  -3.225   0.348
  428    H    LEU  56           HN       LEU  56   0.700  -2.994  -2.403
  429    HA   LEU  56           HA       LEU  56   1.155  -5.610  -3.191
  430    HB2  LEU  56           HB2      LEU  56   1.797  -3.234  -4.926
  431    HB3  LEU  56           HB1      LEU  56   1.327  -4.838  -5.454
  432    HG   LEU  56           HG       LEU  56  -0.400  -2.747  -4.143
  433   HD11  LEU  56          HD11      LEU  56  -0.518  -4.184  -6.789
  434   HD12  LEU  56          HD12      LEU  56  -0.144  -2.482  -6.518
  435   HD13  LEU  56          HD13      LEU  56  -1.761  -3.095  -6.178
  436   HD21  LEU  56          HD21      LEU  56  -1.054  -4.743  -3.057
  437   HD22  LEU  56          HD22      LEU  56  -0.932  -5.680  -4.544
  438   HD23  LEU  56          HD23      LEU  56  -2.220  -4.491  -4.355
  439    H    ARG  57           HN       ARG  57   3.571  -2.956  -3.304
  440    HA   ARG  57           HA       ARG  57   5.662  -4.579  -4.357
  441    HB2  ARG  57           HB2      ARG  57   5.881  -2.117  -2.614
  442    HB3  ARG  57           HB1      ARG  57   7.169  -2.797  -3.601
  443    HG2  ARG  57           HG2      ARG  57   5.746  -2.406  -5.610
  444    HG3  ARG  57           HG1      ARG  57   4.597  -1.566  -4.566
  445    HD2  ARG  57           HD2      ARG  57   6.436  -0.025  -3.903
  446    HD3  ARG  57           HD1      ARG  57   7.463  -0.808  -5.100
  447    HE   ARG  57           HE       ARG  57   5.182  -0.047  -6.492
  448   HH11  ARG  57          HH11      ARG  57   7.674   1.588  -4.582
  449   HH12  ARG  57          HH12      ARG  57   7.547   3.072  -5.465
  450   HH21  ARG  57          HH21      ARG  57   5.045   1.924  -7.626
  451   HH22  ARG  57          HH22      ARG  57   6.054   3.265  -7.192
  452    H    TYR  58           HN       TYR  58   4.465  -4.112  -1.085
  453    HA   TYR  58           HA       TYR  58   6.712  -5.268   0.276
  454    HB2  TYR  58           HB2      TYR  58   5.014  -3.896   1.409
  455    HB3  TYR  58           HB1      TYR  58   3.797  -5.122   1.087
  456    HD1  TYR  58           HD2      TYR  58   6.823  -4.348   3.036
  457    HD2  TYR  58           HD1      TYR  58   3.613  -7.073   2.455
  458    HE1  TYR  58           HE2      TYR  58   7.378  -5.442   5.167
  459    HE2  TYR  58           HE1      TYR  58   4.153  -8.175   4.585
  460    HH   TYR  58           HH       TYR  58   6.191  -8.435   6.063
  461    H    LYS  59           HN       LYS  59   3.612  -6.576  -0.887
  462    HA   LYS  59           HA       LYS  59   4.274  -9.296  -0.083
  463    HB2  LYS  59           HB2      LYS  59   2.032  -8.227  -1.789
  464    HB3  LYS  59           HB1      LYS  59   2.142  -9.859  -1.155
  465    HG2  LYS  59           HG2      LYS  59   1.918  -7.345   0.486
  466    HG3  LYS  59           HG1      LYS  59   0.617  -8.490   0.158
  467    HD2  LYS  59           HD2      LYS  59   1.888 -10.246   1.312
  468    HD3  LYS  59           HD1      LYS  59   3.171  -9.085   1.654
  469    HE2  LYS  59           HE2      LYS  59   1.846  -9.239   3.619
  470    HE3  LYS  59           HE1      LYS  59   1.452  -7.700   2.856
  471    HZ1  LYS  59           HZ1      LYS  59  -0.510  -8.939   3.651
  472    HZ2  LYS  59           HZ2      LYS  59  -0.161 -10.174   2.551
  473    HZ3  LYS  59           HZ3      LYS  59  -0.560  -8.630   1.988
  474    H    LYS  60           HN       LYS  60   5.120  -7.347  -2.728
  475    HA   LYS  60           HA       LYS  60   6.222  -7.816  -4.664
  476    HB2  LYS  60           HB2      LYS  60   7.435  -9.508  -3.265
  477    HB3  LYS  60           HB1      LYS  60   6.272 -10.713  -3.799
  478    HG2  LYS  60           HG2      LYS  60   8.257 -10.926  -5.106
  479    HG3  LYS  60           HG1      LYS  60   6.975 -10.291  -6.136
  480    HD2  LYS  60           HD2      LYS  60   7.883  -8.008  -5.766
  481    HD3  LYS  60           HD1      LYS  60   9.218  -8.725  -4.862
  482    HE2  LYS  60           HE2      LYS  60   9.961  -8.302  -7.101
  483    HE3  LYS  60           HE1      LYS  60   9.802 -10.044  -6.888
  484    HZ1  LYS  60           HZ1      LYS  60   7.682  -9.964  -8.035
  485    HZ2  LYS  60           HZ2      LYS  60   8.894  -9.301  -9.009
  486    HZ3  LYS  60           HZ3      LYS  60   7.803  -8.285  -8.211
  487    H    LEU  61           HN       LEU  61   3.947  -7.244  -5.336
  488    HA   LEU  61           HA       LEU  61   3.249  -8.978  -7.504
  489    HB2  LEU  61           HB2      LEU  61   0.785  -9.235  -6.600
  490    HB3  LEU  61           HB1      LEU  61   2.026 -10.405  -6.209
  491    HG   LEU  61           HG       LEU  61   2.371  -9.285  -4.026
  492   HD11  LEU  61          HD11      LEU  61   0.816  -7.625  -3.238
  493   HD12  LEU  61          HD12      LEU  61  -0.052  -7.660  -4.770
  494   HD13  LEU  61          HD13      LEU  61   1.600  -7.045  -4.707
  495   HD21  LEU  61          HD21      LEU  61   0.891 -11.205  -4.196
  496   HD22  LEU  61          HD22      LEU  61  -0.460 -10.145  -4.601
  497   HD23  LEU  61          HD23      LEU  61   0.285 -10.055  -3.005
  498    H    TYR  62           HN       TYR  62   3.883  -6.160  -6.976
  499    HA   TYR  62           HA       TYR  62   1.625  -4.493  -7.181
  500    HB2  TYR  62           HB2      TYR  62   3.979  -3.789  -6.746
  501    HB3  TYR  62           HB1      TYR  62   4.336  -4.060  -8.446
  502    HD1  TYR  62           HD1      TYR  62   2.421  -1.958  -6.088
  503    HD2  TYR  62           HD2      TYR  62   3.767  -2.442 -10.096
  504    HE1  TYR  62           HE1      TYR  62   1.746   0.349  -6.588
  505    HE2  TYR  62           HE2      TYR  62   3.094  -0.132 -10.606
  506    HH   TYR  62           HH       TYR  62   2.376   2.137  -8.257
  507    H    ASN  63           HN       ASN  63   2.825  -6.726  -9.523
  508    HA   ASN  63           HA       ASN  63   1.967  -5.254 -11.861
  509    HB2  ASN  63           HB2      ASN  63   2.659  -8.171 -11.485
  510    HB3  ASN  63           HB1      ASN  63   2.361  -7.410 -13.043
  511   HD21  ASN  63          HD21      ASN  63   4.744  -8.764 -11.993
  512   HD22  ASN  63          HD22      ASN  63   6.064  -7.550 -12.113
  513    H    GLN  64           HN       GLN  64   0.725  -8.407 -10.600
  514    HA   GLN  64           HA       GLN  64  -1.799  -7.826 -12.003
  515    HB2  GLN  64           HB2      GLN  64  -0.680 -10.019 -12.281
  516    HB3  GLN  64           HB1      GLN  64  -0.944 -10.342 -10.574
  517    HG2  GLN  64           HG2      GLN  64  -3.317 -10.378 -10.883
  518    HG3  GLN  64           HG1      GLN  64  -3.153  -9.838 -12.553
  519   HE21  GLN  64          HE21      GLN  64  -2.746 -12.494 -10.305
  520   HE22  GLN  64          HE22      GLN  64  -2.609 -13.777 -11.557
  521    H    ALA  65           HN       ALA  65  -0.657  -7.216  -8.874
  522    HA   ALA  65           HA       ALA  65  -3.058  -8.027  -7.453
  523    HB1  ALA  65           HB1      ALA  65  -2.131  -6.803  -5.579
  524    HB2  ALA  65           HB2      ALA  65  -0.914  -6.078  -6.629
  525    HB3  ALA  65           HB3      ALA  65  -0.897  -7.816  -6.327
  526    H    ARG  66           HN       ARG  66  -1.857  -5.027  -8.926
  527    HA   ARG  66           HA       ARG  66  -4.015  -3.403  -7.910
  528    HB2  ARG  66           HB2      ARG  66  -1.800  -2.523  -8.597
  529    HB3  ARG  66           HB1      ARG  66  -2.198  -2.892 -10.269
  530    HG2  ARG  66           HG2      ARG  66  -3.985  -1.290 -10.258
  531    HG3  ARG  66           HG1      ARG  66  -3.778  -1.011  -8.528
  532    HD2  ARG  66           HD2      ARG  66  -2.770   0.782  -9.837
  533    HD3  ARG  66           HD1      ARG  66  -1.550  -0.108  -8.930
  534    HE   ARG  66           HE       ARG  66  -1.782  -1.231 -11.538
  535   HH11  ARG  66          HH11      ARG  66  -0.609   1.684  -9.909
  536   HH12  ARG  66          HH12      ARG  66   0.598   2.012 -11.106
  537   HH21  ARG  66          HH21      ARG  66  -0.179  -0.768 -13.086
  538   HH22  ARG  66          HH22      ARG  66   0.842   0.620 -12.911
  539    H    VAL  67           HN       VAL  67  -3.705  -5.567 -10.632
  540    HA   VAL  67           HA       VAL  67  -6.002  -4.329 -12.007
  541    HB   VAL  67           HB       VAL  67  -5.649  -5.944 -13.772
  542   HG11  VAL  67          HG11      VAL  67  -3.380  -5.322 -14.453
  543   HG12  VAL  67          HG12      VAL  67  -3.047  -4.762 -12.815
  544   HG13  VAL  67          HG13      VAL  67  -4.266  -3.947 -13.794
  545   HG21  VAL  67          HG21      VAL  67  -3.805  -7.581 -13.661
  546   HG22  VAL  67          HG22      VAL  67  -5.073  -7.907 -12.481
  547   HG23  VAL  67          HG23      VAL  67  -3.562  -7.160 -11.966
  548    H    LYS  68           HN       LYS  68  -5.204  -7.260 -10.165
  549    HA   LYS  68           HA       LYS  68  -7.685  -8.601 -10.687
  550    HB2  LYS  68           HB2      LYS  68  -5.551  -8.894  -8.597
  551    HB3  LYS  68           HB1      LYS  68  -7.029  -9.840  -8.510
  552    HG2  LYS  68           HG2      LYS  68  -5.147  -9.804 -10.861
  553    HG3  LYS  68           HG1      LYS  68  -5.166 -11.035  -9.596
  554    HD2  LYS  68           HD2      LYS  68  -7.545 -11.503 -10.186
  555    HD3  LYS  68           HD1      LYS  68  -7.380 -10.385 -11.541
  556    HE2  LYS  68           HE2      LYS  68  -7.056 -12.574 -12.402
  557    HE3  LYS  68           HE1      LYS  68  -5.472 -11.802 -12.348
  558    HZ1  LYS  68           HZ1      LYS  68  -6.537 -13.741 -10.364
  559    HZ2  LYS  68           HZ2      LYS  68  -5.031 -12.980 -10.269
  560    HZ3  LYS  68           HZ3      LYS  68  -5.354 -14.058 -11.530
  561    H    TYR  69           HN       TYR  69  -6.792  -6.056  -8.472
  562    HA   TYR  69           HA       TYR  69  -9.519  -6.267  -7.284
  563    HB2  TYR  69           HB2      TYR  69  -6.899  -5.556  -5.976
  564    HB3  TYR  69           HB1      TYR  69  -8.445  -5.116  -5.265
  565    HD1  TYR  69           HD1      TYR  69  -6.283  -7.946  -6.220
  566    HD2  TYR  69           HD2      TYR  69  -9.804  -6.733  -4.165
  567    HE1  TYR  69           HE1      TYR  69  -6.434 -10.167  -5.179
  568    HE2  TYR  69           HE2      TYR  69  -9.962  -8.947  -3.118
  569    HH   TYR  69           HH       TYR  69  -7.466 -11.151  -3.075
  570    H    SER  70           HN       SER  70 -10.420  -4.225  -6.484
  571    HA   SER  70           HA       SER  70  -9.953  -2.136  -8.476
  572    HB2  SER  70           HB2      SER  70 -11.933  -2.386  -6.206
  573    HB3  SER  70           HB1      SER  70 -11.878  -1.009  -7.303
  574    HG   SER  70           HG       SER  70 -13.078  -3.345  -7.663
  575    H    LEU  71           HN       LEU  71  -7.802  -1.518  -7.912
  576    HA   LEU  71           HA       LEU  71  -7.525  -0.112  -5.314
  577    HB2  LEU  71           HB2      LEU  71  -5.516  -0.874  -7.436
  578    HB3  LEU  71           HB1      LEU  71  -5.112   0.087  -6.027
  579    HG   LEU  71           HG       LEU  71  -5.930  -1.869  -4.621
  580   HD11  LEU  71          HD11      LEU  71  -7.211  -3.115  -6.163
  581   HD12  LEU  71          HD12      LEU  71  -5.773  -4.076  -5.817
  582   HD13  LEU  71          HD13      LEU  71  -5.888  -3.173  -7.327
  583   HD21  LEU  71          HD21      LEU  71  -3.525  -2.179  -6.408
  584   HD22  LEU  71          HD22      LEU  71  -3.829  -3.146  -4.965
  585   HD23  LEU  71          HD23      LEU  71  -3.586  -1.405  -4.824
  586    H    LEU  72           HN       LEU  72  -6.592   0.500  -8.730
  587    HA   LEU  72           HA       LEU  72  -6.986   3.394  -8.200
  588    HB2  LEU  72           HB2      LEU  72  -5.469   1.846 -10.273
  589    HB3  LEU  72           HB1      LEU  72  -5.905   3.518 -10.564
  590    HG   LEU  72           HG       LEU  72  -3.618   3.330  -9.730
  591   HD11  LEU  72          HD11      LEU  72  -3.794   4.913  -7.854
  592   HD12  LEU  72          HD12      LEU  72  -5.526   4.589  -7.767
  593   HD13  LEU  72          HD13      LEU  72  -4.841   5.345  -9.205
  594   HD21  LEU  72          HD21      LEU  72  -4.794   2.257  -7.172
  595   HD22  LEU  72          HD22      LEU  72  -3.090   2.498  -7.556
  596   HD23  LEU  72          HD23      LEU  72  -4.015   1.253  -8.394
  597    H    GLU  73           HN       GLU  73  -9.227   3.476  -8.230
  598    HA   GLU  73           HA       GLU  73 -10.519   2.721 -10.796
  599    HB2  GLU  73           HB2      GLU  73 -11.814   3.472  -8.169
  600    HB3  GLU  73           HB1      GLU  73 -12.622   2.820  -9.588
  601    HG2  GLU  73           HG2      GLU  73 -10.600   1.390  -7.875
  602    HG3  GLU  73           HG1      GLU  73 -12.340   1.119  -7.884
  Start of MODEL    3
    1    H1   SER   1           HT1      SER   1  -0.681  13.829   9.270
    2    H2   SER   1           HT2      SER   1  -0.979  15.023   8.109
    3    H3   SER   1           HT3      SER   1  -1.349  15.313   9.733
    4    HA   SER   1           HA       SER   1   0.648  16.472   9.145
    5    HB2  SER   1           HB2      SER   1   2.187  15.452  10.844
    6    HB3  SER   1           HB1      SER   1   0.539  15.683  11.424
    7    HG   SER   1           HG       SER   1   1.051  13.644  12.005
    8    H    ASP   2           HN       ASP   2   1.211  12.921   8.901
    9    HA   ASP   2           HA       ASP   2   2.733  13.331   6.442
   10    HB2  ASP   2           HB2      ASP   2   4.091  12.414   8.984
   11    HB3  ASP   2           HB1      ASP   2   4.744  12.082   7.384
   12    H    VAL   3           HN       VAL   3   3.463  11.242   5.487
   13    HA   VAL   3           HA       VAL   3   1.344   9.326   5.627
   14    HB   VAL   3           HB       VAL   3   2.713   9.680   3.602
   15   HG11  VAL   3          HG11      VAL   3   4.881   8.155   5.042
   16   HG12  VAL   3          HG12      VAL   3   4.900   9.895   4.759
   17   HG13  VAL   3          HG13      VAL   3   4.934   8.781   3.394
   18   HG21  VAL   3          HG21      VAL   3   3.021   7.254   3.044
   19   HG22  VAL   3          HG22      VAL   3   1.436   7.674   3.689
   20   HG23  VAL   3          HG23      VAL   3   2.627   6.885   4.722
   21    H    TRP   4           HN       TRP   4   4.564   9.479   7.100
   22    HA   TRP   4           HA       TRP   4   4.423   6.759   8.120
   23    HB2  TRP   4           HB2      TRP   4   6.485   8.399   7.640
   24    HB3  TRP   4           HB1      TRP   4   6.254   8.760   9.348
   25    HD1  TRP   4           HD1      TRP   4   5.913   6.170  10.781
   26    HE1  TRP   4           HE1      TRP   4   7.628   4.223  10.727
   27    HE3  TRP   4           HE3      TRP   4   8.324   7.418   6.447
   28    HZ2  TRP   4           HZ2      TRP   4   9.721   3.383   9.022
   29    HZ3  TRP   4           HZ3      TRP   4  10.174   5.989   5.675
   30    HH2  TRP   4           HH2      TRP   4  10.857   4.014   6.938
   31    H    SER   5           HN       SER   5   3.740  10.021   9.360
   32    HA   SER   5           HA       SER   5   3.404   9.278  12.095
   33    HB2  SER   5           HB2      SER   5   2.036  11.497  10.543
   34    HB3  SER   5           HB1      SER   5   2.135  11.383  12.299
   35    HG   SER   5           HG       SER   5   3.742  12.755  11.216
   36    H    LEU   6           HN       LEU   6   1.043   9.644   9.430
   37    HA   LEU   6           HA       LEU   6  -0.953   8.196  11.089
   38    HB2  LEU   6           HB2      LEU   6  -1.288   9.739   8.514
   39    HB3  LEU   6           HB1      LEU   6  -2.584   8.966   9.404
   40    HG   LEU   6           HG       LEU   6  -0.901  11.267  10.406
   41   HD11  LEU   6          HD11      LEU   6  -2.407  11.941   8.624
   42   HD12  LEU   6          HD12      LEU   6  -2.961  12.570  10.176
   43   HD13  LEU   6          HD13      LEU   6  -3.759  11.172   9.454
   44   HD21  LEU   6          HD21      LEU   6  -2.548  11.348  12.239
   45   HD22  LEU   6          HD22      LEU   6  -1.613   9.854  12.239
   46   HD23  LEU   6          HD23      LEU   6  -3.268   9.856  11.634
   47    H    SER   7           HN       SER   7  -0.304   6.080  10.907
   48    HA   SER   7           HA       SER   7  -0.518   4.944   8.151
   49    HB2  SER   7           HB2      SER   7   1.462   4.156  10.301
   50    HB3  SER   7           HB1      SER   7   1.259   3.329   8.760
   51    HG   SER   7           HG       SER   7   2.343   4.859   7.798
   52    H    LYS   8           HN       LYS   8  -2.258   5.145  10.776
   53    HA   LYS   8           HA       LYS   8  -2.721   2.263  11.185
   54    HB2  LYS   8           HB2      LYS   8  -3.946   4.697  12.486
   55    HB3  LYS   8           HB1      LYS   8  -4.331   3.037  12.917
   56    HG2  LYS   8           HG2      LYS   8  -1.613   4.318  13.134
   57    HG3  LYS   8           HG1      LYS   8  -2.733   4.035  14.468
   58    HD2  LYS   8           HD2      LYS   8  -2.589   1.637  14.118
   59    HD3  LYS   8           HD1      LYS   8  -1.547   1.882  12.716
   60    HE2  LYS   8           HE2      LYS   8  -0.218   1.255  14.644
   61    HE3  LYS   8           HE1      LYS   8   0.144   2.913  14.169
   62    HZ1  LYS   8           HZ1      LYS   8  -1.208   3.728  15.956
   63    HZ2  LYS   8           HZ2      LYS   8  -0.101   2.617  16.590
   64    HZ3  LYS   8           HZ3      LYS   8  -1.715   2.166  16.362
   65    H    THR   9           HN       THR   9  -4.170   4.984   9.505
   66    HA   THR   9           HA       THR   9  -6.811   3.938   9.248
   67    HB   THR   9           HB       THR   9  -6.990   5.447   7.260
   68    HG1  THR   9           HG1      THR   9  -5.225   6.202   6.370
   69   HG21  THR   9          HG21      THR   9  -6.690   7.534   8.519
   70   HG22  THR   9          HG22      THR   9  -5.748   6.665   9.730
   71   HG23  THR   9          HG23      THR   9  -7.457   6.288   9.504
   72    H    SER  10           HN       SER  10  -7.227   1.946   8.518
   73    HA   SER  10           HA       SER  10  -5.623   0.804   6.343
   74    HB2  SER  10           HB2      SER  10  -8.033  -0.327   7.789
   75    HB3  SER  10           HB1      SER  10  -6.963  -1.217   6.708
   76    HG   SER  10           HG       SER  10  -6.545  -0.358   9.322
   77    H    MET  11           HN       MET  11  -6.894  -0.480   4.608
   78    HA   MET  11           HA       MET  11  -9.198   1.123   3.629
   79    HB2  MET  11           HB2      MET  11  -7.208   2.001   2.503
   80    HB3  MET  11           HB1      MET  11  -6.772   0.378   1.984
   81    HG2  MET  11           HG2      MET  11  -7.752   1.528   0.143
   82    HG3  MET  11           HG1      MET  11  -8.874   0.279   0.680
   83    HE1  MET  11           HE1      MET  11  -9.791   2.611  -1.259
   84    HE2  MET  11           HE2      MET  11 -11.333   3.049  -0.524
   85    HE3  MET  11           HE3      MET  11 -10.864   1.353  -0.645
   86    H    THR  12           HN       THR  12 -10.700   0.020   2.385
   87    HA   THR  12           HA       THR  12 -10.482  -2.915   2.634
   88    HB   THR  12           HB       THR  12 -12.856  -1.241   1.794
   89    HG1  THR  12           HG1      THR  12 -12.706  -0.792   3.894
   90   HG21  THR  12          HG21      THR  12 -13.004  -3.532   0.976
   91   HG22  THR  12          HG22      THR  12 -14.152  -3.279   2.291
   92   HG23  THR  12          HG23      THR  12 -12.648  -4.150   2.590
   93    H    PHE  13           HN       PHE  13 -10.194  -4.289   1.025
   94    HA   PHE  13           HA       PHE  13  -9.921  -3.217  -1.720
   95    HB2  PHE  13           HB2      PHE  13  -9.102  -5.788  -0.389
   96    HB3  PHE  13           HB1      PHE  13  -9.026  -5.570  -2.132
   97    HD1  PHE  13           HD1      PHE  13  -7.880  -3.965   1.028
   98    HD2  PHE  13           HD2      PHE  13  -7.093  -4.762  -3.076
   99    HE1  PHE  13           HE1      PHE  13  -5.660  -2.940   1.259
  100    HE2  PHE  13           HE2      PHE  13  -4.869  -3.737  -2.852
  101    HZ   PHE  13           HZ       PHE  13  -4.149  -2.823  -0.682
  102    H    GLN  14           HN       GLN  14 -11.085  -3.845  -3.459
  103    HA   GLN  14           HA       GLN  14 -13.404  -5.624  -2.861
  104    HB2  GLN  14           HB2      GLN  14 -14.120  -3.295  -3.101
  105    HB3  GLN  14           HB1      GLN  14 -13.321  -3.193  -4.662
  106    HG2  GLN  14           HG2      GLN  14 -15.695  -3.460  -4.961
  107    HG3  GLN  14           HG1      GLN  14 -14.851  -4.891  -5.546
  108   HE21  GLN  14          HE21      GLN  14 -15.114  -6.856  -4.534
  109   HE22  GLN  14          HE22      GLN  14 -16.373  -7.117  -3.277
  110    HA   PRO  15           HA       PRO  15 -11.047  -7.961  -5.968
  111    HB2  PRO  15           HB2      PRO  15 -12.872 -10.071  -5.864
  112    HB3  PRO  15           HB1      PRO  15 -11.408  -9.924  -4.891
  113    HG2  PRO  15           HG2      PRO  15 -14.229  -9.276  -4.181
  114    HG3  PRO  15           HG1      PRO  15 -12.955  -9.997  -3.180
  115    HD2  PRO  15           HD2      PRO  15 -13.652  -7.430  -2.904
  116    HD3  PRO  15           HD1      PRO  15 -11.960  -7.943  -2.750
  117    H    LYS  16           HN       LYS  16 -11.307  -8.254  -8.145
  118    HA   LYS  16           HA       LYS  16 -13.600  -6.953  -9.355
  119    HB2  LYS  16           HB2      LYS  16 -11.255  -8.461 -10.528
  120    HB3  LYS  16           HB1      LYS  16 -12.492  -7.680 -11.503
  121    HG2  LYS  16           HG2      LYS  16 -10.718  -6.278  -9.515
  122    HG3  LYS  16           HG1      LYS  16 -10.461  -6.318 -11.260
  123    HD2  LYS  16           HD2      LYS  16 -12.600  -5.188 -11.603
  124    HD3  LYS  16           HD1      LYS  16 -12.874  -5.166  -9.860
  125    HE2  LYS  16           HE2      LYS  16 -10.827  -3.813  -9.590
  126    HE3  LYS  16           HE1      LYS  16 -10.641  -3.782 -11.343
  127    HZ1  LYS  16           HZ1      LYS  16 -12.919  -2.654  -9.805
  128    HZ2  LYS  16           HZ2      LYS  16 -12.799  -2.666 -11.492
  129    HZ3  LYS  16           HZ3      LYS  16 -11.697  -1.771 -10.574
  130    H    LYS  17           HN       LYS  17 -12.413 -10.302  -9.048
  131    HA   LYS  17           HA       LYS  17 -14.923 -11.266 -10.321
  132    HB2  LYS  17           HB2      LYS  17 -12.309 -12.672  -9.748
  133    HB3  LYS  17           HB1      LYS  17 -13.734 -13.477 -10.382
  134    HG2  LYS  17           HG2      LYS  17 -12.383 -13.063 -12.245
  135    HG3  LYS  17           HG1      LYS  17 -13.639 -11.828 -12.308
  136    HD2  LYS  17           HD2      LYS  17 -11.444 -10.882 -12.813
  137    HD3  LYS  17           HD1      LYS  17 -12.096 -10.204 -11.324
  138    HE2  LYS  17           HE2      LYS  17  -9.743 -10.704 -11.050
  139    HE3  LYS  17           HE1      LYS  17 -10.712 -11.757 -10.024
  140    HZ1  LYS  17           HZ1      LYS  17  -9.600 -12.531 -12.668
  141    HZ2  LYS  17           HZ2      LYS  17 -10.430 -13.541 -11.593
  142    HZ3  LYS  17           HZ3      LYS  17  -8.908 -12.932 -11.177
  143    H    ALA  18           HN       ALA  18 -15.699 -13.447  -9.393
  144    HA   ALA  18           HA       ALA  18 -16.448 -12.950  -6.647
  145    HB1  ALA  18           HB1      ALA  18 -16.884 -15.411  -8.336
  146    HB2  ALA  18           HB2      ALA  18 -17.957 -14.015  -8.261
  147    HB3  ALA  18           HB3      ALA  18 -17.716 -15.017  -6.830
  148    H    SER  19           HN       SER  19 -14.154 -15.117  -8.267
  149    HA   SER  19           HA       SER  19 -13.571 -16.801  -6.069
  150    HB2  SER  19           HB2      SER  19 -12.851 -17.250  -8.385
  151    HB3  SER  19           HB1      SER  19 -11.712 -15.908  -8.286
  152    HG   SER  19           HG       SER  19 -11.490 -18.454  -7.341
  153    H    LEU  20           HN       LEU  20 -12.238 -13.625  -6.978
  154    HA   LEU  20           HA       LEU  20 -10.157 -13.627  -5.012
  155    HB2  LEU  20           HB2      LEU  20 -11.583 -11.305  -6.297
  156    HB3  LEU  20           HB1      LEU  20 -10.078 -11.204  -5.416
  157    HG   LEU  20           HG       LEU  20 -10.508 -12.661  -8.024
  158   HD11  LEU  20          HD11      LEU  20 -10.510 -10.249  -8.287
  159   HD12  LEU  20          HD12      LEU  20  -9.021 -10.936  -8.935
  160   HD13  LEU  20          HD13      LEU  20  -9.011 -10.128  -7.367
  161   HD21  LEU  20          HD21      LEU  20  -8.071 -12.970  -8.002
  162   HD22  LEU  20          HD22      LEU  20  -8.859 -13.813  -6.668
  163   HD23  LEU  20          HD23      LEU  20  -8.011 -12.295  -6.373
  164    H    GLN  21           HN       GLN  21  -9.981 -12.523  -3.029
  165    HA   GLN  21           HA       GLN  21 -12.615 -12.033  -1.711
  166    HB2  GLN  21           HB2      GLN  21 -11.506 -14.101  -0.932
  167    HB3  GLN  21           HB1      GLN  21 -10.109 -13.152  -0.445
  168    HG2  GLN  21           HG2      GLN  21 -11.549 -11.910   1.131
  169    HG3  GLN  21           HG1      GLN  21 -12.893 -12.955   0.684
  170   HE21  GLN  21          HE21      GLN  21 -11.304 -15.379   0.456
  171   HE22  GLN  21          HE22      GLN  21 -10.877 -15.842   2.139
  172    HA   PRO  22           HA       PRO  22 -11.321  -7.871  -0.904
  173    HB2  PRO  22           HB2      PRO  22 -12.782  -8.231   1.663
  174    HB3  PRO  22           HB1      PRO  22 -12.976  -6.991   0.421
  175    HG2  PRO  22           HG2      PRO  22 -14.761  -8.939   0.660
  176    HG3  PRO  22           HG1      PRO  22 -14.257  -8.369  -0.942
  177    HD2  PRO  22           HD2      PRO  22 -13.448 -10.844   0.532
  178    HD3  PRO  22           HD1      PRO  22 -13.795 -10.622  -1.196
  179    H    LEU  23           HN       LEU  23 -10.362  -6.500   0.883
  180    HA   LEU  23           HA       LEU  23  -8.845  -8.001   2.907
  181    HB2  LEU  23           HB2      LEU  23  -7.514  -8.102   0.778
  182    HB3  LEU  23           HB1      LEU  23  -7.391  -6.357   0.840
  183    HG   LEU  23           HG       LEU  23  -6.468  -7.874   3.228
  184   HD11  LEU  23          HD11      LEU  23  -5.556  -9.154   1.340
  185   HD12  LEU  23          HD12      LEU  23  -4.298  -8.302   2.233
  186   HD13  LEU  23          HD13      LEU  23  -4.859  -7.673   0.685
  187   HD21  LEU  23          HD21      LEU  23  -4.845  -6.088   3.334
  188   HD22  LEU  23          HD22      LEU  23  -6.454  -5.401   3.124
  189   HD23  LEU  23          HD23      LEU  23  -5.349  -5.491   1.754
  190    H    THR  24           HN       THR  24  -7.955  -6.702   4.568
  191    HA   THR  24           HA       THR  24  -8.502  -3.795   4.361
  192    HB   THR  24           HB       THR  24  -9.535  -5.439   6.683
  193    HG1  THR  24           HG1      THR  24 -11.366  -5.550   5.620
  194   HG21  THR  24          HG21      THR  24  -9.871  -2.514   5.994
  195   HG22  THR  24          HG22      THR  24  -8.851  -3.158   7.283
  196   HG23  THR  24          HG23      THR  24 -10.603  -3.344   7.367
  197    H    ILE  25           HN       ILE  25  -6.394  -3.202   4.473
  198    HA   ILE  25           HA       ILE  25  -5.117  -3.569   7.107
  199    HB   ILE  25           HB       ILE  25  -4.342  -5.441   5.556
  200   HG12  ILE  25          HG12      ILE  25  -1.927  -5.131   6.234
  201   HG13  ILE  25          HG11      ILE  25  -2.366  -3.532   6.818
  202   HG21  ILE  25          HG21      ILE  25  -2.772  -3.215   4.266
  203   HG22  ILE  25          HG22      ILE  25  -4.154  -4.031   3.534
  204   HG23  ILE  25          HG23      ILE  25  -2.684  -4.936   3.890
  205   HD11  ILE  25          HD11      ILE  25  -2.274  -5.225   8.597
  206   HD12  ILE  25          HD12      ILE  25  -3.573  -6.108   7.795
  207   HD13  ILE  25          HD13      ILE  25  -3.870  -4.492   8.435
  208    H    SER  26           HN       SER  26  -3.377  -2.088   7.546
  209    HA   SER  26           HA       SER  26  -3.460   0.294   5.744
  210    HB2  SER  26           HB2      SER  26  -4.522   0.648   7.955
  211    HB3  SER  26           HB1      SER  26  -3.001   0.226   8.738
  212    HG   SER  26           HG       SER  26  -3.453   2.416   6.987
  213    H    LEU  27           HN       LEU  27  -1.542   1.827   6.291
  214    HA   LEU  27           HA       LEU  27   0.841   0.796   5.276
  215    HB2  LEU  27           HB2      LEU  27   0.492   3.090   7.186
  216    HB3  LEU  27           HB1      LEU  27   1.905   2.804   6.189
  217    HG   LEU  27           HG       LEU  27  -0.867   3.396   5.143
  218   HD11  LEU  27          HD11      LEU  27   0.097   5.564   4.495
  219   HD12  LEU  27          HD12      LEU  27   1.579   5.146   5.356
  220   HD13  LEU  27          HD13      LEU  27   0.066   5.335   6.243
  221   HD21  LEU  27          HD21      LEU  27   1.785   3.098   3.738
  222   HD22  LEU  27          HD22      LEU  27   0.300   3.685   2.989
  223   HD23  LEU  27          HD23      LEU  27   0.388   2.032   3.595
  224    H    ASP  28           HN       ASP  28   0.366   1.686   8.710
  225    HA   ASP  28           HA       ASP  28   2.812   0.519   9.580
  226    HB2  ASP  28           HB2      ASP  28   1.504   2.245  10.813
  227    HB3  ASP  28           HB1      ASP  28   0.317   1.010  11.216
  228    H    GLU  29           HN       GLU  29  -0.484  -0.772   9.355
  229    HA   GLU  29           HA       GLU  29   0.136  -3.193  10.802
  230    HB2  GLU  29           HB2      GLU  29  -2.133  -2.769   8.864
  231    HB3  GLU  29           HB1      GLU  29  -2.054  -3.928  10.180
  232    HG2  GLU  29           HG2      GLU  29  -2.397  -0.957  10.326
  233    HG3  GLU  29           HG1      GLU  29  -3.474  -2.220  10.915
  234    H    LEU  30           HN       LEU  30   0.775  -2.176   7.554
  235    HA   LEU  30           HA       LEU  30   1.124  -5.035   6.802
  236    HB2  LEU  30           HB2      LEU  30  -0.551  -3.680   5.501
  237    HB3  LEU  30           HB1      LEU  30   0.779  -2.701   4.919
  238    HG   LEU  30           HG       LEU  30   1.759  -4.708   3.848
  239   HD11  LEU  30          HD11      LEU  30  -0.781  -6.035   4.780
  240   HD12  LEU  30          HD12      LEU  30   0.863  -6.432   5.280
  241   HD13  LEU  30          HD13      LEU  30   0.354  -6.716   3.617
  242   HD21  LEU  30          HD21      LEU  30  -1.098  -4.180   3.048
  243   HD22  LEU  30          HD22      LEU  30   0.181  -4.831   2.023
  244   HD23  LEU  30          HD23      LEU  30   0.283  -3.173   2.615
  245    H    PHE  31           HN       PHE  31   2.996  -2.744   8.007
  246    HA   PHE  31           HA       PHE  31   5.230  -3.655   6.319
  247    HB2  PHE  31           HB2      PHE  31   4.993  -0.779   7.245
  248    HB3  PHE  31           HB1      PHE  31   6.337  -1.451   6.330
  249    HD1  PHE  31           HD1      PHE  31   5.112  -2.953   4.212
  250    HD2  PHE  31           HD2      PHE  31   3.881   0.735   5.935
  251    HE1  PHE  31           HE1      PHE  31   3.971  -2.358   2.116
  252    HE2  PHE  31           HE2      PHE  31   2.737   1.334   3.845
  253    HZ   PHE  31           HZ       PHE  31   2.779  -0.216   1.934
  254    H    SER  32           HN       SER  32   7.174  -4.089   7.334
  255    HA   SER  32           HA       SER  32   7.216  -3.602  10.265
  256    HB2  SER  32           HB2      SER  32   8.133  -5.881  10.575
  257    HB3  SER  32           HB1      SER  32   6.494  -5.886   9.932
  258    HG   SER  32           HG       SER  32   8.816  -6.798   8.812
  259    H    SER  33           HN       SER  33   8.588  -2.276   7.933
  260    HA   SER  33           HA       SER  33  11.284  -2.333   9.037
  261    HB2  SER  33           HB2      SER  33  10.792  -3.288   6.213
  262    HB3  SER  33           HB1      SER  33  12.374  -2.828   6.840
  263    HG   SER  33           HG       SER  33  12.439  -4.603   8.037
  264    H    ARG  34           HN       ARG  34  12.382  -0.463   8.760
  265    HA   ARG  34           HA       ARG  34  10.897   1.795   7.824
  266    HB2  ARG  34           HB2      ARG  34  13.755   1.377   8.656
  267    HB3  ARG  34           HB1      ARG  34  13.235   2.920   7.994
  268    HG2  ARG  34           HG2      ARG  34  13.189   3.016  10.394
  269    HG3  ARG  34           HG1      ARG  34  11.539   3.083   9.776
  270    HD2  ARG  34           HD2      ARG  34  11.327   0.653  10.224
  271    HD3  ARG  34           HD1      ARG  34  12.934   0.679  10.947
  272    HE   ARG  34           HE       ARG  34  11.432   2.653  12.256
  273   HH11  ARG  34          HH11      ARG  34  11.358  -0.863  11.838
  274   HH12  ARG  34          HH12      ARG  34  10.596  -1.150  13.367
  275   HH21  ARG  34          HH21      ARG  34  10.429   2.231  14.259
  276   HH22  ARG  34          HH22      ARG  34  10.065   0.607  14.739
  277    H    GLY  35           HN       GLY  35  13.727   0.063   6.453
  278    HA2  GLY  35           HA2      GLY  35  13.890   1.642   4.084
  279    HA3  GLY  35           HA1      GLY  35  14.505   0.007   4.271
  280    H    GLU  36           HN       GLU  36  11.954  -1.204   4.926
  281    HA   GLU  36           HA       GLU  36  11.022  -1.816   2.316
  282    HB2  GLU  36           HB2      GLU  36  10.689  -3.327   4.195
  283    HB3  GLU  36           HB1      GLU  36   9.674  -2.145   5.005
  284    HG2  GLU  36           HG2      GLU  36   8.287  -3.836   4.053
  285    HG3  GLU  36           HG1      GLU  36   8.041  -2.336   3.162
  286    H    PHE  37           HN       PHE  37   9.892   0.472   4.785
  287    HA   PHE  37           HA       PHE  37   7.506   1.295   3.488
  288    HB2  PHE  37           HB2      PHE  37   8.457   1.844   5.863
  289    HB3  PHE  37           HB1      PHE  37   9.219   3.207   5.052
  290    HD1  PHE  37           HD1      PHE  37   7.888   5.035   4.172
  291    HD2  PHE  37           HD2      PHE  37   6.071   1.746   6.173
  292    HE1  PHE  37           HE1      PHE  37   5.811   6.332   4.411
  293    HE2  PHE  37           HE2      PHE  37   3.989   3.036   6.413
  294    HZ   PHE  37           HZ       PHE  37   3.858   5.333   5.532
  295    H    ILE  38           HN       ILE  38  10.858   2.524   3.276
  296    HA   ILE  38           HA       ILE  38  10.419   4.658   1.529
  297    HB   ILE  38           HB       ILE  38  12.801   2.799   1.600
  298   HG12  ILE  38          HG12      ILE  38  12.421   3.747   3.779
  299   HG13  ILE  38          HG11      ILE  38  13.771   4.604   3.045
  300   HG21  ILE  38          HG21      ILE  38  12.490   5.565   0.441
  301   HG22  ILE  38          HG22      ILE  38  12.849   4.076  -0.434
  302   HG23  ILE  38          HG23      ILE  38  14.035   4.751   0.683
  303   HD11  ILE  38          HD11      ILE  38  12.299   6.140   4.197
  304   HD12  ILE  38          HD12      ILE  38  10.932   5.590   3.228
  305   HD13  ILE  38          HD13      ILE  38  12.269   6.448   2.461
  306    H    SER  39           HN       SER  39  11.286   1.264   0.620
  307    HA   SER  39           HA       SER  39  11.196   1.729  -2.171
  308    HB2  SER  39           HB2      SER  39  10.825  -0.764  -2.347
  309    HB3  SER  39           HB1      SER  39  12.192  -0.300  -1.336
  310    HG   SER  39           HG       SER  39  11.209  -1.091   0.359
  311    H    VAL  40           HN       VAL  40   8.658  -0.043  -0.285
  312    HA   VAL  40           HA       VAL  40   6.693  -0.297  -2.028
  313    HB   VAL  40           HB       VAL  40   4.984   0.153  -0.296
  314   HG11  VAL  40          HG11      VAL  40   5.801  -1.547   1.290
  315   HG12  VAL  40          HG12      VAL  40   7.411  -1.398   0.589
  316   HG13  VAL  40          HG13      VAL  40   6.075  -2.000  -0.391
  317   HG21  VAL  40          HG21      VAL  40   7.322   1.040   1.386
  318   HG22  VAL  40          HG22      VAL  40   5.661   0.830   1.936
  319   HG23  VAL  40          HG23      VAL  40   6.050   2.090   0.766
  320    H    GLY  41           HN       GLY  41   7.433   2.989  -0.686
  321    HA2  GLY  41           HA2      GLY  41   6.990   4.652  -2.572
  322    HA3  GLY  41           HA1      GLY  41   5.356   4.007  -2.558
  323    H    GLY  42           HN       GLY  42   7.485   4.654   0.247
  324    HA2  GLY  42           HA2      GLY  42   5.440   6.653   1.120
  325    HA3  GLY  42           HA1      GLY  42   6.245   5.553   2.218
  326    H    ASP  43           HN       ASP  43   6.445   8.486   0.384
  327    HA   ASP  43           HA       ASP  43   9.161   9.048   1.388
  328    HB2  ASP  43           HB2      ASP  43   7.269  10.622  -0.367
  329    HB3  ASP  43           HB1      ASP  43   8.845  11.224   0.138
  330    H    GLY  44           HN       GLY  44   6.335  11.255   1.249
  331    HA2  GLY  44           HA2      GLY  44   6.344  11.454   4.197
  332    HA3  GLY  44           HA1      GLY  44   6.829  12.895   3.319
  333    H    ARG  45           HN       ARG  45   5.288  13.670   1.610
  334    HA   ARG  45           HA       ARG  45   2.619  13.723   2.811
  335    HB2  ARG  45           HB2      ARG  45   3.839  15.166   0.454
  336    HB3  ARG  45           HB1      ARG  45   2.158  15.356   0.933
  337    HG2  ARG  45           HG2      ARG  45   3.304  17.177   1.876
  338    HG3  ARG  45           HG1      ARG  45   3.011  16.055   3.204
  339    HD2  ARG  45           HD2      ARG  45   5.268  16.962   3.310
  340    HD3  ARG  45           HD1      ARG  45   5.298  15.225   3.022
  341    HE   ARG  45           HE       ARG  45   5.406  16.758   0.566
  342   HH11  ARG  45          HH11      ARG  45   7.341  15.519   3.260
  343   HH12  ARG  45          HH12      ARG  45   8.815  15.506   2.353
  344   HH21  ARG  45          HH21      ARG  45   7.373  16.724  -0.593
  345   HH22  ARG  45          HH22      ARG  45   8.836  16.191   0.168
  346    H    MET  46           HN       MET  46   1.393  11.980   2.477
  347    HA   MET  46           HA       MET  46   1.532  10.554  -0.075
  348    HB2  MET  46           HB2      MET  46   1.312   9.423   2.147
  349    HB3  MET  46           HB1      MET  46  -0.304  10.099   2.282
  350    HG2  MET  46           HG2      MET  46  -0.381   7.797   1.540
  351    HG3  MET  46           HG1      MET  46  -0.998   8.876   0.298
  352    HE1  MET  46           HE1      MET  46   2.764   8.196   1.274
  353    HE2  MET  46           HE2      MET  46   3.172   6.904   0.146
  354    HE3  MET  46           HE3      MET  46   2.002   6.613   1.433
  355    H    SER  47           HN       SER  47  -0.500   9.936  -1.236
  356    HA   SER  47           HA       SER  47  -2.066  12.387  -1.681
  357    HB2  SER  47           HB2      SER  47  -1.091  11.121  -3.596
  358    HB3  SER  47           HB1      SER  47  -2.137   9.761  -3.189
  359    HG   SER  47           HG       SER  47  -2.798  12.269  -4.257
  360    H    HIS  48           HN       HIS  48  -2.937   8.912  -1.589
  361    HA   HIS  48           HA       HIS  48  -4.845   8.892   0.454
  362    HB2  HIS  48           HB2      HIS  48  -6.034  10.678  -0.740
  363    HB3  HIS  48           HB1      HIS  48  -6.066   9.686  -2.192
  364    HD1  HIS  48           HD1      HIS  48  -7.893  10.413   0.919
  365    HD2  HIS  48           HD2      HIS  48  -7.768   7.345  -1.936
  366    HE1  HIS  48           HE1      HIS  48 -10.003   9.042   1.245
  367    HE2  HIS  48           HE2      HIS  48  -9.878   7.126  -0.418
  368    H    LYS  49           HN       LYS  49  -4.640   8.022  -3.024
  369    HA   LYS  49           HA       LYS  49  -5.480   5.258  -2.434
  370    HB2  LYS  49           HB2      LYS  49  -4.733   6.809  -4.908
  371    HB3  LYS  49           HB1      LYS  49  -4.987   5.073  -4.936
  372    HG2  LYS  49           HG2      LYS  49  -7.000   7.177  -4.171
  373    HG3  LYS  49           HG1      LYS  49  -6.994   6.200  -5.638
  374    HD2  LYS  49           HD2      LYS  49  -7.321   5.162  -2.821
  375    HD3  LYS  49           HD1      LYS  49  -8.612   5.354  -4.009
  376    HE2  LYS  49           HE2      LYS  49  -7.521   3.728  -5.467
  377    HE3  LYS  49           HE1      LYS  49  -6.208   3.552  -4.303
  378    HZ1  LYS  49           HZ1      LYS  49  -9.059   2.864  -3.815
  379    HZ2  LYS  49           HZ2      LYS  49  -7.803   2.700  -2.694
  380    HZ3  LYS  49           HZ3      LYS  49  -7.808   1.760  -4.099
  381    H    GLU  50           HN       GLU  50  -2.534   7.097  -3.133
  382    HA   GLU  50           HA       GLU  50  -0.841   4.974  -3.914
  383    HB2  GLU  50           HB2      GLU  50  -0.273   7.343  -4.142
  384    HB3  GLU  50           HB1      GLU  50  -0.154   7.493  -2.396
  385    HG2  GLU  50           HG2      GLU  50   1.752   6.056  -2.331
  386    HG3  GLU  50           HG1      GLU  50   1.559   5.642  -4.032
  387    H    ALA  51           HN       ALA  51  -1.319   6.375  -0.626
  388    HA   ALA  51           HA       ALA  51   0.522   4.845   0.762
  389    HB1  ALA  51           HB1      ALA  51  -2.010   6.165   1.468
  390    HB2  ALA  51           HB2      ALA  51  -0.426   6.260   2.240
  391    HB3  ALA  51           HB3      ALA  51  -1.492   4.900   2.582
  392    H    ILE  52           HN       ILE  52  -2.900   3.816   0.138
  393    HA   ILE  52           HA       ILE  52  -2.414   1.324   1.438
  394    HB   ILE  52           HB       ILE  52  -4.500   1.962  -0.683
  395   HG12  ILE  52          HG12      ILE  52  -4.646   3.407   1.293
  396   HG13  ILE  52          HG11      ILE  52  -6.008   2.303   1.220
  397   HG21  ILE  52          HG21      ILE  52  -4.348  -0.341   1.258
  398   HG22  ILE  52          HG22      ILE  52  -4.212  -0.432  -0.499
  399   HG23  ILE  52          HG23      ILE  52  -5.740   0.042   0.244
  400   HD11  ILE  52          HD11      ILE  52  -3.582   2.031   2.978
  401   HD12  ILE  52          HD12      ILE  52  -4.905   0.868   2.883
  402   HD13  ILE  52          HD13      ILE  52  -5.206   2.499   3.485
  403    H    LEU  53           HN       LEU  53  -2.296   2.315  -2.004
  404    HA   LEU  53           HA       LEU  53  -1.926  -0.253  -3.089
  405    HB2  LEU  53           HB2      LEU  53  -2.264   1.891  -4.363
  406    HB3  LEU  53           HB1      LEU  53  -0.607   2.358  -4.054
  407    HG   LEU  53           HG       LEU  53   0.131   0.323  -5.315
  408   HD11  LEU  53          HD11      LEU  53  -1.884  -1.012  -5.080
  409   HD12  LEU  53          HD12      LEU  53  -1.502  -0.762  -6.784
  410   HD13  LEU  53          HD13      LEU  53  -2.795   0.168  -6.024
  411   HD21  LEU  53          HD21      LEU  53  -0.357   1.280  -7.520
  412   HD22  LEU  53          HD22      LEU  53   0.106   2.519  -6.353
  413   HD23  LEU  53          HD23      LEU  53  -1.589   2.310  -6.793
  414    H    LEU  54           HN       LEU  54   0.506   1.833  -1.441
  415    HA   LEU  54           HA       LEU  54   2.949   0.832  -2.142
  416    HB2  LEU  54           HB2      LEU  54   1.678   1.651   0.437
  417    HB3  LEU  54           HB1      LEU  54   3.161   0.743   0.586
  418    HG   LEU  54           HG       LEU  54   4.326   2.391  -0.807
  419   HD11  LEU  54          HD11      LEU  54   1.768   3.975  -0.710
  420   HD12  LEU  54          HD12      LEU  54   2.353   3.104  -2.128
  421   HD13  LEU  54          HD13      LEU  54   3.287   4.449  -1.471
  422   HD21  LEU  54          HD21      LEU  54   4.342   4.201   0.822
  423   HD22  LEU  54          HD22      LEU  54   4.296   2.635   1.627
  424   HD23  LEU  54          HD23      LEU  54   2.831   3.609   1.510
  425    H    GLY  55           HN       GLY  55   0.493  -0.848  -0.084
  426    HA2  GLY  55           HA2      GLY  55   1.906  -2.970   0.959
  427    HA3  GLY  55           HA1      GLY  55   0.245  -3.089   0.419
  428    H    LEU  56           HN       LEU  56   0.576  -2.849  -2.372
  429    HA   LEU  56           HA       LEU  56   1.069  -5.477  -3.119
  430    HB2  LEU  56           HB2      LEU  56   1.663  -3.124  -4.908
  431    HB3  LEU  56           HB1      LEU  56   1.195  -4.743  -5.396
  432    HG   LEU  56           HG       LEU  56  -0.521  -2.624  -4.124
  433   HD11  LEU  56          HD11      LEU  56  -0.691  -4.166  -6.706
  434   HD12  LEU  56          HD12      LEU  56  -0.303  -2.457  -6.513
  435   HD13  LEU  56          HD13      LEU  56  -1.916  -3.044  -6.116
  436   HD21  LEU  56          HD21      LEU  56  -2.339  -4.366  -4.215
  437   HD22  LEU  56          HD22      LEU  56  -1.132  -4.591  -2.950
  438   HD23  LEU  56          HD23      LEU  56  -1.065  -5.569  -4.415
  439    H    ARG  57           HN       ARG  57   3.423  -2.796  -3.033
  440    HA   ARG  57           HA       ARG  57   5.584  -4.286  -4.167
  441    HB2  ARG  57           HB2      ARG  57   5.657  -1.947  -2.250
  442    HB3  ARG  57           HB1      ARG  57   7.026  -2.538  -3.180
  443    HG2  ARG  57           HG2      ARG  57   4.487  -1.414  -4.347
  444    HG3  ARG  57           HG1      ARG  57   6.007  -0.538  -4.164
  445    HD2  ARG  57           HD2      ARG  57   5.639  -3.049  -5.795
  446    HD3  ARG  57           HD1      ARG  57   5.660  -1.414  -6.449
  447    HE   ARG  57           HE       ARG  57   8.029  -1.893  -4.914
  448   HH11  ARG  57          HH11      ARG  57   6.506  -2.707  -8.006
  449   HH12  ARG  57          HH12      ARG  57   8.014  -2.954  -8.820
  450   HH21  ARG  57          HH21      ARG  57   9.990  -2.221  -6.026
  451   HH22  ARG  57          HH22      ARG  57   9.993  -2.675  -7.698
  452    H    TYR  58           HN       TYR  58   4.374  -3.923  -0.863
  453    HA   TYR  58           HA       TYR  58   6.580  -5.174   0.460
  454    HB2  TYR  58           HB2      TYR  58   4.871  -3.801   1.603
  455    HB3  TYR  58           HB1      TYR  58   3.669  -5.042   1.284
  456    HD1  TYR  58           HD2      TYR  58   6.624  -4.165   3.269
  457    HD2  TYR  58           HD1      TYR  58   3.611  -7.084   2.579
  458    HE1  TYR  58           HE2      TYR  58   7.220  -5.267   5.384
  459    HE2  TYR  58           HE1      TYR  58   4.194  -8.195   4.693
  460    HH   TYR  58           HH       TYR  58   6.235  -8.349   6.198
  461    H    LYS  59           HN       LYS  59   3.401  -6.425  -0.567
  462    HA   LYS  59           HA       LYS  59   4.038  -9.154   0.144
  463    HB2  LYS  59           HB2      LYS  59   1.797  -7.949  -1.459
  464    HB3  LYS  59           HB1      LYS  59   1.887  -9.646  -1.016
  465    HG2  LYS  59           HG2      LYS  59   1.764  -7.339   0.915
  466    HG3  LYS  59           HG1      LYS  59   0.414  -8.385   0.472
  467    HD2  LYS  59           HD2      LYS  59   1.512 -10.299   1.437
  468    HD3  LYS  59           HD1      LYS  59   2.975  -9.360   1.735
  469    HE2  LYS  59           HE2      LYS  59   1.749  -7.944   3.303
  470    HE3  LYS  59           HE1      LYS  59   0.280  -8.867   2.996
  471    HZ1  LYS  59           HZ1      LYS  59   1.354 -10.826   3.900
  472    HZ2  LYS  59           HZ2      LYS  59   1.378  -9.572   5.033
  473    HZ3  LYS  59           HZ3      LYS  59   2.781  -9.956   4.172
  474    H    LYS  60           HN       LYS  60   4.825  -7.206  -2.542
  475    HA   LYS  60           HA       LYS  60   5.898  -7.695  -4.493
  476    HB2  LYS  60           HB2      LYS  60   6.045 -10.569  -3.569
  477    HB3  LYS  60           HB1      LYS  60   7.034  -9.804  -4.804
  478    HG2  LYS  60           HG2      LYS  60   7.938  -8.293  -3.031
  479    HG3  LYS  60           HG1      LYS  60   7.072  -9.268  -1.844
  480    HD2  LYS  60           HD2      LYS  60   9.165 -10.297  -3.761
  481    HD3  LYS  60           HD1      LYS  60   9.430  -9.938  -2.054
  482    HE2  LYS  60           HE2      LYS  60   7.752 -11.631  -1.455
  483    HE3  LYS  60           HE1      LYS  60   7.527 -12.001  -3.163
  484    HZ1  LYS  60           HZ1      LYS  60  10.096 -12.294  -1.701
  485    HZ2  LYS  60           HZ2      LYS  60   9.788 -12.754  -3.300
  486    HZ3  LYS  60           HZ3      LYS  60   9.024 -13.562  -2.025
  487    H    LEU  61           HN       LEU  61   3.633  -7.193  -5.182
  488    HA   LEU  61           HA       LEU  61   2.917  -9.052  -7.242
  489    HB2  LEU  61           HB2      LEU  61   0.468  -9.269  -6.324
  490    HB3  LEU  61           HB1      LEU  61   1.716 -10.390  -5.822
  491    HG   LEU  61           HG       LEU  61   2.004  -9.178  -3.720
  492   HD11  LEU  61          HD11      LEU  61  -0.209  -7.394  -4.717
  493   HD12  LEU  61          HD12      LEU  61   1.478  -6.933  -4.495
  494   HD13  LEU  61          HD13      LEU  61   0.491  -7.367  -3.099
  495   HD21  LEU  61          HD21      LEU  61  -0.880  -9.829  -4.315
  496   HD22  LEU  61          HD22      LEU  61  -0.161  -9.700  -2.710
  497   HD23  LEU  61          HD23      LEU  61   0.363 -10.975  -3.811
  498    H    TYR  62           HN       TYR  62   3.556  -6.199  -6.899
  499    HA   TYR  62           HA       TYR  62   1.261  -4.578  -7.185
  500    HB2  TYR  62           HB2      TYR  62   3.556  -3.744  -6.785
  501    HB3  TYR  62           HB1      TYR  62   3.987  -4.174  -8.436
  502    HD1  TYR  62           HD1      TYR  62   1.998  -1.881  -6.351
  503    HD2  TYR  62           HD2      TYR  62   3.339  -2.790 -10.286
  504    HE1  TYR  62           HE1      TYR  62   1.252   0.333  -7.111
  505    HE2  TYR  62           HE2      TYR  62   2.595  -0.576 -11.057
  506    HH   TYR  62           HH       TYR  62   0.901   1.156 -10.331
  507    H    ASN  63           HN       ASN  63   2.690  -6.816  -9.426
  508    HA   ASN  63           HA       ASN  63   1.856  -5.619 -11.864
  509    HB2  ASN  63           HB2      ASN  63   2.347  -8.512 -11.152
  510    HB3  ASN  63           HB1      ASN  63   2.093  -7.929 -12.795
  511   HD21  ASN  63          HD21      ASN  63   3.663  -6.711 -13.828
  512   HD22  ASN  63          HD22      ASN  63   5.340  -6.610 -13.185
  513    H    GLN  64           HN       GLN  64   0.351  -8.516 -10.315
  514    HA   GLN  64           HA       GLN  64  -2.091  -7.870 -11.831
  515    HB2  GLN  64           HB2      GLN  64  -1.045 -10.331 -10.513
  516    HB3  GLN  64           HB1      GLN  64  -2.772 -10.187 -10.802
  517    HG2  GLN  64           HG2      GLN  64  -1.742 -11.394 -12.606
  518    HG3  GLN  64           HG1      GLN  64  -2.325  -9.838 -13.191
  519   HE21  GLN  64          HE21      GLN  64   0.482 -11.766 -12.373
  520   HE22  GLN  64          HE22      GLN  64   1.675 -10.728 -13.228
  521    H    ALA  65           HN       ALA  65  -0.975  -7.138  -8.714
  522    HA   ALA  65           HA       ALA  65  -3.436  -7.752  -7.320
  523    HB1  ALA  65           HB1      ALA  65  -1.170  -5.917  -6.575
  524    HB2  ALA  65           HB2      ALA  65  -1.363  -7.605  -6.099
  525    HB3  ALA  65           HB3      ALA  65  -2.493  -6.386  -5.508
  526    H    ARG  66           HN       ARG  66  -2.105  -4.887  -8.942
  527    HA   ARG  66           HA       ARG  66  -4.253  -3.158  -8.050
  528    HB2  ARG  66           HB2      ARG  66  -1.902  -2.467  -8.748
  529    HB3  ARG  66           HB1      ARG  66  -2.437  -2.683 -10.408
  530    HG2  ARG  66           HG2      ARG  66  -4.093  -0.969 -10.160
  531    HG3  ARG  66           HG1      ARG  66  -3.758  -0.834  -8.434
  532    HD2  ARG  66           HD2      ARG  66  -2.663   0.982  -9.499
  533    HD3  ARG  66           HD1      ARG  66  -1.414  -0.173  -9.042
  534    HE   ARG  66           HE       ARG  66  -1.784  -0.965 -11.540
  535   HH11  ARG  66          HH11      ARG  66  -1.686   2.352 -10.291
  536   HH12  ARG  66          HH12      ARG  66  -1.085   3.016 -11.771
  537   HH21  ARG  66          HH21      ARG  66  -0.990  -0.043 -13.464
  538   HH22  ARG  66          HH22      ARG  66  -0.693   1.660 -13.572
  539    H    VAL  67           HN       VAL  67  -3.869  -5.430 -10.668
  540    HA   VAL  67           HA       VAL  67  -6.103  -4.197 -12.169
  541    HB   VAL  67           HB       VAL  67  -5.661  -5.861 -13.901
  542   HG11  VAL  67          HG11      VAL  67  -4.420  -3.772 -13.951
  543   HG12  VAL  67          HG12      VAL  67  -3.437  -5.099 -14.573
  544   HG13  VAL  67          HG13      VAL  67  -3.158  -4.481 -12.944
  545   HG21  VAL  67          HG21      VAL  67  -3.597  -6.909 -11.973
  546   HG22  VAL  67          HG22      VAL  67  -3.635  -7.319 -13.686
  547   HG23  VAL  67          HG23      VAL  67  -4.982  -7.771 -12.641
  548    H    LYS  68           HN       LYS  68  -5.299  -7.194 -10.407
  549    HA   LYS  68           HA       LYS  68  -7.801  -8.486 -11.003
  550    HB2  LYS  68           HB2      LYS  68  -5.761  -8.965  -8.830
  551    HB3  LYS  68           HB1      LYS  68  -7.160  -9.993  -9.096
  552    HG2  LYS  68           HG2      LYS  68  -4.983  -9.464 -11.114
  553    HG3  LYS  68           HG1      LYS  68  -5.111 -10.903 -10.099
  554    HD2  LYS  68           HD2      LYS  68  -7.249 -11.457 -11.138
  555    HD3  LYS  68           HD1      LYS  68  -7.157  -9.997 -12.126
  556    HE2  LYS  68           HE2      LYS  68  -5.091 -10.852 -13.156
  557    HE3  LYS  68           HE1      LYS  68  -5.239 -12.324 -12.199
  558    HZ1  LYS  68           HZ1      LYS  68  -7.322 -12.808 -13.305
  559    HZ2  LYS  68           HZ2      LYS  68  -6.090 -12.614 -14.448
  560    HZ3  LYS  68           HZ3      LYS  68  -7.217 -11.377 -14.203
  561    H    TYR  69           HN       TYR  69  -6.721  -6.303  -8.444
  562    HA   TYR  69           HA       TYR  69  -9.444  -6.518  -7.249
  563    HB2  TYR  69           HB2      TYR  69  -6.767  -5.866  -6.048
  564    HB3  TYR  69           HB1      TYR  69  -8.262  -5.393  -5.249
  565    HD1  TYR  69           HD1      TYR  69  -6.144  -8.217  -6.234
  566    HD2  TYR  69           HD2      TYR  69  -9.729  -7.046  -4.267
  567    HE1  TYR  69           HE1      TYR  69  -6.327 -10.462  -5.246
  568    HE2  TYR  69           HE2      TYR  69  -9.923  -9.285  -3.274
  569    HH   TYR  69           HH       TYR  69  -7.411 -11.512  -3.237
  570    H    SER  70           HN       SER  70 -10.335  -4.528  -6.292
  571    HA   SER  70           HA       SER  70 -10.168  -2.394  -8.256
  572    HB2  SER  70           HB2      SER  70 -12.305  -3.066  -7.203
  573    HB3  SER  70           HB1      SER  70 -11.704  -2.491  -5.649
  574    HG   SER  70           HG       SER  70 -12.086  -0.503  -6.240
  575    H    LEU  71           HN       LEU  71  -8.123  -1.518  -8.167
  576    HA   LEU  71           HA       LEU  71  -7.608   0.118  -5.722
  577    HB2  LEU  71           HB2      LEU  71  -5.636  -1.374  -7.455
  578    HB3  LEU  71           HB1      LEU  71  -5.155  -0.097  -6.356
  579    HG   LEU  71           HG       LEU  71  -6.239  -1.501  -4.507
  580   HD11  LEU  71          HD11      LEU  71  -6.258  -3.940  -4.992
  581   HD12  LEU  71          HD12      LEU  71  -6.087  -3.556  -6.704
  582   HD13  LEU  71          HD13      LEU  71  -7.522  -3.036  -5.821
  583   HD21  LEU  71          HD21      LEU  71  -3.855  -1.249  -4.674
  584   HD22  LEU  71          HD22      LEU  71  -3.776  -2.454  -5.958
  585   HD23  LEU  71          HD23      LEU  71  -4.226  -2.935  -4.323
  586    H    LEU  72           HN       LEU  72  -6.250  -0.182  -9.016
  587    HA   LEU  72           HA       LEU  72  -7.022   2.654  -9.510
  588    HB2  LEU  72           HB2      LEU  72  -4.368   1.329 -10.039
  589    HB3  LEU  72           HB1      LEU  72  -4.864   2.784 -10.876
  590    HG   LEU  72           HG       LEU  72  -3.426   3.449  -9.110
  591   HD11  LEU  72          HD11      LEU  72  -4.856   4.874  -7.745
  592   HD12  LEU  72          HD12      LEU  72  -6.270   3.950  -8.250
  593   HD13  LEU  72          HD13      LEU  72  -5.360   4.887  -9.435
  594   HD21  LEU  72          HD21      LEU  72  -3.631   2.810  -6.835
  595   HD22  LEU  72          HD22      LEU  72  -3.708   1.330  -7.791
  596   HD23  LEU  72          HD23      LEU  72  -5.181   2.028  -7.124
  597    H    GLU  73           HN       GLU  73  -5.905  -0.417 -10.964
  598    HA   GLU  73           HA       GLU  73  -7.234   0.316 -13.499
  599    HB2  GLU  73           HB2      GLU  73  -5.576  -2.121 -12.815
  600    HB3  GLU  73           HB1      GLU  73  -6.116  -1.647 -14.420
  601    HG2  GLU  73           HG2      GLU  73  -4.739   0.345 -14.323
  602    HG3  GLU  73           HG1      GLU  73  -4.243  -0.056 -12.680
  Start of MODEL    4
    1    H1   SER   1           HT1      SER   1  -1.036  16.078   7.361
    2    H2   SER   1           HT2      SER   1   0.340  16.756   8.075
    3    H3   SER   1           HT3      SER   1  -1.087  16.605   8.969
    4    HA   SER   1           HA       SER   1   0.509  14.925   9.611
    5    HB2  SER   1           HB2      SER   1  -1.912  13.885   8.115
    6    HB3  SER   1           HB1      SER   1  -0.958  12.934   9.252
    7    HG   SER   1           HG       SER   1  -2.898  14.752   9.743
    8    H    ASP   2           HN       ASP   2   1.593  12.906   9.093
    9    HA   ASP   2           HA       ASP   2   2.483  12.904   6.245
   10    HB2  ASP   2           HB2      ASP   2   4.165  13.464   8.084
   11    HB3  ASP   2           HB1      ASP   2   4.025  11.783   8.589
   12    H    VAL   3           HN       VAL   3   3.124  10.831   5.324
   13    HA   VAL   3           HA       VAL   3   1.078   8.882   5.602
   14    HB   VAL   3           HB       VAL   3   2.554   9.229   3.591
   15   HG11  VAL   3          HG11      VAL   3   4.503   7.495   5.104
   16   HG12  VAL   3          HG12      VAL   3   4.706   9.221   4.811
   17   HG13  VAL   3          HG13      VAL   3   4.676   8.097   3.455
   18   HG21  VAL   3          HG21      VAL   3   1.053   7.349   3.692
   19   HG22  VAL   3          HG22      VAL   3   2.217   6.423   4.639
   20   HG23  VAL   3          HG23      VAL   3   2.575   6.838   2.963
   21    H    TRP   4           HN       TRP   4   4.266   9.170   7.113
   22    HA   TRP   4           HA       TRP   4   4.170   6.494   8.247
   23    HB2  TRP   4           HB2      TRP   4   6.108   8.572   7.963
   24    HB3  TRP   4           HB1      TRP   4   5.996   8.158   9.670
   25    HD1  TRP   4           HD1      TRP   4   6.103   5.289  10.050
   26    HE1  TRP   4           HE1      TRP   4   7.848   3.663   9.027
   27    HE3  TRP   4           HE3      TRP   4   7.633   8.199   6.132
   28    HZ2  TRP   4           HZ2      TRP   4   9.624   3.681   6.827
   29    HZ3  TRP   4           HZ3      TRP   4   9.360   7.321   4.617
   30    HH2  TRP   4           HH2      TRP   4  10.334   5.109   4.959
   31    H    SER   5           HN       SER   5   3.561   9.824   9.386
   32    HA   SER   5           HA       SER   5   3.129   9.190  12.115
   33    HB2  SER   5           HB2      SER   5   3.358  11.498  11.266
   34    HB3  SER   5           HB1      SER   5   1.804  11.350  10.448
   35    HG   SER   5           HG       SER   5   0.813  11.665  12.281
   36    H    LEU   6           HN       LEU   6   0.762   9.541   9.441
   37    HA   LEU   6           HA       LEU   6  -1.251   8.171  11.130
   38    HB2  LEU   6           HB2      LEU   6  -1.479   9.613   8.488
   39    HB3  LEU   6           HB1      LEU   6  -2.815   8.793   9.271
   40    HG   LEU   6           HG       LEU   6  -1.329  11.207  10.306
   41   HD11  LEU   6          HD11      LEU   6  -2.897  11.701   8.519
   42   HD12  LEU   6          HD12      LEU   6  -3.503  12.307  10.059
   43   HD13  LEU   6          HD13      LEU   6  -4.169  10.826   9.370
   44   HD21  LEU   6          HD21      LEU   6  -3.577   9.648  11.581
   45   HD22  LEU   6          HD22      LEU   6  -2.927  11.180  12.164
   46   HD23  LEU   6          HD23      LEU   6  -1.914   9.737  12.160
   47    H    SER   7           HN       SER   7   0.051   6.186  10.977
   48    HA   SER   7           HA       SER   7  -0.318   4.808   8.359
   49    HB2  SER   7           HB2      SER   7   1.407   3.236   9.168
   50    HB3  SER   7           HB1      SER   7   1.998   4.896   9.142
   51    HG   SER   7           HG       SER   7   2.273   4.797  11.219
   52    H    LYS   8           HN       LYS   8  -2.156   5.199  10.926
   53    HA   LYS   8           HA       LYS   8  -2.782   2.322  11.278
   54    HB2  LYS   8           HB2      LYS   8  -3.861   4.705  12.795
   55    HB3  LYS   8           HB1      LYS   8  -4.075   3.012  13.210
   56    HG2  LYS   8           HG2      LYS   8  -1.487   4.549  13.239
   57    HG3  LYS   8           HG1      LYS   8  -2.414   4.013  14.641
   58    HD2  LYS   8           HD2      LYS   8  -2.032   1.687  14.028
   59    HD3  LYS   8           HD1      LYS   8  -1.154   2.197  12.585
   60    HE2  LYS   8           HE2      LYS   8  -0.347   2.803  15.428
   61    HE3  LYS   8           HE1      LYS   8   0.349   1.537  14.418
   62    HZ1  LYS   8           HZ1      LYS   8   0.483   4.464  13.932
   63    HZ2  LYS   8           HZ2      LYS   8   1.040   3.292  12.848
   64    HZ3  LYS   8           HZ3      LYS   8   1.764   3.448  14.369
   65    H    THR   9           HN       THR   9  -3.424   3.988   8.840
   66    HA   THR   9           HA       THR   9  -6.395   3.726   8.951
   67    HB   THR   9           HB       THR   9  -6.474   5.339   7.075
   68    HG1  THR   9           HG1      THR   9  -3.702   5.772   7.588
   69   HG21  THR   9          HG21      THR   9  -4.996   6.347   9.510
   70   HG22  THR   9          HG22      THR   9  -6.742   6.155   9.362
   71   HG23  THR   9          HG23      THR   9  -5.899   7.346   8.372
   72    H    SER  10           HN       SER  10  -7.369   2.298   7.650
   73    HA   SER  10           HA       SER  10  -5.689   1.067   5.509
   74    HB2  SER  10           HB2      SER  10  -7.056  -0.987   5.843
   75    HB3  SER  10           HB1      SER  10  -6.140  -0.536   7.279
   76    HG   SER  10           HG       SER  10  -7.950  -0.023   8.297
   77    H    MET  11           HN       MET  11  -7.082  -0.090   3.804
   78    HA   MET  11           HA       MET  11  -9.535   1.471   3.205
   79    HB2  MET  11           HB2      MET  11  -7.631   2.524   1.993
   80    HB3  MET  11           HB1      MET  11  -7.323   0.986   1.200
   81    HG2  MET  11           HG2      MET  11  -8.540   2.505  -0.250
   82    HG3  MET  11           HG1      MET  11  -9.499   1.075   0.128
   83    HE1  MET  11           HE1      MET  11  -8.848   4.140   2.533
   84    HE2  MET  11           HE2      MET  11 -10.186   5.199   2.091
   85    HE3  MET  11           HE3      MET  11  -8.902   4.869   0.929
   86    H    THR  12           HN       THR  12 -11.138   0.353   2.201
   87    HA   THR  12           HA       THR  12 -10.739  -2.558   2.111
   88    HB   THR  12           HB       THR  12 -13.255  -0.945   1.638
   89    HG1  THR  12           HG1      THR  12 -13.345  -0.838   3.745
   90   HG21  THR  12          HG21      THR  12 -14.407  -3.085   2.087
   91   HG22  THR  12          HG22      THR  12 -12.842  -3.898   2.134
   92   HG23  THR  12          HG23      THR  12 -13.406  -3.155   0.636
   93    H    PHE  13           HN       PHE  13 -10.028  -3.536   0.360
   94    HA   PHE  13           HA       PHE  13 -10.635  -2.329  -2.290
   95    HB2  PHE  13           HB2      PHE  13  -8.578  -4.355  -1.383
   96    HB3  PHE  13           HB1      PHE  13  -8.879  -3.999  -3.077
   97    HD1  PHE  13           HD2      PHE  13  -9.358  -0.983  -2.645
   98    HD2  PHE  13           HD1      PHE  13  -6.312  -3.657  -1.347
   99    HE1  PHE  13           HE2      PHE  13  -7.772   0.892  -2.524
  100    HE2  PHE  13           HE1      PHE  13  -4.722  -1.788  -1.225
  101    HZ   PHE  13           HZ       PHE  13  -5.448   0.491  -1.814
  102    H    GLN  14           HN       GLN  14 -11.595  -3.548  -3.951
  103    HA   GLN  14           HA       GLN  14 -12.794  -6.109  -3.015
  104    HB2  GLN  14           HB2      GLN  14 -14.851  -5.533  -4.259
  105    HB3  GLN  14           HB1      GLN  14 -14.524  -4.430  -2.930
  106    HG2  GLN  14           HG2      GLN  14 -13.496  -2.879  -4.627
  107    HG3  GLN  14           HG1      GLN  14 -14.160  -3.938  -5.869
  108   HE21  GLN  14          HE21      GLN  14 -14.708  -1.111  -5.262
  109   HE22  GLN  14          HE22      GLN  14 -16.480  -1.033  -4.969
  110    HA   PRO  15           HA       PRO  15 -10.514  -7.724  -6.556
  111    HB2  PRO  15           HB2      PRO  15 -12.471  -9.893  -6.008
  112    HB3  PRO  15           HB1      PRO  15 -10.728  -9.987  -6.273
  113    HG2  PRO  15           HG2      PRO  15 -11.774 -10.211  -3.824
  114    HG3  PRO  15           HG1      PRO  15 -10.229  -9.388  -4.101
  115    HD2  PRO  15           HD2      PRO  15 -12.889  -8.248  -3.448
  116    HD3  PRO  15           HD1      PRO  15 -11.268  -7.625  -3.090
  117    H    LYS  16           HN       LYS  16 -10.892  -8.000  -8.714
  118    HA   LYS  16           HA       LYS  16 -13.283  -6.852  -9.784
  119    HB2  LYS  16           HB2      LYS  16 -11.196  -8.562 -11.155
  120    HB3  LYS  16           HB1      LYS  16 -12.397  -7.573 -11.970
  121    HG2  LYS  16           HG2      LYS  16 -10.215  -6.543 -10.170
  122    HG3  LYS  16           HG1      LYS  16 -10.199  -6.511 -11.932
  123    HD2  LYS  16           HD2      LYS  16 -12.086  -5.019 -11.974
  124    HD3  LYS  16           HD1      LYS  16 -12.285  -5.156 -10.225
  125    HE2  LYS  16           HE2      LYS  16 -10.071  -4.131  -9.913
  126    HE3  LYS  16           HE1      LYS  16  -9.915  -3.960 -11.660
  127    HZ1  LYS  16           HZ1      LYS  16 -10.645  -1.904 -10.632
  128    HZ2  LYS  16           HZ2      LYS  16 -11.999  -2.674  -9.977
  129    HZ3  LYS  16           HZ3      LYS  16 -11.848  -2.508 -11.654
  130    H    LYS  17           HN       LYS  17 -12.261 -10.160  -9.113
  131    HA   LYS  17           HA       LYS  17 -14.832 -11.154 -10.243
  132    HB2  LYS  17           HB2      LYS  17 -12.315 -12.658  -9.503
  133    HB3  LYS  17           HB1      LYS  17 -13.781 -13.395 -10.130
  134    HG2  LYS  17           HG2      LYS  17 -12.313 -13.239 -11.951
  135    HG3  LYS  17           HG1      LYS  17 -13.485 -11.942 -12.177
  136    HD2  LYS  17           HD2      LYS  17 -11.939 -10.294 -11.491
  137    HD3  LYS  17           HD1      LYS  17 -10.830 -11.496 -10.832
  138    HE2  LYS  17           HE2      LYS  17 -11.530 -11.277 -13.755
  139    HE3  LYS  17           HE1      LYS  17 -10.134 -10.489 -13.021
  140    HZ1  LYS  17           HZ1      LYS  17  -9.336 -12.688 -12.334
  141    HZ2  LYS  17           HZ2      LYS  17  -9.487 -12.571 -14.014
  142    HZ3  LYS  17           HZ3      LYS  17 -10.647 -13.416 -13.118
  143    H    ALA  18           HN       ALA  18 -15.765 -13.081  -9.036
  144    HA   ALA  18           HA       ALA  18 -16.139 -12.255  -6.252
  145    HB1  ALA  18           HB1      ALA  18 -18.048 -12.921  -7.613
  146    HB2  ALA  18           HB2      ALA  18 -17.869 -13.981  -6.214
  147    HB3  ALA  18           HB3      ALA  18 -17.357 -14.531  -7.809
  148    H    SER  19           HN       SER  19 -14.285 -14.633  -7.995
  149    HA   SER  19           HA       SER  19 -14.029 -16.634  -6.019
  150    HB2  SER  19           HB2      SER  19 -12.027 -15.713  -8.093
  151    HB3  SER  19           HB1      SER  19 -11.910 -17.218  -7.180
  152    HG   SER  19           HG       SER  19 -13.217 -18.064  -8.573
  153    H    LEU  20           HN       LEU  20 -12.072 -13.685  -6.552
  154    HA   LEU  20           HA       LEU  20 -10.323 -14.271  -4.312
  155    HB2  LEU  20           HB2      LEU  20 -10.752 -11.626  -5.689
  156    HB3  LEU  20           HB1      LEU  20  -9.365 -12.106  -4.739
  157    HG   LEU  20           HG       LEU  20  -9.505 -14.008  -6.778
  158   HD11  LEU  20          HD11      LEU  20  -9.574 -12.707  -8.825
  159   HD12  LEU  20          HD12      LEU  20  -9.932 -11.244  -7.907
  160   HD13  LEU  20          HD13      LEU  20 -11.103 -12.562  -7.956
  161   HD21  LEU  20          HD21      LEU  20  -7.798 -11.526  -6.611
  162   HD22  LEU  20          HD22      LEU  20  -7.434 -12.984  -7.532
  163   HD23  LEU  20          HD23      LEU  20  -7.484 -13.044  -5.770
  164    H    GLN  21           HN       GLN  21 -10.012 -12.698  -2.485
  165    HA   GLN  21           HA       GLN  21 -12.689 -11.833  -1.485
  166    HB2  GLN  21           HB2      GLN  21 -10.295 -12.797   0.091
  167    HB3  GLN  21           HB1      GLN  21 -11.789 -12.196   0.793
  168    HG2  GLN  21           HG2      GLN  21 -12.170 -14.430   0.911
  169    HG3  GLN  21           HG1      GLN  21 -12.861 -14.092  -0.675
  170   HE21  GLN  21          HE21      GLN  21 -10.184 -15.495   1.090
  171   HE22  GLN  21          HE22      GLN  21  -9.511 -16.422  -0.296
  172    HA   PRO  22           HA       PRO  22 -11.430  -7.592  -1.385
  173    HB2  PRO  22           HB2      PRO  22 -12.736  -7.657   1.307
  174    HB3  PRO  22           HB1      PRO  22 -12.952  -6.506  -0.019
  175    HG2  PRO  22           HG2      PRO  22 -14.783  -8.356   0.394
  176    HG3  PRO  22           HG1      PRO  22 -14.260  -7.991  -1.261
  177    HD2  PRO  22           HD2      PRO  22 -13.538 -10.311   0.487
  178    HD3  PRO  22           HD1      PRO  22 -13.867 -10.272  -1.258
  179    H    LEU  23           HN       LEU  23  -9.824  -6.290  -0.601
  180    HA   LEU  23           HA       LEU  23  -8.213  -7.462   1.622
  181    HB2  LEU  23           HB2      LEU  23  -7.298  -7.288  -0.799
  182    HB3  LEU  23           HB1      LEU  23  -7.122  -5.584  -0.442
  183    HG   LEU  23           HG       LEU  23  -5.839  -7.779   1.187
  184   HD11  LEU  23          HD11      LEU  23  -3.758  -7.173   0.060
  185   HD12  LEU  23          HD12      LEU  23  -4.642  -6.058  -0.981
  186   HD13  LEU  23          HD13      LEU  23  -4.952  -7.791  -1.082
  187   HD21  LEU  23          HD21      LEU  23  -6.123  -5.764   2.461
  188   HD22  LEU  23          HD22      LEU  23  -5.489  -4.785   1.139
  189   HD23  LEU  23          HD23      LEU  23  -4.428  -5.900   1.999
  190    H    THR  24           HN       THR  24  -8.239  -6.361   3.467
  191    HA   THR  24           HA       THR  24  -8.456  -3.403   3.270
  192    HB   THR  24           HB       THR  24  -9.795  -5.065   5.410
  193    HG1  THR  24           HG1      THR  24 -11.275  -5.291   3.908
  194   HG21  THR  24          HG21      THR  24  -9.128  -2.825   6.156
  195   HG22  THR  24          HG22      THR  24 -10.882  -2.956   6.027
  196   HG23  THR  24          HG23      THR  24  -9.965  -2.113   4.777
  197    H    ILE  25           HN       ILE  25  -6.182  -3.242   3.467
  198    HA   ILE  25           HA       ILE  25  -5.194  -3.953   6.196
  199    HB   ILE  25           HB       ILE  25  -4.217  -5.332   4.343
  200   HG12  ILE  25          HG12      ILE  25  -1.838  -4.985   5.079
  201   HG13  ILE  25          HG11      ILE  25  -2.370  -3.550   5.943
  202   HG21  ILE  25          HG21      ILE  25  -2.727  -2.847   3.547
  203   HG22  ILE  25          HG22      ILE  25  -4.194  -3.379   2.725
  204   HG23  ILE  25          HG23      ILE  25  -2.767  -4.414   2.736
  205   HD11  ILE  25          HD11      ILE  25  -3.833  -4.924   7.324
  206   HD12  ILE  25          HD12      ILE  25  -2.155  -5.452   7.430
  207   HD13  ILE  25          HD13      ILE  25  -3.306  -6.363   6.452
  208    H    SER  26           HN       SER  26  -3.627  -2.603   7.166
  209    HA   SER  26           HA       SER  26  -3.760   0.194   6.154
  210    HB2  SER  26           HB2      SER  26  -4.728  -0.198   8.396
  211    HB3  SER  26           HB1      SER  26  -3.176  -0.822   8.950
  212    HG   SER  26           HG       SER  26  -2.489   1.149   9.174
  213    H    LEU  27           HN       LEU  27  -1.859   1.574   6.798
  214    HA   LEU  27           HA       LEU  27   0.513   0.652   5.547
  215    HB2  LEU  27           HB2      LEU  27   0.221   2.868   7.559
  216    HB3  LEU  27           HB1      LEU  27   1.544   2.664   6.427
  217    HG   LEU  27           HG       LEU  27  -1.325   3.306   5.739
  218   HD11  LEU  27          HD11      LEU  27  -0.146   5.212   6.620
  219   HD12  LEU  27          HD12      LEU  27  -0.333   5.399   4.877
  220   HD13  LEU  27          HD13      LEU  27   1.221   4.907   5.550
  221   HD21  LEU  27          HD21      LEU  27   1.043   2.903   3.913
  222   HD22  LEU  27          HD22      LEU  27  -0.560   3.454   3.427
  223   HD23  LEU  27          HD23      LEU  27  -0.343   1.824   4.063
  224    H    ASP  28           HN       ASP  28   0.115   1.422   9.016
  225    HA   ASP  28           HA       ASP  28   2.580   0.254   9.806
  226    HB2  ASP  28           HB2      ASP  28   1.199   1.904  11.105
  227    HB3  ASP  28           HB1      ASP  28   0.111   0.585  11.519
  228    H    GLU  29           HN       GLU  29  -0.611  -1.143   9.308
  229    HA   GLU  29           HA       GLU  29   0.053  -3.597  10.738
  230    HB2  GLU  29           HB2      GLU  29  -2.257  -2.534  10.500
  231    HB3  GLU  29           HB1      GLU  29  -2.268  -3.179   8.866
  232    HG2  GLU  29           HG2      GLU  29  -2.083  -5.429   9.719
  233    HG3  GLU  29           HG1      GLU  29  -1.951  -4.822  11.368
  234    H    LEU  30           HN       LEU  30   1.141  -2.463   7.794
  235    HA   LEU  30           HA       LEU  30   1.414  -5.268   6.864
  236    HB2  LEU  30           HB2      LEU  30  -0.404  -3.962   5.643
  237    HB3  LEU  30           HB1      LEU  30   0.897  -3.021   4.939
  238    HG   LEU  30           HG       LEU  30   1.840  -5.080   3.952
  239   HD11  LEU  30          HD11      LEU  30   1.122  -6.757   5.471
  240   HD12  LEU  30          HD12      LEU  30   0.356  -7.103   3.922
  241   HD13  LEU  30          HD13      LEU  30  -0.575  -6.354   5.218
  242   HD21  LEU  30          HD21      LEU  30   0.221  -3.642   2.729
  243   HD22  LEU  30          HD22      LEU  30  -1.066  -4.728   3.250
  244   HD23  LEU  30          HD23      LEU  30   0.223  -5.327   2.205
  245    H    PHE  31           HN       PHE  31   3.174  -2.877   8.026
  246    HA   PHE  31           HA       PHE  31   5.340  -3.571   6.155
  247    HB2  PHE  31           HB2      PHE  31   4.951  -0.780   7.271
  248    HB3  PHE  31           HB1      PHE  31   6.328  -1.290   6.299
  249    HD1  PHE  31           HD1      PHE  31   5.386  -2.637   4.052
  250    HD2  PHE  31           HD2      PHE  31   3.493   0.556   6.133
  251    HE1  PHE  31           HE1      PHE  31   4.158  -2.034   2.007
  252    HE2  PHE  31           HE2      PHE  31   2.260   1.159   4.094
  253    HZ   PHE  31           HZ       PHE  31   2.592  -0.137   2.028
  254    H    SER  32           HN       SER  32   7.366  -3.991   7.012
  255    HA   SER  32           HA       SER  32   7.584  -3.691   9.960
  256    HB2  SER  32           HB2      SER  32   8.291  -6.154   8.367
  257    HB3  SER  32           HB1      SER  32   8.576  -5.940  10.094
  258    HG   SER  32           HG       SER  32   6.298  -6.638   8.794
  259    H    SER  33           HN       SER  33   8.746  -2.137   7.671
  260    HA   SER  33           HA       SER  33  11.485  -2.112   8.600
  261    HB2  SER  33           HB2      SER  33  11.703  -4.010   7.093
  262    HB3  SER  33           HB1      SER  33  10.947  -3.096   5.790
  263    HG   SER  33           HG       SER  33  13.141  -2.975   5.494
  264    H    ARG  34           HN       ARG  34  12.367  -0.132   8.391
  265    HA   ARG  34           HA       ARG  34  10.768   1.996   7.366
  266    HB2  ARG  34           HB2      ARG  34  13.691   1.857   8.109
  267    HB3  ARG  34           HB1      ARG  34  12.894   3.348   7.628
  268    HG2  ARG  34           HG2      ARG  34  11.312   3.056   9.509
  269    HG3  ARG  34           HG1      ARG  34  12.236   1.641  10.019
  270    HD2  ARG  34           HD2      ARG  34  14.216   3.023  10.317
  271    HD3  ARG  34           HD1      ARG  34  13.330   4.438   9.750
  272    HE   ARG  34           HE       ARG  34  12.054   3.167  12.016
  273   HH11  ARG  34          HH11      ARG  34  14.617   5.410  11.049
  274   HH12  ARG  34          HH12      ARG  34  14.627   6.244  12.567
  275   HH21  ARG  34          HH21      ARG  34  12.103   4.290  14.002
  276   HH22  ARG  34          HH22      ARG  34  13.202   5.608  14.242
  277    H    GLY  35           HN       GLY  35  13.682   0.363   6.072
  278    HA2  GLY  35           HA2      GLY  35  13.866   1.933   3.699
  279    HA3  GLY  35           HA1      GLY  35  14.518   0.316   3.913
  280    H    GLU  36           HN       GLU  36  12.044  -1.027   4.456
  281    HA   GLU  36           HA       GLU  36  11.208  -1.635   1.821
  282    HB2  GLU  36           HB2      GLU  36  10.886  -3.162   3.706
  283    HB3  GLU  36           HB1      GLU  36   9.747  -2.043   4.440
  284    HG2  GLU  36           HG2      GLU  36   8.575  -3.867   3.392
  285    HG3  GLU  36           HG1      GLU  36   8.223  -2.360   2.552
  286    H    PHE  37           HN       PHE  37   9.808   0.516   4.297
  287    HA   PHE  37           HA       PHE  37   7.468   1.246   2.895
  288    HB2  PHE  37           HB2      PHE  37   8.228   1.812   5.311
  289    HB3  PHE  37           HB1      PHE  37   9.014   3.204   4.577
  290    HD1  PHE  37           HD1      PHE  37   7.616   4.877   3.338
  291    HD2  PHE  37           HD2      PHE  37   5.916   1.792   5.727
  292    HE1  PHE  37           HE1      PHE  37   5.496   6.120   3.429
  293    HE2  PHE  37           HE2      PHE  37   3.793   3.030   5.821
  294    HZ   PHE  37           HZ       PHE  37   3.581   5.195   4.670
  295    H    ILE  38           HN       ILE  38  10.759   2.661   2.826
  296    HA   ILE  38           HA       ILE  38  10.289   4.786   1.083
  297    HB   ILE  38           HB       ILE  38  12.720   2.992   1.180
  298   HG12  ILE  38          HG12      ILE  38  12.257   3.954   3.351
  299   HG13  ILE  38          HG11      ILE  38  13.631   4.795   2.642
  300   HG21  ILE  38          HG21      ILE  38  12.396   5.768   0.048
  301   HG22  ILE  38          HG22      ILE  38  12.703   4.293  -0.867
  302   HG23  ILE  38          HG23      ILE  38  13.928   4.917   0.238
  303   HD11  ILE  38          HD11      ILE  38  12.149   6.636   1.993
  304   HD12  ILE  38          HD12      ILE  38  12.144   6.355   3.734
  305   HD13  ILE  38          HD13      ILE  38  10.794   5.797   2.746
  306    H    SER  39           HN       SER  39  11.265   1.425   0.185
  307    HA   SER  39           HA       SER  39  11.191   1.860  -2.611
  308    HB2  SER  39           HB2      SER  39  12.188  -0.147  -1.568
  309    HB3  SER  39           HB1      SER  39  10.585  -0.715  -1.107
  310    HG   SER  39           HG       SER  39  10.190  -1.285  -3.120
  311    H    VAL  40           HN       VAL  40   8.699   0.049  -0.713
  312    HA   VAL  40           HA       VAL  40   6.744  -0.261  -2.473
  313    HB   VAL  40           HB       VAL  40   5.026   0.076  -0.741
  314   HG11  VAL  40          HG11      VAL  40   5.913  -1.571   0.856
  315   HG12  VAL  40          HG12      VAL  40   7.526  -1.331   0.189
  316   HG13  VAL  40          HG13      VAL  40   6.250  -2.012  -0.816
  317   HG21  VAL  40          HG21      VAL  40   5.582   0.844   1.459
  318   HG22  VAL  40          HG22      VAL  40   6.051   2.085   0.297
  319   HG23  VAL  40          HG23      VAL  40   7.274   1.035   1.011
  320    H    GLY  41           HN       GLY  41   7.452   3.030  -1.144
  321    HA2  GLY  41           HA2      GLY  41   6.897   4.647  -3.073
  322    HA3  GLY  41           HA1      GLY  41   5.263   4.027  -2.887
  323    H    GLY  42           HN       GLY  42   7.775   4.868  -0.462
  324    HA2  GLY  42           HA2      GLY  42   5.710   6.584   0.836
  325    HA3  GLY  42           HA1      GLY  42   7.049   5.812   1.657
  326    H    ASP  43           HN       ASP  43   5.940   8.543  -0.121
  327    HA   ASP  43           HA       ASP  43   8.620   9.804   0.063
  328    HB2  ASP  43           HB2      ASP  43   6.161  10.634  -1.468
  329    HB3  ASP  43           HB1      ASP  43   7.697  11.490  -1.489
  330    H    GLY  44           HN       GLY  44   6.786   9.384   2.384
  331    HA2  GLY  44           HA2      GLY  44   6.333  10.692   4.249
  332    HA3  GLY  44           HA1      GLY  44   6.899  12.105   3.381
  333    H    ARG  45           HN       ARG  45   5.418  13.071   1.769
  334    HA   ARG  45           HA       ARG  45   2.746  13.183   2.972
  335    HB2  ARG  45           HB2      ARG  45   4.125  14.783   0.823
  336    HB3  ARG  45           HB1      ARG  45   2.423  14.999   1.203
  337    HG2  ARG  45           HG2      ARG  45   3.613  16.669   2.382
  338    HG3  ARG  45           HG1      ARG  45   3.107  15.466   3.569
  339    HD2  ARG  45           HD2      ARG  45   5.409  16.191   3.952
  340    HD3  ARG  45           HD1      ARG  45   5.327  14.479   3.545
  341    HE   ARG  45           HE       ARG  45   5.827  16.269   1.283
  342   HH11  ARG  45          HH11      ARG  45   7.251  14.250   3.822
  343   HH12  ARG  45          HH12      ARG  45   8.769  14.089   3.008
  344   HH21  ARG  45          HH21      ARG  45   7.841  16.026   0.246
  345   HH22  ARG  45          HH22      ARG  45   9.104  15.096   0.979
  346    H    MET  46           HN       MET  46   1.791  11.228   2.477
  347    HA   MET  46           HA       MET  46   1.608  10.392  -0.323
  348    HB2  MET  46           HB2      MET  46   1.673   8.941   1.877
  349    HB3  MET  46           HB1      MET  46  -0.064   9.205   1.856
  350    HG2  MET  46           HG2      MET  46  -0.033   7.307   0.654
  351    HG3  MET  46           HG1      MET  46   0.275   8.420  -0.671
  352    HE1  MET  46           HE1      MET  46   2.598   8.861  -1.742
  353    HE2  MET  46           HE2      MET  46   4.105   8.107  -1.221
  354    HE3  MET  46           HE3      MET  46   3.311   9.294  -0.186
  355    H    SER  47           HN       SER  47  -0.543   9.871  -1.312
  356    HA   SER  47           HA       SER  47  -2.240  12.243  -1.023
  357    HB2  SER  47           HB2      SER  47  -1.586  11.472  -3.262
  358    HB3  SER  47           HB1      SER  47  -2.404   9.938  -2.976
  359    HG   SER  47           HG       SER  47  -4.256  10.859  -3.379
  360    H    HIS  48           HN       HIS  48  -3.103   8.801  -1.507
  361    HA   HIS  48           HA       HIS  48  -4.747   8.480   0.816
  362    HB2  HIS  48           HB2      HIS  48  -6.195  10.168  -0.081
  363    HB3  HIS  48           HB1      HIS  48  -6.121   9.450  -1.684
  364    HD1  HIS  48           HD1      HIS  48  -7.765   9.113   1.675
  365    HD2  HIS  48           HD2      HIS  48  -7.803   7.229  -2.071
  366    HE1  HIS  48           HE1      HIS  48  -9.778   7.570   1.669
  367    HE2  HIS  48           HE2      HIS  48  -9.816   6.444  -0.610
  368    H    LYS  49           HN       LYS  49  -5.176   7.758  -2.680
  369    HA   LYS  49           HA       LYS  49  -5.641   4.954  -2.156
  370    HB2  LYS  49           HB2      LYS  49  -6.404   6.317  -4.159
  371    HB3  LYS  49           HB1      LYS  49  -4.753   6.221  -4.751
  372    HG2  LYS  49           HG2      LYS  49  -6.015   4.535  -5.835
  373    HG3  LYS  49           HG1      LYS  49  -4.948   3.738  -4.684
  374    HD2  LYS  49           HD2      LYS  49  -7.172   2.748  -4.616
  375    HD3  LYS  49           HD1      LYS  49  -6.807   3.558  -3.093
  376    HE2  LYS  49           HE2      LYS  49  -9.085   4.035  -3.772
  377    HE3  LYS  49           HE1      LYS  49  -8.113   5.504  -3.830
  378    HZ1  LYS  49           HZ1      LYS  49  -7.941   5.289  -6.208
  379    HZ2  LYS  49           HZ2      LYS  49  -9.572   5.249  -5.767
  380    HZ3  LYS  49           HZ3      LYS  49  -8.776   3.817  -6.185
  381    H    GLU  50           HN       GLU  50  -2.813   6.946  -2.776
  382    HA   GLU  50           HA       GLU  50  -1.016   4.922  -3.627
  383    HB2  GLU  50           HB2      GLU  50  -0.554   7.533  -2.183
  384    HB3  GLU  50           HB1      GLU  50   0.730   6.548  -2.865
  385    HG2  GLU  50           HG2      GLU  50  -1.526   7.826  -4.394
  386    HG3  GLU  50           HG1      GLU  50   0.144   8.383  -4.337
  387    H    ALA  51           HN       ALA  51  -1.464   6.368  -0.360
  388    HA   ALA  51           HA       ALA  51   0.460   4.938   1.017
  389    HB1  ALA  51           HB1      ALA  51  -0.842   5.264   3.034
  390    HB2  ALA  51           HB2      ALA  51  -2.303   5.532   2.082
  391    HB3  ALA  51           HB3      ALA  51  -0.977   6.692   2.009
  392    H    ILE  52           HN       ILE  52  -2.981   3.797   0.776
  393    HA   ILE  52           HA       ILE  52  -2.357   1.326   1.987
  394    HB   ILE  52           HB       ILE  52  -4.520   1.811  -0.092
  395   HG12  ILE  52          HG12      ILE  52  -4.794   3.387   1.711
  396   HG13  ILE  52          HG11      ILE  52  -5.985   2.118   1.914
  397   HG21  ILE  52          HG21      ILE  52  -5.664  -0.084   0.952
  398   HG22  ILE  52          HG22      ILE  52  -4.280  -0.330   2.017
  399   HG23  ILE  52          HG23      ILE  52  -4.105  -0.558   0.278
  400   HD11  ILE  52          HD11      ILE  52  -5.005   2.745   4.036
  401   HD12  ILE  52          HD12      ILE  52  -3.400   2.349   3.423
  402   HD13  ILE  52          HD13      ILE  52  -4.604   1.077   3.627
  403    H    LEU  53           HN       LEU  53  -2.375   2.287  -1.458
  404    HA   LEU  53           HA       LEU  53  -2.010  -0.282  -2.550
  405    HB2  LEU  53           HB2      LEU  53  -2.480   1.774  -3.859
  406    HB3  LEU  53           HB1      LEU  53  -0.879   2.406  -3.547
  407    HG   LEU  53           HG       LEU  53   0.016   0.368  -4.785
  408   HD11  LEU  53          HD11      LEU  53  -2.880   0.199  -5.598
  409   HD12  LEU  53          HD12      LEU  53  -1.955  -1.018  -4.719
  410   HD13  LEU  53          HD13      LEU  53  -1.553  -0.645  -6.396
  411   HD21  LEU  53          HD21      LEU  53  -0.596   1.396  -7.027
  412   HD22  LEU  53          HD22      LEU  53   0.165   2.462  -5.847
  413   HD23  LEU  53          HD23      LEU  53  -1.575   2.543  -6.114
  414    H    LEU  54           HN       LEU  54   0.449   1.816  -0.966
  415    HA   LEU  54           HA       LEU  54   2.828   0.752  -1.957
  416    HB2  LEU  54           HB2      LEU  54   1.897   1.804   0.705
  417    HB3  LEU  54           HB1      LEU  54   3.401   0.917   0.714
  418    HG   LEU  54           HG       LEU  54   4.344   2.459  -0.935
  419   HD11  LEU  54          HD11      LEU  54   1.780   4.012  -0.663
  420   HD12  LEU  54          HD12      LEU  54   2.204   3.020  -2.058
  421   HD13  LEU  54          HD13      LEU  54   3.179   4.431  -1.650
  422   HD21  LEU  54          HD21      LEU  54   3.107   3.840   1.443
  423   HD22  LEU  54          HD22      LEU  54   4.488   4.423   0.514
  424   HD23  LEU  54          HD23      LEU  54   4.618   2.929   1.442
  425    H    GLY  55           HN       GLY  55   0.450  -0.805   0.244
  426    HA2  GLY  55           HA2      GLY  55   1.929  -2.857   1.383
  427    HA3  GLY  55           HA1      GLY  55   0.260  -3.021   0.878
  428    H    LEU  56           HN       LEU  56   0.508  -2.868  -1.902
  429    HA   LEU  56           HA       LEU  56   1.029  -5.506  -2.618
  430    HB2  LEU  56           HB2      LEU  56   1.476  -3.161  -4.451
  431    HB3  LEU  56           HB1      LEU  56   1.055  -4.802  -4.906
  432    HG   LEU  56           HG       LEU  56  -0.705  -2.771  -3.540
  433   HD11  LEU  56          HD11      LEU  56  -0.734  -4.129  -6.219
  434   HD12  LEU  56          HD12      LEU  56  -0.672  -2.404  -5.864
  435   HD13  LEU  56          HD13      LEU  56  -2.147  -3.318  -5.545
  436   HD21  LEU  56          HD21      LEU  56  -1.114  -5.724  -3.941
  437   HD22  LEU  56          HD22      LEU  56  -2.446  -4.598  -3.687
  438   HD23  LEU  56          HD23      LEU  56  -1.214  -4.802  -2.442
  439    H    ARG  57           HN       ARG  57   3.290  -2.737  -2.887
  440    HA   ARG  57           HA       ARG  57   5.428  -4.235  -4.008
  441    HB2  ARG  57           HB2      ARG  57   5.376  -1.715  -2.359
  442    HB3  ARG  57           HB1      ARG  57   6.868  -2.381  -3.004
  443    HG2  ARG  57           HG2      ARG  57   6.292  -0.807  -4.585
  444    HG3  ARG  57           HG1      ARG  57   5.643  -2.292  -5.281
  445    HD2  ARG  57           HD2      ARG  57   3.440  -1.730  -4.706
  446    HD3  ARG  57           HD1      ARG  57   3.963  -0.496  -3.560
  447    HE   ARG  57           HE       ARG  57   4.690  -0.024  -6.366
  448   HH11  ARG  57          HH11      ARG  57   2.350   0.560  -3.772
  449   HH12  ARG  57          HH12      ARG  57   1.723   1.999  -4.498
  450   HH21  ARG  57          HH21      ARG  57   3.830   1.874  -7.288
  451   HH22  ARG  57          HH22      ARG  57   2.558   2.743  -6.497
  452    H    TYR  58           HN       TYR  58   4.380  -3.770  -0.668
  453    HA   TYR  58           HA       TYR  58   6.722  -4.905   0.555
  454    HB2  TYR  58           HB2      TYR  58   5.240  -3.538   1.873
  455    HB3  TYR  58           HB1      TYR  58   3.872  -4.579   1.515
  456    HD1  TYR  58           HD1      TYR  58   3.625  -6.741   2.622
  457    HD2  TYR  58           HD2      TYR  58   6.859  -4.150   3.573
  458    HE1  TYR  58           HE1      TYR  58   4.059  -8.046   4.658
  459    HE2  TYR  58           HE2      TYR  58   7.308  -5.448   5.611
  460    HH   TYR  58           HH       TYR  58   6.017  -8.485   6.188
  461    H    LYS  59           HN       LYS  59   3.526  -6.206  -0.301
  462    HA   LYS  59           HA       LYS  59   4.130  -8.892   0.570
  463    HB2  LYS  59           HB2      LYS  59   1.948  -7.904  -1.258
  464    HB3  LYS  59           HB1      LYS  59   1.999  -9.466  -0.459
  465    HG2  LYS  59           HG2      LYS  59   1.820  -6.794   0.916
  466    HG3  LYS  59           HG1      LYS  59   0.487  -7.922   0.669
  467    HD2  LYS  59           HD2      LYS  59   2.996  -8.622   2.187
  468    HD3  LYS  59           HD1      LYS  59   1.546  -7.974   2.953
  469    HE2  LYS  59           HE2      LYS  59   1.669 -10.506   1.322
  470    HE3  LYS  59           HE1      LYS  59   1.682 -10.435   3.082
  471    HZ1  LYS  59           HZ1      LYS  59  -0.521  -9.569   1.288
  472    HZ2  LYS  59           HZ2      LYS  59  -0.507  -9.326   2.962
  473    HZ3  LYS  59           HZ3      LYS  59  -0.527 -10.897   2.337
  474    H    LYS  60           HN       LYS  60   4.992  -7.111  -2.218
  475    HA   LYS  60           HA       LYS  60   6.128  -7.726  -4.101
  476    HB2  LYS  60           HB2      LYS  60   6.169 -10.586  -3.130
  477    HB3  LYS  60           HB1      LYS  60   7.282  -9.808  -4.246
  478    HG2  LYS  60           HG2      LYS  60   7.028  -9.244  -1.299
  479    HG3  LYS  60           HG1      LYS  60   8.330 -10.133  -2.093
  480    HD2  LYS  60           HD2      LYS  60   8.972  -8.125  -3.316
  481    HD3  LYS  60           HD1      LYS  60   7.641  -7.233  -2.577
  482    HE2  LYS  60           HE2      LYS  60   8.657  -7.711  -0.348
  483    HE3  LYS  60           HE1      LYS  60  10.041  -8.412  -1.185
  484    HZ1  LYS  60           HZ1      LYS  60  10.455  -6.283  -2.232
  485    HZ2  LYS  60           HZ2      LYS  60  10.436  -6.109  -0.550
  486    HZ3  LYS  60           HZ3      LYS  60   9.106  -5.606  -1.467
  487    H    LEU  61           HN       LEU  61   3.761  -7.238  -4.720
  488    HA   LEU  61           HA       LEU  61   3.086  -9.104  -6.802
  489    HB2  LEU  61           HB2      LEU  61   0.687  -9.462  -5.893
  490    HB3  LEU  61           HB1      LEU  61   1.988 -10.475  -5.306
  491    HG   LEU  61           HG       LEU  61   2.146  -9.080  -3.273
  492   HD11  LEU  61          HD11      LEU  61   0.355  -7.477  -2.779
  493   HD12  LEU  61          HD12      LEU  61  -0.255  -7.670  -4.421
  494   HD13  LEU  61          HD13      LEU  61   1.341  -6.974  -4.151
  495   HD21  LEU  61          HD21      LEU  61  -0.599 -10.179  -3.857
  496   HD22  LEU  61          HD22      LEU  61   0.046  -9.827  -2.253
  497   HD23  LEU  61          HD23      LEU  61   0.784 -11.086  -3.244
  498    H    TYR  62           HN       TYR  62   3.629  -6.226  -6.435
  499    HA   TYR  62           HA       TYR  62   1.231  -4.727  -6.697
  500    HB2  TYR  62           HB2      TYR  62   3.415  -3.735  -6.172
  501    HB3  TYR  62           HB1      TYR  62   3.988  -4.126  -7.790
  502    HD1  TYR  62           HD1      TYR  62   1.328  -2.200  -6.030
  503    HD2  TYR  62           HD2      TYR  62   3.772  -2.551  -9.493
  504    HE1  TYR  62           HE1      TYR  62   0.487  -0.041  -6.835
  505    HE2  TYR  62           HE2      TYR  62   2.936  -0.385 -10.307
  506    HH   TYR  62           HH       TYR  62   1.245   1.782  -8.371
  507    H    ASN  63           HN       ASN  63   2.782  -6.842  -8.950
  508    HA   ASN  63           HA       ASN  63   2.041  -5.584 -11.386
  509    HB2  ASN  63           HB2      ASN  63   2.530  -8.484 -10.703
  510    HB3  ASN  63           HB1      ASN  63   2.268  -7.907 -12.345
  511   HD21  ASN  63          HD21      ASN  63   4.280  -8.547 -13.061
  512   HD22  ASN  63          HD22      ASN  63   5.777  -7.690 -12.553
  513    H    GLN  64           HN       GLN  64   0.468  -8.508  -9.968
  514    HA   GLN  64           HA       GLN  64  -1.927  -7.836 -11.551
  515    HB2  GLN  64           HB2      GLN  64  -0.963 -10.129 -11.601
  516    HB3  GLN  64           HB1      GLN  64  -1.380 -10.302  -9.903
  517    HG2  GLN  64           HG2      GLN  64  -3.717 -10.148 -10.398
  518    HG3  GLN  64           HG1      GLN  64  -3.381  -9.756 -12.083
  519   HE21  GLN  64          HE21      GLN  64  -3.451 -12.247  -9.635
  520   HE22  GLN  64          HE22      GLN  64  -3.324 -13.634 -10.771
  521    H    ALA  65           HN       ALA  65  -0.877  -7.075  -8.416
  522    HA   ALA  65           HA       ALA  65  -3.379  -7.649  -7.058
  523    HB1  ALA  65           HB1      ALA  65  -1.052  -5.897  -6.302
  524    HB2  ALA  65           HB2      ALA  65  -1.358  -7.554  -5.778
  525    HB3  ALA  65           HB3      ALA  65  -2.425  -6.253  -5.255
  526    H    ARG  66           HN       ARG  66  -1.902  -4.788  -8.576
  527    HA   ARG  66           HA       ARG  66  -3.999  -2.993  -7.760
  528    HB2  ARG  66           HB2      ARG  66  -1.753  -2.224  -8.349
  529    HB3  ARG  66           HB1      ARG  66  -1.991  -2.762 -10.005
  530    HG2  ARG  66           HG2      ARG  66  -3.664  -1.103 -10.380
  531    HG3  ARG  66           HG1      ARG  66  -3.688  -0.667  -8.670
  532    HD2  ARG  66           HD2      ARG  66  -2.439   0.972  -9.960
  533    HD3  ARG  66           HD1      ARG  66  -1.378   0.123  -8.840
  534    HE   ARG  66           HE       ARG  66  -1.006  -1.343 -11.060
  535   HH11  ARG  66          HH11      ARG  66  -1.099   2.172 -10.630
  536   HH12  ARG  66          HH12      ARG  66   0.006   2.479 -11.926
  537   HH21  ARG  66          HH21      ARG  66   0.453  -0.893 -12.747
  538   HH22  ARG  66          HH22      ARG  66   0.888   0.738 -13.126
  539    H    VAL  67           HN       VAL  67  -3.672  -5.262 -10.410
  540    HA   VAL  67           HA       VAL  67  -5.925  -3.987 -11.846
  541    HB   VAL  67           HB       VAL  67  -5.523  -5.663 -13.608
  542   HG11  VAL  67          HG11      VAL  67  -3.061  -4.148 -12.753
  543   HG12  VAL  67          HG12      VAL  67  -4.400  -3.506 -13.702
  544   HG13  VAL  67          HG13      VAL  67  -3.375  -4.776 -14.371
  545   HG21  VAL  67          HG21      VAL  67  -3.533  -7.086 -13.523
  546   HG22  VAL  67          HG22      VAL  67  -4.666  -7.490 -12.234
  547   HG23  VAL  67          HG23      VAL  67  -3.218  -6.550 -11.873
  548    H    LYS  68           HN       LYS  68  -5.113  -7.006 -10.134
  549    HA   LYS  68           HA       LYS  68  -7.615  -8.293 -10.746
  550    HB2  LYS  68           HB2      LYS  68  -5.476  -9.422 -10.002
  551    HB3  LYS  68           HB1      LYS  68  -5.832  -8.857  -8.378
  552    HG2  LYS  68           HG2      LYS  68  -6.509 -11.175  -8.706
  553    HG3  LYS  68           HG1      LYS  68  -7.890 -10.137  -8.353
  554    HD2  LYS  68           HD2      LYS  68  -8.458 -11.687 -10.124
  555    HD3  LYS  68           HD1      LYS  68  -8.406 -10.046 -10.764
  556    HE2  LYS  68           HE2      LYS  68  -5.921 -11.665 -10.918
  557    HE3  LYS  68           HE1      LYS  68  -7.246 -12.102 -11.995
  558    HZ1  LYS  68           HZ1      LYS  68  -7.274  -9.708 -12.690
  559    HZ2  LYS  68           HZ2      LYS  68  -5.895 -10.571 -13.149
  560    HZ3  LYS  68           HZ3      LYS  68  -5.824  -9.503 -11.843
  561    H    TYR  69           HN       TYR  69  -6.533  -6.112  -8.201
  562    HA   TYR  69           HA       TYR  69  -9.231  -6.324  -6.949
  563    HB2  TYR  69           HB2      TYR  69  -6.542  -5.517  -5.862
  564    HB3  TYR  69           HB1      TYR  69  -8.030  -5.065  -5.039
  565    HD1  TYR  69           HD1      TYR  69  -6.650  -8.179  -6.609
  566    HD2  TYR  69           HD2      TYR  69  -8.541  -6.395  -3.240
  567    HE1  TYR  69           HE1      TYR  69  -6.673 -10.359  -5.476
  568    HE2  TYR  69           HE2      TYR  69  -8.569  -8.569  -2.099
  569    HH   TYR  69           HH       TYR  69  -8.520 -10.997  -2.748
  570    H    SER  70           HN       SER  70 -10.244  -4.339  -6.183
  571    HA   SER  70           HA       SER  70  -9.995  -2.255  -8.206
  572    HB2  SER  70           HB2      SER  70 -12.197  -2.963  -7.319
  573    HB3  SER  70           HB1      SER  70 -11.742  -2.341  -5.734
  574    HG   SER  70           HG       SER  70 -12.282  -0.932  -8.110
  575    H    LEU  71           HN       LEU  71  -7.917  -1.411  -7.907
  576    HA   LEU  71           HA       LEU  71  -7.647   0.243  -5.435
  577    HB2  LEU  71           HB2      LEU  71  -5.535  -1.148  -7.079
  578    HB3  LEU  71           HB1      LEU  71  -5.156   0.115  -5.925
  579    HG   LEU  71           HG       LEU  71  -6.276  -1.334  -4.164
  580   HD11  LEU  71          HD11      LEU  71  -6.131  -3.315  -6.418
  581   HD12  LEU  71          HD12      LEU  71  -7.546  -2.834  -5.483
  582   HD13  LEU  71          HD13      LEU  71  -6.266  -3.776  -4.721
  583   HD21  LEU  71          HD21      LEU  71  -3.898  -1.129  -4.207
  584   HD22  LEU  71          HD22      LEU  71  -3.773  -2.256  -5.559
  585   HD23  LEU  71          HD23      LEU  71  -4.292  -2.833  -3.975
  586    H    LEU  72           HN       LEU  72  -6.035   0.126  -8.639
  587    HA   LEU  72           HA       LEU  72  -6.566   3.051  -8.852
  588    HB2  LEU  72           HB2      LEU  72  -4.359   1.300  -9.893
  589    HB3  LEU  72           HB1      LEU  72  -4.694   2.852 -10.635
  590    HG   LEU  72           HG       LEU  72  -2.854   2.991  -9.023
  591   HD11  LEU  72          HD11      LEU  72  -5.333   4.445  -8.111
  592   HD12  LEU  72          HD12      LEU  72  -4.250   4.954  -9.407
  593   HD13  LEU  72          HD13      LEU  72  -3.668   4.899  -7.744
  594   HD21  LEU  72          HD21      LEU  72  -4.912   2.227  -6.954
  595   HD22  LEU  72          HD22      LEU  72  -3.246   2.709  -6.642
  596   HD23  LEU  72          HD23      LEU  72  -3.581   1.209  -7.504
  597    H    GLU  73           HN       GLU  73  -8.465   3.251  -9.875
  598    HA   GLU  73           HA       GLU  73  -8.835   1.680 -12.377
  599    HB2  GLU  73           HB2      GLU  73 -10.782   3.019 -10.506
  600    HB3  GLU  73           HB1      GLU  73 -11.250   2.503 -12.120
  601    HG2  GLU  73           HG2      GLU  73 -11.875   0.856 -10.454
  602    HG3  GLU  73           HG1      GLU  73 -10.679   0.204 -11.570
  Start of MODEL    5
    1    H1   SER   1           HT1      SER   1   0.026  16.766   7.355
    2    H2   SER   1           HT2      SER   1   0.822  16.226   8.747
    3    H3   SER   1           HT3      SER   1  -0.801  16.692   8.829
    4    HA   SER   1           HA       SER   1  -0.589  14.297   8.869
    5    HB2  SER   1           HB2      SER   1  -2.595  15.298   7.865
    6    HB3  SER   1           HB1      SER   1  -1.783  15.382   6.302
    7    HG   SER   1           HG       SER   1  -2.722  13.495   6.080
    8    H    ASP   2           HN       ASP   2   1.208  13.089   8.688
    9    HA   ASP   2           HA       ASP   2   2.501  12.985   6.000
   10    HB2  ASP   2           HB2      ASP   2   3.864  13.609   8.055
   11    HB3  ASP   2           HB1      ASP   2   3.635  11.957   8.615
   12    H    VAL   3           HN       VAL   3   3.217  10.952   5.154
   13    HA   VAL   3           HA       VAL   3   1.188   8.936   5.327
   14    HB   VAL   3           HB       VAL   3   2.543   9.393   3.294
   15   HG11  VAL   3          HG11      VAL   3   4.734   7.948   4.781
   16   HG12  VAL   3          HG12      VAL   3   4.731   9.654   4.338
   17   HG13  VAL   3          HG13      VAL   3   4.774   8.417   3.082
   18   HG21  VAL   3          HG21      VAL   3   2.743   7.069   2.585
   19   HG22  VAL   3          HG22      VAL   3   1.267   7.319   3.517
   20   HG23  VAL   3          HG23      VAL   3   2.660   6.539   4.266
   21    H    TRP   4           HN       TRP   4   4.406   9.274   6.789
   22    HA   TRP   4           HA       TRP   4   4.398   6.545   7.789
   23    HB2  TRP   4           HB2      TRP   4   6.372   8.358   7.334
   24    HB3  TRP   4           HB1      TRP   4   6.177   8.520   9.075
   25    HD1  TRP   4           HD1      TRP   4   5.721   5.516   9.894
   26    HE1  TRP   4           HE1      TRP   4   7.640   3.776   9.704
   27    HE3  TRP   4           HE3      TRP   4   8.618   7.962   6.460
   28    HZ2  TRP   4           HZ2      TRP   4  10.059   3.541   8.257
   29    HZ3  TRP   4           HZ3      TRP   4  10.720   6.912   5.728
   30    HH2  TRP   4           HH2      TRP   4  11.425   4.746   6.609
   31    H    SER   5           HN       SER   5   3.686   9.787   9.074
   32    HA   SER   5           HA       SER   5   3.343   9.014  11.790
   33    HB2  SER   5           HB2      SER   5   3.505  11.362  11.089
   34    HB3  SER   5           HB1      SER   5   1.968  11.226  10.236
   35    HG   SER   5           HG       SER   5   0.916  11.306  12.085
   36    H    LEU   6           HN       LEU   6   0.935   9.410   9.157
   37    HA   LEU   6           HA       LEU   6  -1.056   7.994  10.825
   38    HB2  LEU   6           HB2      LEU   6  -1.317   9.333   8.130
   39    HB3  LEU   6           HB1      LEU   6  -2.636   8.590   9.012
   40    HG   LEU   6           HG       LEU   6  -1.050  10.997   9.915
   41   HD11  LEU   6          HD11      LEU   6  -3.893  10.773   8.939
   42   HD12  LEU   6          HD12      LEU   6  -2.546  11.454   8.029
   43   HD13  LEU   6          HD13      LEU   6  -3.096  12.239   9.508
   44   HD21  LEU   6          HD21      LEU   6  -1.787   9.656  11.807
   45   HD22  LEU   6          HD22      LEU   6  -3.429   9.627  11.167
   46   HD23  LEU   6          HD23      LEU   6  -2.720  11.149  11.706
   47    H    SER   7           HN       SER   7  -0.035   5.944  10.798
   48    HA   SER   7           HA       SER   7  -0.218   4.574   8.149
   49    HB2  SER   7           HB2      SER   7   1.614   4.072  10.500
   50    HB3  SER   7           HB1      SER   7   1.445   2.953   9.148
   51    HG   SER   7           HG       SER   7   3.153   4.759   9.169
   52    H    LYS   8           HN       LYS   8  -2.030   4.941  10.812
   53    HA   LYS   8           HA       LYS   8  -2.640   2.072  11.165
   54    HB2  LYS   8           HB2      LYS   8  -3.658   4.542  12.577
   55    HB3  LYS   8           HB1      LYS   8  -4.172   2.903  12.952
   56    HG2  LYS   8           HG2      LYS   8  -1.349   3.934  13.162
   57    HG3  LYS   8           HG1      LYS   8  -2.469   3.729  14.509
   58    HD2  LYS   8           HD2      LYS   8  -1.614   1.481  12.689
   59    HD3  LYS   8           HD1      LYS   8  -0.803   1.868  14.206
   60    HE2  LYS   8           HE2      LYS   8  -2.928   1.519  15.403
   61    HE3  LYS   8           HE1      LYS   8  -3.698   1.082  13.878
   62    HZ1  LYS   8           HZ1      LYS   8  -1.434  -0.363  15.148
   63    HZ2  LYS   8           HZ2      LYS   8  -2.171  -0.783  13.686
   64    HZ3  LYS   8           HZ3      LYS   8  -3.046  -0.876  15.130
   65    H    THR   9           HN       THR   9  -3.654   4.708   9.253
   66    HA   THR   9           HA       THR   9  -6.462   4.037   9.102
   67    HB   THR   9           HB       THR   9  -6.474   5.522   7.107
   68    HG1  THR   9           HG1      THR   9  -4.631   6.266   6.268
   69   HG21  THR   9          HG21      THR   9  -5.831   7.589   8.302
   70   HG22  THR   9          HG22      THR   9  -5.051   6.604   9.541
   71   HG23  THR   9          HG23      THR   9  -6.794   6.500   9.302
   72    H    SER  10           HN       SER  10  -7.178   2.163   8.331
   73    HA   SER  10           HA       SER  10  -5.662   0.846   6.160
   74    HB2  SER  10           HB2      SER  10  -7.138  -1.086   6.609
   75    HB3  SER  10           HB1      SER  10  -6.315  -0.539   8.067
   76    HG   SER  10           HG       SER  10  -8.409  -0.793   8.651
   77    H    MET  11           HN       MET  11  -6.968  -0.274   4.426
   78    HA   MET  11           HA       MET  11  -9.318   1.360   3.618
   79    HB2  MET  11           HB2      MET  11  -7.381   2.290   2.448
   80    HB3  MET  11           HB1      MET  11  -6.952   0.691   1.857
   81    HG2  MET  11           HG2      MET  11  -7.998   1.889   0.089
   82    HG3  MET  11           HG1      MET  11  -9.101   0.624   0.627
   83    HE1  MET  11           HE1      MET  11  -9.989   3.079  -1.206
   84    HE2  MET  11           HE2      MET  11 -11.523   3.514  -0.453
   85    HE3  MET  11           HE3      MET  11 -11.097   1.816  -0.669
   86    H    THR  12           HN       THR  12 -10.922   0.282   2.533
   87    HA   THR  12           HA       THR  12 -10.624  -2.659   2.531
   88    HB   THR  12           HB       THR  12 -13.104  -0.978   2.098
   89    HG1  THR  12           HG1      THR  12 -12.735  -0.710   4.203
   90   HG21  THR  12          HG21      THR  12 -13.300  -3.201   1.106
   91   HG22  THR  12          HG22      THR  12 -14.313  -3.074   2.545
   92   HG23  THR  12          HG23      THR  12 -12.776  -3.938   2.621
   93    H    PHE  13           HN       PHE  13 -10.129  -3.740   0.775
   94    HA   PHE  13           HA       PHE  13 -10.566  -2.461  -1.868
   95    HB2  PHE  13           HB2      PHE  13  -8.749  -4.639  -0.874
   96    HB3  PHE  13           HB1      PHE  13  -9.080  -4.467  -2.591
   97    HD1  PHE  13           HD2      PHE  13  -9.248  -1.399  -2.557
   98    HD2  PHE  13           HD1      PHE  13  -6.435  -4.165  -0.963
   99    HE1  PHE  13           HE2      PHE  13  -7.485   0.308  -2.719
  100    HE2  PHE  13           HE1      PHE  13  -4.670  -2.464  -1.121
  101    HZ   PHE  13           HZ       PHE  13  -5.191  -0.223  -2.001
  102    H    GLN  14           HN       GLN  14 -11.651  -3.475  -3.545
  103    HA   GLN  14           HA       GLN  14 -13.340  -5.767  -2.657
  104    HB2  GLN  14           HB2      GLN  14 -15.034  -4.943  -4.276
  105    HB3  GLN  14           HB1      GLN  14 -14.707  -3.809  -2.973
  106    HG2  GLN  14           HG2      GLN  14 -13.294  -2.494  -4.454
  107    HG3  GLN  14           HG1      GLN  14 -13.586  -3.637  -5.762
  108   HE21  GLN  14          HE21      GLN  14 -15.580  -3.704  -6.797
  109   HE22  GLN  14          HE22      GLN  14 -16.770  -2.369  -6.608
  110    HA   PRO  15           HA       PRO  15 -11.222  -8.018  -5.871
  111    HB2  PRO  15           HB2      PRO  15 -12.815 -10.232  -5.810
  112    HB3  PRO  15           HB1      PRO  15 -11.551  -9.912  -4.619
  113    HG2  PRO  15           HG2      PRO  15 -14.498  -9.448  -4.424
  114    HG3  PRO  15           HG1      PRO  15 -13.385 -10.109  -3.213
  115    HD2  PRO  15           HD2      PRO  15 -14.238  -7.550  -3.138
  116    HD3  PRO  15           HD1      PRO  15 -12.615  -8.023  -2.597
  117    H    LYS  16           HN       LYS  16 -11.467  -8.399  -8.055
  118    HA   LYS  16           HA       LYS  16 -13.766  -7.147  -9.296
  119    HB2  LYS  16           HB2      LYS  16 -11.503  -8.753 -10.509
  120    HB3  LYS  16           HB1      LYS  16 -12.681  -7.820 -11.419
  121    HG2  LYS  16           HG2      LYS  16 -10.651  -6.742  -9.477
  122    HG3  LYS  16           HG1      LYS  16 -10.620  -6.589 -11.233
  123    HD2  LYS  16           HD2      LYS  16 -12.636  -5.239 -11.176
  124    HD3  LYS  16           HD1      LYS  16 -12.759  -5.454  -9.429
  125    HE2  LYS  16           HE2      LYS  16 -10.556  -4.331  -9.192
  126    HE3  LYS  16           HE1      LYS  16 -10.569  -4.020 -10.927
  127    HZ1  LYS  16           HZ1      LYS  16 -12.573  -3.020  -8.975
  128    HZ2  LYS  16           HZ2      LYS  16 -12.591  -2.723 -10.640
  129    HZ3  LYS  16           HZ3      LYS  16 -11.341  -2.103  -9.685
  130    H    LYS  17           HN       LYS  17 -12.625 -10.485  -8.824
  131    HA   LYS  17           HA       LYS  17 -15.215 -11.443  -9.956
  132    HB2  LYS  17           HB2      LYS  17 -12.530 -12.818  -9.783
  133    HB3  LYS  17           HB1      LYS  17 -14.013 -13.635 -10.247
  134    HG2  LYS  17           HG2      LYS  17 -12.951 -13.133 -12.262
  135    HG3  LYS  17           HG1      LYS  17 -14.204 -11.901 -12.102
  136    HD2  LYS  17           HD2      LYS  17 -12.553 -10.305 -11.295
  137    HD3  LYS  17           HD1      LYS  17 -11.295 -11.538 -11.376
  138    HE2  LYS  17           HE2      LYS  17 -12.888 -10.555 -13.740
  139    HE3  LYS  17           HE1      LYS  17 -11.291  -9.959 -13.298
  140    HZ1  LYS  17           HZ1      LYS  17 -11.117 -11.630 -15.006
  141    HZ2  LYS  17           HZ2      LYS  17 -11.969 -12.748 -14.066
  142    HZ3  LYS  17           HZ3      LYS  17 -10.437 -12.224 -13.575
  143    H    ALA  18           HN       ALA  18 -15.864 -13.658  -9.027
  144    HA   ALA  18           HA       ALA  18 -16.365 -13.297  -6.234
  145    HB1  ALA  18           HB1      ALA  18 -17.889 -14.506  -7.703
  146    HB2  ALA  18           HB2      ALA  18 -17.398 -15.512  -6.341
  147    HB3  ALA  18           HB3      ALA  18 -16.681 -15.771  -7.931
  148    H    SER  19           HN       SER  19 -14.043 -15.309  -8.031
  149    HA   SER  19           HA       SER  19 -13.117 -16.901  -5.905
  150    HB2  SER  19           HB2      SER  19 -12.495 -17.281  -8.248
  151    HB3  SER  19           HB1      SER  19 -11.539 -15.800  -8.245
  152    HG   SER  19           HG       SER  19  -9.971 -16.974  -7.513
  153    H    LEU  20           HN       LEU  20 -12.051 -13.650  -6.932
  154    HA   LEU  20           HA       LEU  20  -9.933 -13.454  -5.019
  155    HB2  LEU  20           HB2      LEU  20 -11.534 -11.328  -6.431
  156    HB3  LEU  20           HB1      LEU  20 -10.099 -11.008  -5.486
  157    HG   LEU  20           HG       LEU  20 -10.180 -12.718  -7.972
  158   HD11  LEU  20          HD11      LEU  20  -9.174  -9.907  -7.561
  159   HD12  LEU  20          HD12      LEU  20 -10.599 -10.379  -8.485
  160   HD13  LEU  20          HD13      LEU  20  -8.993 -10.860  -9.034
  161   HD21  LEU  20          HD21      LEU  20  -8.428 -13.370  -6.383
  162   HD22  LEU  20          HD22      LEU  20  -7.843 -11.706  -6.355
  163   HD23  LEU  20          HD23      LEU  20  -7.753 -12.647  -7.843
  164    H    GLN  21           HN       GLN  21  -9.784 -12.262  -3.086
  165    HA   GLN  21           HA       GLN  21 -12.414 -11.909  -1.715
  166    HB2  GLN  21           HB2      GLN  21  -9.786 -12.854  -0.562
  167    HB3  GLN  21           HB1      GLN  21 -11.213 -12.486   0.393
  168    HG2  GLN  21           HG2      GLN  21 -11.035 -14.613  -1.730
  169    HG3  GLN  21           HG1      GLN  21 -10.937 -14.886   0.009
  170   HE21  GLN  21          HE21      GLN  21 -12.778 -14.661   1.303
  171   HE22  GLN  21          HE22      GLN  21 -14.421 -14.661   0.573
  172    HA   PRO  22           HA       PRO  22 -11.444  -7.634  -1.138
  173    HB2  PRO  22           HB2      PRO  22 -12.812  -7.958   1.480
  174    HB3  PRO  22           HB1      PRO  22 -13.145  -6.823   0.167
  175    HG2  PRO  22           HG2      PRO  22 -14.739  -8.911   0.601
  176    HG3  PRO  22           HG1      PRO  22 -14.361  -8.377  -1.047
  177    HD2  PRO  22           HD2      PRO  22 -13.283 -10.704   0.490
  178    HD3  PRO  22           HD1      PRO  22 -13.696 -10.582  -1.232
  179    H    LEU  23           HN       LEU  23 -10.019  -6.301  -0.077
  180    HA   LEU  23           HA       LEU  23  -8.398  -7.622   2.057
  181    HB2  LEU  23           HB2      LEU  23  -7.336  -7.090  -0.211
  182    HB3  LEU  23           HB1      LEU  23  -7.464  -5.406   0.253
  183    HG   LEU  23           HG       LEU  23  -6.149  -6.138   2.374
  184   HD11  LEU  23          HD11      LEU  23  -4.665  -8.019   2.042
  185   HD12  LEU  23          HD12      LEU  23  -5.389  -8.342   0.466
  186   HD13  LEU  23          HD13      LEU  23  -6.344  -8.549   1.934
  187   HD21  LEU  23          HD21      LEU  23  -4.037  -5.739   1.218
  188   HD22  LEU  23          HD22      LEU  23  -5.292  -4.633   0.660
  189   HD23  LEU  23          HD23      LEU  23  -4.830  -6.014  -0.334
  190    H    THR  24           HN       THR  24  -7.702  -6.395   3.850
  191    HA   THR  24           HA       THR  24  -8.629  -3.631   4.032
  192    HB   THR  24           HB       THR  24  -9.674  -5.638   6.028
  193    HG1  THR  24           HG1      THR  24 -11.107  -5.904   4.463
  194   HG21  THR  24          HG21      THR  24 -11.006  -3.724   6.846
  195   HG22  THR  24          HG22      THR  24 -10.158  -2.672   5.712
  196   HG23  THR  24          HG23      THR  24  -9.271  -3.456   7.019
  197    H    ILE  25           HN       ILE  25  -6.374  -3.210   4.193
  198    HA   ILE  25           HA       ILE  25  -5.409  -3.572   6.960
  199    HB   ILE  25           HB       ILE  25  -4.548  -5.481   5.522
  200   HG12  ILE  25          HG12      ILE  25  -2.247  -3.864   6.553
  201   HG13  ILE  25          HG11      ILE  25  -3.499  -4.397   7.670
  202   HG21  ILE  25          HG21      ILE  25  -4.122  -4.221   3.485
  203   HG22  ILE  25          HG22      ILE  25  -2.652  -5.010   4.056
  204   HG23  ILE  25          HG23      ILE  25  -2.880  -3.279   4.313
  205   HD11  ILE  25          HD11      ILE  25  -1.865  -6.194   5.896
  206   HD12  ILE  25          HD12      ILE  25  -3.082  -6.705   7.065
  207   HD13  ILE  25          HD13      ILE  25  -1.601  -5.925   7.618
  208    H    SER  26           HN       SER  26  -3.502  -2.221   7.475
  209    HA   SER  26           HA       SER  26  -3.519   0.222   5.763
  210    HB2  SER  26           HB2      SER  26  -3.229   1.545   7.747
  211    HB3  SER  26           HB1      SER  26  -4.569   0.442   8.034
  212    HG   SER  26           HG       SER  26  -2.125   0.596   9.274
  213    H    LEU  27           HN       LEU  27  -1.569   1.687   6.495
  214    HA   LEU  27           HA       LEU  27   0.807   0.643   5.409
  215    HB2  LEU  27           HB2      LEU  27   0.604   2.860   7.415
  216    HB3  LEU  27           HB1      LEU  27   1.870   2.616   6.228
  217    HG   LEU  27           HG       LEU  27  -0.984   3.440   5.710
  218   HD11  LEU  27          HD11      LEU  27   0.076   5.430   4.745
  219   HD12  LEU  27          HD12      LEU  27   1.655   4.812   5.229
  220   HD13  LEU  27          HD13      LEU  27   0.460   5.233   6.455
  221   HD21  LEU  27          HD21      LEU  27  -0.456   3.444   3.348
  222   HD22  LEU  27          HD22      LEU  27  -0.236   1.824   4.008
  223   HD23  LEU  27          HD23      LEU  27   1.167   2.843   3.682
  224    H    ASP  28           HN       ASP  28   0.238   1.386   8.863
  225    HA   ASP  28           HA       ASP  28   2.673   0.213   9.749
  226    HB2  ASP  28           HB2      ASP  28   1.379   1.849  11.062
  227    HB3  ASP  28           HB1      ASP  28   0.104   0.658  11.286
  228    H    GLU  29           HN       GLU  29  -0.596  -1.111   9.399
  229    HA   GLU  29           HA       GLU  29   0.075  -3.605  10.700
  230    HB2  GLU  29           HB2      GLU  29  -2.238  -2.877   8.904
  231    HB3  GLU  29           HB1      GLU  29  -2.112  -4.364   9.833
  232    HG2  GLU  29           HG2      GLU  29  -2.272  -1.569  10.938
  233    HG3  GLU  29           HG1      GLU  29  -3.544  -2.788  10.960
  234    H    LEU  30           HN       LEU  30   0.610  -2.380   7.491
  235    HA   LEU  30           HA       LEU  30   1.058  -5.184   6.597
  236    HB2  LEU  30           HB2      LEU  30  -0.695  -3.869   5.383
  237    HB3  LEU  30           HB1      LEU  30   0.561  -2.773   4.846
  238    HG   LEU  30           HG       LEU  30   1.650  -4.633   3.635
  239   HD11  LEU  30          HD11      LEU  30   0.459  -6.739   3.334
  240   HD12  LEU  30          HD12      LEU  30  -0.778  -6.210   4.473
  241   HD13  LEU  30          HD13      LEU  30   0.875  -6.478   5.028
  242   HD21  LEU  30          HD21      LEU  30  -1.256  -4.295   2.916
  243   HD22  LEU  30          HD22      LEU  30   0.052  -4.765   1.833
  244   HD23  LEU  30          HD23      LEU  30   0.022  -3.145   2.530
  245    H    PHE  31           HN       PHE  31   2.885  -2.972   7.923
  246    HA   PHE  31           HA       PHE  31   5.098  -3.648   6.101
  247    HB2  PHE  31           HB2      PHE  31   4.773  -0.893   7.324
  248    HB3  PHE  31           HB1      PHE  31   6.169  -1.419   6.393
  249    HD1  PHE  31           HD1      PHE  31   4.903  -2.827   4.144
  250    HD2  PHE  31           HD2      PHE  31   3.810   0.796   6.087
  251    HE1  PHE  31           HE1      PHE  31   3.805  -2.055   2.082
  252    HE2  PHE  31           HE2      PHE  31   2.709   1.572   4.031
  253    HZ   PHE  31           HZ       PHE  31   2.703   0.144   2.028
  254    H    SER  32           HN       SER  32   7.053  -4.188   7.022
  255    HA   SER  32           HA       SER  32   7.157  -4.029   9.988
  256    HB2  SER  32           HB2      SER  32   8.176  -6.337   9.927
  257    HB3  SER  32           HB1      SER  32   6.458  -6.250   9.542
  258    HG   SER  32           HG       SER  32   8.573  -7.022   7.982
  259    H    SER  33           HN       SER  33   8.499  -2.263   8.139
  260    HA   SER  33           HA       SER  33  11.155  -2.400   9.113
  261    HB2  SER  33           HB2      SER  33  11.643  -4.261   7.745
  262    HB3  SER  33           HB1      SER  33  10.739  -3.601   6.384
  263    HG   SER  33           HG       SER  33  12.885  -3.274   5.955
  264    H    ARG  34           HN       ARG  34  12.203  -0.493   8.879
  265    HA   ARG  34           HA       ARG  34  10.755   1.700   7.763
  266    HB2  ARG  34           HB2      ARG  34  13.629   1.410   8.641
  267    HB3  ARG  34           HB1      ARG  34  12.964   2.931   8.064
  268    HG2  ARG  34           HG2      ARG  34  11.237   2.752   9.875
  269    HG3  ARG  34           HG1      ARG  34  12.150   1.381  10.508
  270    HD2  ARG  34           HD2      ARG  34  12.778   3.392  11.693
  271    HD3  ARG  34           HD1      ARG  34  14.133   2.833  10.713
  272    HE   ARG  34           HE       ARG  34  12.587   4.734   9.240
  273   HH11  ARG  34          HH11      ARG  34  14.875   4.521  11.935
  274   HH12  ARG  34          HH12      ARG  34  15.468   6.132  11.715
  275   HH21  ARG  34          HH21      ARG  34  13.396   6.847   8.987
  276   HH22  ARG  34          HH22      ARG  34  14.629   7.454  10.042
  277    H    GLY  35           HN       GLY  35  13.669  -0.057   6.624
  278    HA2  GLY  35           HA2      GLY  35  13.988   1.420   4.215
  279    HA3  GLY  35           HA1      GLY  35  14.554  -0.221   4.491
  280    H    GLU  36           HN       GLU  36  11.964  -1.385   5.014
  281    HA   GLU  36           HA       GLU  36  11.168  -2.007   2.353
  282    HB2  GLU  36           HB2      GLU  36  10.728  -3.543   4.173
  283    HB3  GLU  36           HB1      GLU  36   9.725  -2.354   4.990
  284    HG2  GLU  36           HG2      GLU  36   8.318  -3.993   3.974
  285    HG3  GLU  36           HG1      GLU  36   8.124  -2.469   3.112
  286    H    PHE  37           HN       PHE  37   9.853   0.218   4.804
  287    HA   PHE  37           HA       PHE  37   7.567   1.079   3.388
  288    HB2  PHE  37           HB2      PHE  37   8.144   1.623   5.772
  289    HB3  PHE  37           HB1      PHE  37   9.325   2.782   5.173
  290    HD1  PHE  37           HD2      PHE  37   5.742   2.021   5.464
  291    HD2  PHE  37           HD1      PHE  37   8.654   4.906   4.318
  292    HE1  PHE  37           HE2      PHE  37   3.991   3.744   5.370
  293    HE2  PHE  37           HE1      PHE  37   6.907   6.636   4.226
  294    HZ   PHE  37           HZ       PHE  37   4.572   6.056   4.751
  295    H    ILE  38           HN       ILE  38  10.921   2.329   3.360
  296    HA   ILE  38           HA       ILE  38  10.565   4.433   1.554
  297    HB   ILE  38           HB       ILE  38  12.953   2.596   1.804
  298   HG12  ILE  38          HG12      ILE  38  12.465   3.574   3.938
  299   HG13  ILE  38          HG11      ILE  38  13.819   4.463   3.254
  300   HG21  ILE  38          HG21      ILE  38  12.680   5.325   0.556
  301   HG22  ILE  38          HG22      ILE  38  13.134   3.821  -0.244
  302   HG23  ILE  38          HG23      ILE  38  14.222   4.556   0.933
  303   HD11  ILE  38          HD11      ILE  38  12.221   5.946   4.328
  304   HD12  ILE  38          HD12      ILE  38  10.947   5.366   3.254
  305   HD13  ILE  38          HD13      ILE  38  12.316   6.261   2.595
  306    H    SER  39           HN       SER  39  11.411   1.001   0.815
  307    HA   SER  39           HA       SER  39  11.562   1.366  -1.995
  308    HB2  SER  39           HB2      SER  39  10.720  -1.127  -0.451
  309    HB3  SER  39           HB1      SER  39  11.220  -1.098  -2.142
  310    HG   SER  39           HG       SER  39  12.738  -1.114   0.103
  311    H    VAL  40           HN       VAL  40   8.839  -0.238  -0.216
  312    HA   VAL  40           HA       VAL  40   6.998  -0.512  -2.107
  313    HB   VAL  40           HB       VAL  40   5.185   0.015  -0.493
  314   HG11  VAL  40          HG11      VAL  40   6.320  -2.168  -0.561
  315   HG12  VAL  40          HG12      VAL  40   5.751  -1.753   1.054
  316   HG13  VAL  40          HG13      VAL  40   7.461  -1.595   0.655
  317   HG21  VAL  40          HG21      VAL  40   7.446   0.807   1.334
  318   HG22  VAL  40          HG22      VAL  40   5.745   0.670   1.775
  319   HG23  VAL  40          HG23      VAL  40   6.263   1.911   0.634
  320    H    GLY  41           HN       GLY  41   7.766   2.783  -0.815
  321    HA2  GLY  41           HA2      GLY  41   7.450   4.418  -2.736
  322    HA3  GLY  41           HA1      GLY  41   5.807   3.800  -2.813
  323    H    GLY  42           HN       GLY  42   7.742   4.431   0.126
  324    HA2  GLY  42           HA2      GLY  42   5.647   6.427   0.867
  325    HA3  GLY  42           HA1      GLY  42   6.482   5.397   2.009
  326    H    ASP  43           HN       ASP  43   6.516   8.327   0.202
  327    HA   ASP  43           HA       ASP  43   9.225   9.016   1.139
  328    HB2  ASP  43           HB2      ASP  43   7.196  10.525  -0.525
  329    HB3  ASP  43           HB1      ASP  43   8.757  11.194  -0.053
  330    H    GLY  44           HN       GLY  44   6.268  11.056   1.133
  331    HA2  GLY  44           HA2      GLY  44   6.283  11.133   4.075
  332    HA3  GLY  44           HA1      GLY  44   6.775  12.622   3.286
  333    H    ARG  45           HN       ARG  45   5.239  13.434   1.552
  334    HA   ARG  45           HA       ARG  45   2.565  13.433   2.762
  335    HB2  ARG  45           HB2      ARG  45   3.826  15.045   0.544
  336    HB3  ARG  45           HB1      ARG  45   2.141  15.217   1.017
  337    HG2  ARG  45           HG2      ARG  45   3.498  16.937   2.050
  338    HG3  ARG  45           HG1      ARG  45   2.837  15.851   3.273
  339    HD2  ARG  45           HD2      ARG  45   4.914  14.768   3.575
  340    HD3  ARG  45           HD1      ARG  45   5.599  15.511   2.132
  341    HE   ARG  45           HE       ARG  45   4.991  17.669   3.706
  342   HH11  ARG  45          HH11      ARG  45   6.829  14.688   4.246
  343   HH12  ARG  45          HH12      ARG  45   7.894  15.413   5.403
  344   HH21  ARG  45          HH21      ARG  45   6.418  18.580   5.232
  345   HH22  ARG  45          HH22      ARG  45   7.663  17.622   5.960
  346    H    MET  46           HN       MET  46   1.411  11.658   2.303
  347    HA   MET  46           HA       MET  46   1.389  10.656  -0.478
  348    HB2  MET  46           HB2      MET  46   1.521   9.248   1.737
  349    HB3  MET  46           HB1      MET  46  -0.222   9.470   1.754
  350    HG2  MET  46           HG2      MET  46  -0.122   7.515   0.625
  351    HG3  MET  46           HG1      MET  46   0.013   8.617  -0.736
  352    HE1  MET  46           HE1      MET  46   3.723   8.452  -1.733
  353    HE2  MET  46           HE2      MET  46   2.965   9.680  -0.720
  354    HE3  MET  46           HE3      MET  46   2.106   9.040  -2.122
  355    H    SER  47           HN       SER  47  -0.762  10.031  -1.442
  356    HA   SER  47           HA       SER  47  -2.541  12.355  -1.174
  357    HB2  SER  47           HB2      SER  47  -1.838  11.561  -3.412
  358    HB3  SER  47           HB1      SER  47  -2.668  10.036  -3.116
  359    HG   SER  47           HG       SER  47  -4.277  11.077  -4.001
  360    H    HIS  48           HN       HIS  48  -3.209   8.869  -1.612
  361    HA   HIS  48           HA       HIS  48  -4.850   8.432   0.675
  362    HB2  HIS  48           HB2      HIS  48  -6.361  10.108  -0.163
  363    HB3  HIS  48           HB1      HIS  48  -6.300   9.415  -1.778
  364    HD1  HIS  48           HD1      HIS  48  -7.883   9.009   1.593
  365    HD2  HIS  48           HD2      HIS  48  -7.859   7.091  -2.136
  366    HE1  HIS  48           HE1      HIS  48  -9.808   7.358   1.624
  367    HE2  HIS  48           HE2      HIS  48  -9.718   6.112  -0.591
  368    H    LYS  49           HN       LYS  49  -4.972   7.837  -2.876
  369    HA   LYS  49           HA       LYS  49  -5.448   4.999  -2.408
  370    HB2  LYS  49           HB2      LYS  49  -5.087   6.791  -4.771
  371    HB3  LYS  49           HB1      LYS  49  -4.854   5.065  -4.986
  372    HG2  LYS  49           HG2      LYS  49  -7.339   6.345  -3.870
  373    HG3  LYS  49           HG1      LYS  49  -7.134   5.802  -5.536
  374    HD2  LYS  49           HD2      LYS  49  -6.785   3.511  -4.750
  375    HD3  LYS  49           HD1      LYS  49  -6.974   4.051  -3.081
  376    HE2  LYS  49           HE2      LYS  49  -9.257   4.659  -3.469
  377    HE3  LYS  49           HE1      LYS  49  -9.094   4.363  -5.200
  378    HZ1  LYS  49           HZ1      LYS  49  -8.812   2.034  -4.781
  379    HZ2  LYS  49           HZ2      LYS  49 -10.222   2.550  -4.004
  380    HZ3  LYS  49           HZ3      LYS  49  -8.815   2.276  -3.106
  381    H    GLU  50           HN       GLU  50  -2.687   7.099  -2.823
  382    HA   GLU  50           HA       GLU  50  -0.829   5.153  -3.769
  383    HB2  GLU  50           HB2      GLU  50  -0.481   7.749  -2.274
  384    HB3  GLU  50           HB1      GLU  50   0.867   6.804  -2.886
  385    HG2  GLU  50           HG2      GLU  50  -0.017   7.046  -5.161
  386    HG3  GLU  50           HG1      GLU  50  -1.337   8.027  -4.529
  387    H    ALA  51           HN       ALA  51  -1.438   6.441  -0.464
  388    HA   ALA  51           HA       ALA  51   0.530   5.001   0.886
  389    HB1  ALA  51           HB1      ALA  51  -2.247   5.614   1.909
  390    HB2  ALA  51           HB2      ALA  51  -0.874   6.719   1.946
  391    HB3  ALA  51           HB3      ALA  51  -0.838   5.236   2.898
  392    H    ILE  52           HN       ILE  52  -2.893   3.885   0.435
  393    HA   ILE  52           HA       ILE  52  -2.315   1.383   1.637
  394    HB   ILE  52           HB       ILE  52  -4.426   1.894  -0.496
  395   HG12  ILE  52          HG12      ILE  52  -4.575   3.493   1.389
  396   HG13  ILE  52          HG11      ILE  52  -5.948   2.402   1.335
  397   HG21  ILE  52          HG21      ILE  52  -4.232  -0.223   1.642
  398   HG22  ILE  52          HG22      ILE  52  -4.070  -0.466  -0.098
  399   HG23  ILE  52          HG23      ILE  52  -5.619   0.032   0.583
  400   HD11  ILE  52          HD11      ILE  52  -5.186   2.750   3.611
  401   HD12  ILE  52          HD12      ILE  52  -3.580   2.168   3.174
  402   HD13  ILE  52          HD13      ILE  52  -4.959   1.070   3.126
  403    H    LEU  53           HN       LEU  53  -2.262   2.444  -1.782
  404    HA   LEU  53           HA       LEU  53  -1.884  -0.077  -2.958
  405    HB2  LEU  53           HB2      LEU  53  -2.266   2.016  -4.214
  406    HB3  LEU  53           HB1      LEU  53  -0.685   2.636  -3.795
  407    HG   LEU  53           HG       LEU  53   0.313   0.720  -5.088
  408   HD11  LEU  53          HD11      LEU  53  -1.108  -0.432  -6.693
  409   HD12  LEU  53          HD12      LEU  53  -2.527   0.384  -6.038
  410   HD13  LEU  53          HD13      LEU  53  -1.630  -0.761  -5.041
  411   HD21  LEU  53          HD21      LEU  53   0.267   2.897  -6.067
  412   HD22  LEU  53          HD22      LEU  53  -1.439   2.734  -6.483
  413   HD23  LEU  53          HD23      LEU  53  -0.234   1.747  -7.305
  414    H    LEU  54           HN       LEU  54   0.533   1.898  -1.184
  415    HA   LEU  54           HA       LEU  54   2.944   0.822  -2.113
  416    HB2  LEU  54           HB2      LEU  54   1.912   1.861   0.503
  417    HB3  LEU  54           HB1      LEU  54   3.354   0.883   0.611
  418    HG   LEU  54           HG       LEU  54   4.515   2.382  -0.932
  419   HD11  LEU  54          HD11      LEU  54   2.537   3.090  -2.228
  420   HD12  LEU  54          HD12      LEU  54   3.523   4.444  -1.681
  421   HD13  LEU  54          HD13      LEU  54   2.017   4.061  -0.851
  422   HD21  LEU  54          HD21      LEU  54   4.577   4.371   0.547
  423   HD22  LEU  54          HD22      LEU  54   4.705   2.846   1.419
  424   HD23  LEU  54          HD23      LEU  54   3.180   3.731   1.408
  425    H    GLY  55           HN       GLY  55   0.441  -0.740  -0.062
  426    HA2  GLY  55           HA2      GLY  55   1.820  -2.855   1.084
  427    HA3  GLY  55           HA1      GLY  55   0.172  -2.966   0.500
  428    H    LEU  56           HN       LEU  56   0.537  -2.748  -2.255
  429    HA   LEU  56           HA       LEU  56   1.049  -5.368  -3.018
  430    HB2  LEU  56           HB2      LEU  56   1.598  -2.985  -4.773
  431    HB3  LEU  56           HB1      LEU  56   1.170  -4.609  -5.282
  432    HG   LEU  56           HG       LEU  56  -0.604  -2.568  -3.957
  433   HD11  LEU  56          HD11      LEU  56  -1.984  -2.975  -5.972
  434   HD12  LEU  56          HD12      LEU  56  -0.701  -4.010  -6.599
  435   HD13  LEU  56          HD13      LEU  56  -0.398  -2.294  -6.330
  436   HD21  LEU  56          HD21      LEU  56  -1.190  -4.568  -2.855
  437   HD22  LEU  56          HD22      LEU  56  -1.029  -5.519  -4.329
  438   HD23  LEU  56          HD23      LEU  56  -2.366  -4.383  -4.158
  439    H    ARG  57           HN       ARG  57   3.375  -2.639  -3.112
  440    HA   ARG  57           HA       ARG  57   5.520  -4.192  -4.163
  441    HB2  ARG  57           HB2      ARG  57   5.448  -1.643  -2.562
  442    HB3  ARG  57           HB1      ARG  57   6.955  -2.347  -3.133
  443    HG2  ARG  57           HG2      ARG  57   4.686  -1.684  -4.987
  444    HG3  ARG  57           HG1      ARG  57   5.932  -0.515  -4.551
  445    HD2  ARG  57           HD2      ARG  57   6.585  -1.512  -6.611
  446    HD3  ARG  57           HD1      ARG  57   7.636  -2.161  -5.355
  447    HE   ARG  57           HE       ARG  57   5.255  -3.750  -6.061
  448   HH11  ARG  57          HH11      ARG  57   8.746  -3.257  -6.433
  449   HH12  ARG  57          HH12      ARG  57   9.035  -4.877  -6.968
  450   HH21  ARG  57          HH21      ARG  57   5.690  -5.871  -6.768
  451   HH22  ARG  57          HH22      ARG  57   7.304  -6.357  -7.162
  452    H    TYR  58           HN       TYR  58   4.334  -3.696  -0.880
  453    HA   TYR  58           HA       TYR  58   6.584  -4.799   0.492
  454    HB2  TYR  58           HB2      TYR  58   4.900  -3.535   1.688
  455    HB3  TYR  58           HB1      TYR  58   3.650  -4.676   1.221
  456    HD1  TYR  58           HD2      TYR  58   6.579  -4.163   3.388
  457    HD2  TYR  58           HD1      TYR  58   3.336  -6.732   2.406
  458    HE1  TYR  58           HE2      TYR  58   6.971  -5.437   5.453
  459    HE2  TYR  58           HE1      TYR  58   3.715  -8.011   4.470
  460    HH   TYR  58           HH       TYR  58   5.605  -6.917   6.993
  461    H    LYS  59           HN       LYS  59   3.539  -6.222  -0.672
  462    HA   LYS  59           HA       LYS  59   4.315  -8.925   0.086
  463    HB2  LYS  59           HB2      LYS  59   2.000  -7.832  -1.494
  464    HB3  LYS  59           HB1      LYS  59   2.192  -9.526  -1.072
  465    HG2  LYS  59           HG2      LYS  59   2.027  -7.304   0.950
  466    HG3  LYS  59           HG1      LYS  59   0.642  -8.249   0.402
  467    HD2  LYS  59           HD2      LYS  59   1.744 -10.299   1.193
  468    HD3  LYS  59           HD1      LYS  59   3.105  -9.336   1.768
  469    HE2  LYS  59           HE2      LYS  59   1.664  -8.173   3.328
  470    HE3  LYS  59           HE1      LYS  59   0.254  -9.031   2.706
  471    HZ1  LYS  59           HZ1      LYS  59   1.170 -11.096   3.514
  472    HZ2  LYS  59           HZ2      LYS  59   1.088  -9.981   4.783
  473    HZ3  LYS  59           HZ3      LYS  59   2.574 -10.314   4.048
  474    H    LYS  60           HN       LYS  60   5.100  -6.912  -2.515
  475    HA   LYS  60           HA       LYS  60   6.120  -7.299  -4.512
  476    HB2  LYS  60           HB2      LYS  60   6.460 -10.114  -3.457
  477    HB3  LYS  60           HB1      LYS  60   7.235  -9.490  -4.905
  478    HG2  LYS  60           HG2      LYS  60   7.645  -8.484  -2.096
  479    HG3  LYS  60           HG1      LYS  60   8.768  -9.472  -3.030
  480    HD2  LYS  60           HD2      LYS  60   7.857  -6.686  -3.757
  481    HD3  LYS  60           HD1      LYS  60   9.409  -7.098  -3.029
  482    HE2  LYS  60           HE2      LYS  60   8.425  -8.085  -5.706
  483    HE3  LYS  60           HE1      LYS  60   9.553  -6.751  -5.470
  484    HZ1  LYS  60           HZ1      LYS  60  11.078  -8.321  -4.392
  485    HZ2  LYS  60           HZ2      LYS  60  10.746  -8.757  -5.991
  486    HZ3  LYS  60           HZ3      LYS  60  10.007  -9.591  -4.719
  487    H    LEU  61           HN       LEU  61   3.839  -6.894  -5.168
  488    HA   LEU  61           HA       LEU  61   3.175  -8.728  -7.264
  489    HB2  LEU  61           HB2      LEU  61   0.776  -9.145  -6.310
  490    HB3  LEU  61           HB1      LEU  61   2.108 -10.184  -5.849
  491    HG   LEU  61           HG       LEU  61   2.354  -8.907  -3.741
  492   HD11  LEU  61          HD11      LEU  61   0.643  -7.338  -3.057
  493   HD12  LEU  61          HD12      LEU  61  -0.170  -7.514  -4.610
  494   HD13  LEU  61          HD13      LEU  61   1.429  -6.778  -4.532
  495   HD21  LEU  61          HD21      LEU  61   1.018 -10.945  -3.800
  496   HD22  LEU  61          HD22      LEU  61  -0.408 -10.006  -4.241
  497   HD23  LEU  61          HD23      LEU  61   0.344  -9.777  -2.662
  498    H    TYR  62           HN       TYR  62   3.643  -5.863  -6.867
  499    HA   TYR  62           HA       TYR  62   1.226  -4.396  -7.049
  500    HB2  TYR  62           HB2      TYR  62   3.275  -3.262  -6.573
  501    HB3  TYR  62           HB1      TYR  62   4.013  -3.833  -8.064
  502    HD1  TYR  62           HD1      TYR  62   1.289  -1.659  -6.771
  503    HD2  TYR  62           HD2      TYR  62   3.911  -2.531 -10.004
  504    HE1  TYR  62           HE1      TYR  62   0.566   0.395  -7.906
  505    HE2  TYR  62           HE2      TYR  62   3.197  -0.475 -11.148
  506    HH   TYR  62           HH       TYR  62   1.494   1.982  -9.634
  507    H    ASN  63           HN       ASN  63   2.680  -6.508  -9.351
  508    HA   ASN  63           HA       ASN  63   1.815  -5.215 -11.747
  509    HB2  ASN  63           HB2      ASN  63   2.453  -8.108 -11.163
  510    HB3  ASN  63           HB1      ASN  63   2.146  -7.475 -12.778
  511   HD21  ASN  63          HD21      ASN  63   4.353  -7.612 -10.082
  512   HD22  ASN  63          HD22      ASN  63   5.747  -6.867 -10.940
  513    H    GLN  64           HN       GLN  64   0.446  -8.235 -10.313
  514    HA   GLN  64           HA       GLN  64  -2.046  -7.633 -11.773
  515    HB2  GLN  64           HB2      GLN  64  -2.683  -9.955 -11.255
  516    HB3  GLN  64           HB1      GLN  64  -1.138  -9.850 -12.085
  517    HG2  GLN  64           HG2      GLN  64   0.033 -10.158  -9.969
  518    HG3  GLN  64           HG1      GLN  64  -1.510 -10.244  -9.123
  519   HE21  GLN  64          HE21      GLN  64  -1.099 -12.299  -8.317
  520   HE22  GLN  64          HE22      GLN  64  -1.139 -13.745  -9.385
  521    H    ALA  65           HN       ALA  65  -0.912  -6.959  -8.657
  522    HA   ALA  65           HA       ALA  65  -3.356  -7.707  -7.254
  523    HB1  ALA  65           HB1      ALA  65  -1.122  -5.878  -6.395
  524    HB2  ALA  65           HB2      ALA  65  -1.198  -7.617  -6.111
  525    HB3  ALA  65           HB3      ALA  65  -2.384  -6.549  -5.362
  526    H    ARG  66           HN       ARG  66  -1.941  -4.690  -8.528
  527    HA   ARG  66           HA       ARG  66  -4.012  -2.979  -7.555
  528    HB2  ARG  66           HB2      ARG  66  -1.774  -2.217  -8.289
  529    HB3  ARG  66           HB1      ARG  66  -2.210  -2.593  -9.949
  530    HG2  ARG  66           HG2      ARG  66  -3.922  -0.903  -9.938
  531    HG3  ARG  66           HG1      ARG  66  -3.651  -0.591  -8.223
  532    HD2  ARG  66           HD2      ARG  66  -2.588   1.085  -9.706
  533    HD3  ARG  66           HD1      ARG  66  -1.442   0.242  -8.668
  534    HE   ARG  66           HE       ARG  66  -0.537  -0.876 -10.527
  535   HH11  ARG  66          HH11      ARG  66  -3.246   1.216 -11.452
  536   HH12  ARG  66          HH12      ARG  66  -2.858   1.168 -13.137
  537   HH21  ARG  66          HH21      ARG  66  -0.071  -0.912 -12.750
  538   HH22  ARG  66          HH22      ARG  66  -1.058  -0.043 -13.876
  539    H    VAL  67           HN       VAL  67  -3.807  -5.067 -10.365
  540    HA   VAL  67           HA       VAL  67  -6.111  -3.748 -11.638
  541    HB   VAL  67           HB       VAL  67  -4.233  -4.592 -13.015
  542   HG11  VAL  67          HG11      VAL  67  -3.695  -6.594 -11.720
  543   HG12  VAL  67          HG12      VAL  67  -3.979  -6.980 -13.417
  544   HG13  VAL  67          HG13      VAL  67  -5.222  -7.325 -12.215
  545   HG21  VAL  67          HG21      VAL  67  -6.470  -4.282 -13.968
  546   HG22  VAL  67          HG22      VAL  67  -6.863  -5.956 -13.575
  547   HG23  VAL  67          HG23      VAL  67  -5.597  -5.599 -14.750
  548    H    LYS  68           HN       LYS  68  -5.375  -6.664  -9.773
  549    HA   LYS  68           HA       LYS  68  -7.893  -7.959 -10.333
  550    HB2  LYS  68           HB2      LYS  68  -5.684  -8.383  -8.363
  551    HB3  LYS  68           HB1      LYS  68  -7.207  -9.234  -8.152
  552    HG2  LYS  68           HG2      LYS  68  -6.977 -10.191 -10.393
  553    HG3  LYS  68           HG1      LYS  68  -5.439  -9.349 -10.588
  554    HD2  LYS  68           HD2      LYS  68  -4.506 -10.587  -8.710
  555    HD3  LYS  68           HD1      LYS  68  -6.055 -11.397  -8.458
  556    HE2  LYS  68           HE2      LYS  68  -5.868 -12.343 -10.748
  557    HE3  LYS  68           HE1      LYS  68  -4.265 -11.621 -10.876
  558    HZ1  LYS  68           HZ1      LYS  68  -3.612 -12.942  -8.914
  559    HZ2  LYS  68           HZ2      LYS  68  -4.050 -13.901 -10.235
  560    HZ3  LYS  68           HZ3      LYS  68  -5.122 -13.705  -8.942
  561    H    TYR  69           HN       TYR  69  -7.099  -5.285  -8.346
  562    HA   TYR  69           HA       TYR  69  -9.759  -5.542  -7.056
  563    HB2  TYR  69           HB2      TYR  69  -7.167  -4.926  -5.633
  564    HB3  TYR  69           HB1      TYR  69  -8.756  -4.655  -4.929
  565    HD1  TYR  69           HD1      TYR  69  -6.344  -7.202  -6.011
  566    HD2  TYR  69           HD2      TYR  69 -10.115  -6.499  -4.173
  567    HE1  TYR  69           HE1      TYR  69  -6.398  -9.535  -5.243
  568    HE2  TYR  69           HE2      TYR  69 -10.179  -8.829  -3.399
  569    HH   TYR  69           HH       TYR  69  -7.496 -10.853  -3.414
  570    H    SER  70           HN       SER  70 -10.574  -3.502  -6.134
  571    HA   SER  70           HA       SER  70 -10.185  -1.376  -8.049
  572    HB2  SER  70           HB2      SER  70 -12.370  -1.856  -6.984
  573    HB3  SER  70           HB1      SER  70 -11.713  -1.329  -5.435
  574    HG   SER  70           HG       SER  70 -11.935   0.680  -6.033
  575    H    LEU  71           HN       LEU  71  -8.077  -0.668  -7.973
  576    HA   LEU  71           HA       LEU  71  -7.368   0.818  -5.483
  577    HB2  LEU  71           HB2      LEU  71  -5.629  -0.767  -7.359
  578    HB3  LEU  71           HB1      LEU  71  -4.959   0.475  -6.320
  579    HG   LEU  71           HG       LEU  71  -5.979  -0.800  -4.369
  580   HD11  LEU  71          HD11      LEU  71  -6.301  -3.233  -4.795
  581   HD12  LEU  71          HD12      LEU  71  -6.282  -2.879  -6.524
  582   HD13  LEU  71          HD13      LEU  71  -7.545  -2.201  -5.497
  583   HD21  LEU  71          HD21      LEU  71  -4.131  -2.460  -4.351
  584   HD22  LEU  71          HD22      LEU  71  -3.616  -0.819  -4.740
  585   HD23  LEU  71          HD23      LEU  71  -3.777  -2.018  -6.023
  586    H    LEU  72           HN       LEU  72  -5.991   0.705  -8.788
  587    HA   LEU  72           HA       LEU  72  -6.567   3.627  -8.978
  588    HB2  LEU  72           HB2      LEU  72  -4.158   2.044  -9.832
  589    HB3  LEU  72           HB1      LEU  72  -4.536   3.584 -10.577
  590    HG   LEU  72           HG       LEU  72  -2.864   3.878  -8.848
  591   HD11  LEU  72          HD11      LEU  72  -5.516   4.982  -7.936
  592   HD12  LEU  72          HD12      LEU  72  -4.511   5.667  -9.215
  593   HD13  LEU  72          HD13      LEU  72  -3.918   5.624  -7.554
  594   HD21  LEU  72          HD21      LEU  72  -4.889   2.874  -6.859
  595   HD22  LEU  72          HD22      LEU  72  -3.219   3.344  -6.554
  596   HD23  LEU  72          HD23      LEU  72  -3.568   1.895  -7.494
  597    H    GLU  73           HN       GLU  73  -8.597   3.111  -9.930
  598    HA   GLU  73           HA       GLU  73  -8.370   2.819 -12.823
  599    HB2  GLU  73           HB2      GLU  73 -10.378   0.997 -12.466
  600    HB3  GLU  73           HB1      GLU  73  -8.711   0.597 -12.846
  601    HG2  GLU  73           HG2      GLU  73  -9.413  -0.801 -11.060
  602    HG3  GLU  73           HG1      GLU  73  -8.273   0.369 -10.406
  Start of MODEL    6
    1    H1   SER   1           HT1      SER   1   0.383  16.388  10.513
    2    H2   SER   1           HT2      SER   1   0.741  16.771   8.904
    3    H3   SER   1           HT3      SER   1   1.855  15.903   9.835
    4    HA   SER   1           HA       SER   1   0.362  14.042   9.990
    5    HB2  SER   1           HB2      SER   1  -1.705  14.043   8.589
    6    HB3  SER   1           HB1      SER   1  -1.760  15.216   9.902
    7    HG   SER   1           HG       SER   1  -2.291  16.510   8.314
    8    H    ASP   2           HN       ASP   2   1.757  12.751   9.007
    9    HA   ASP   2           HA       ASP   2   2.097  13.100   6.064
   10    HB2  ASP   2           HB2      ASP   2   4.096  12.326   8.176
   11    HB3  ASP   2           HB1      ASP   2   4.358  11.962   6.474
   12    H    VAL   3           HN       VAL   3   3.117  10.973   5.111
   13    HA   VAL   3           HA       VAL   3   1.097   8.955   5.420
   14    HB   VAL   3           HB       VAL   3   2.350   9.419   3.307
   15   HG11  VAL   3          HG11      VAL   3   4.598   9.581   4.322
   16   HG12  VAL   3          HG12      VAL   3   4.537   8.474   2.950
   17   HG13  VAL   3          HG13      VAL   3   4.569   7.838   4.595
   18   HG21  VAL   3          HG21      VAL   3   1.026   7.398   3.552
   19   HG22  VAL   3          HG22      VAL   3   2.395   6.567   4.290
   20   HG23  VAL   3          HG23      VAL   3   2.474   7.071   2.602
   21    H    TRP   4           HN       TRP   4   4.373   9.370   6.711
   22    HA   TRP   4           HA       TRP   4   4.460   6.647   7.745
   23    HB2  TRP   4           HB2      TRP   4   6.375   8.558   7.189
   24    HB3  TRP   4           HB1      TRP   4   6.319   8.565   8.947
   25    HD1  TRP   4           HD1      TRP   4   6.078   5.600   9.698
   26    HE1  TRP   4           HE1      TRP   4   7.930   3.867   9.152
   27    HE3  TRP   4           HE3      TRP   4   8.364   8.120   5.880
   28    HZ2  TRP   4           HZ2      TRP   4  10.070   3.661   7.315
   29    HZ3  TRP   4           HZ3      TRP   4  10.308   7.086   4.783
   30    HH2  TRP   4           HH2      TRP   4  11.142   4.903   5.487
   31    H    SER   5           HN       SER   5   3.900   9.927   9.050
   32    HA   SER   5           HA       SER   5   3.668   9.183  11.778
   33    HB2  SER   5           HB2      SER   5   3.801  11.525  11.045
   34    HB3  SER   5           HB1      SER   5   2.223  11.384  10.273
   35    HG   SER   5           HG       SER   5   2.878  11.607  12.966
   36    H    LEU   6           HN       LEU   6   1.144   9.590   9.266
   37    HA   LEU   6           HA       LEU   6  -0.784   8.183  11.013
   38    HB2  LEU   6           HB2      LEU   6  -1.145   9.573   8.354
   39    HB3  LEU   6           HB1      LEU   6  -2.436   8.833   9.281
   40    HG   LEU   6           HG       LEU   6  -0.756  11.150  10.247
   41   HD11  LEU   6          HD11      LEU   6  -3.578  11.160   9.186
   42   HD12  LEU   6          HD12      LEU   6  -2.160  11.736   8.306
   43   HD13  LEU   6          HD13      LEU   6  -2.669  12.547   9.789
   44   HD21  LEU   6          HD21      LEU   6  -1.666   9.776  12.050
   45   HD22  LEU   6          HD22      LEU   6  -3.278   9.911  11.347
   46   HD23  LEU   6          HD23      LEU   6  -2.470  11.344  11.981
   47    H    SER   7           HN       SER   7   0.087   6.097  10.936
   48    HA   SER   7           HA       SER   7  -0.218   4.763   8.277
   49    HB2  SER   7           HB2      SER   7   1.714   4.163  10.525
   50    HB3  SER   7           HB1      SER   7   1.471   3.114   9.129
   51    HG   SER   7           HG       SER   7   2.488   4.513   7.877
   52    H    LYS   8           HN       LYS   8  -1.992   5.192  10.865
   53    HA   LYS   8           HA       LYS   8  -2.651   2.324  11.264
   54    HB2  LYS   8           HB2      LYS   8  -3.527   4.777  12.800
   55    HB3  LYS   8           HB1      LYS   8  -3.951   3.120  13.202
   56    HG2  LYS   8           HG2      LYS   8  -1.113   4.104  13.085
   57    HG3  LYS   8           HG1      LYS   8  -2.092   4.139  14.551
   58    HD2  LYS   8           HD2      LYS   8  -2.357   1.729  14.465
   59    HD3  LYS   8           HD1      LYS   8  -1.469   1.662  12.941
   60    HE2  LYS   8           HE2      LYS   8   0.542   2.420  14.022
   61    HE3  LYS   8           HE1      LYS   8  -0.324   2.693  15.533
   62    HZ1  LYS   8           HZ1      LYS   8   0.924   0.627  15.584
   63    HZ2  LYS   8           HZ2      LYS   8   0.084   0.055  14.230
   64    HZ3  LYS   8           HZ3      LYS   8  -0.738   0.320  15.686
   65    H    THR   9           HN       THR   9  -3.375   4.109   8.870
   66    HA   THR   9           HA       THR   9  -6.337   3.818   9.086
   67    HB   THR   9           HB       THR   9  -6.485   5.464   7.238
   68    HG1  THR   9           HG1      THR   9  -3.706   5.924   7.678
   69   HG21  THR   9          HG21      THR   9  -5.833   7.450   8.565
   70   HG22  THR   9          HG22      THR   9  -4.968   6.391   9.680
   71   HG23  THR   9          HG23      THR   9  -6.720   6.258   9.514
   72    H    SER  10           HN       SER  10  -7.101   2.068   8.112
   73    HA   SER  10           HA       SER  10  -5.593   0.969   5.801
   74    HB2  SER  10           HB2      SER  10  -6.965  -1.067   6.171
   75    HB3  SER  10           HB1      SER  10  -6.053  -0.606   7.606
   76    HG   SER  10           HG       SER  10  -8.139  -1.061   8.234
   77    H    MET  11           HN       MET  11  -6.978  -0.127   4.088
   78    HA   MET  11           HA       MET  11  -9.444   1.436   3.532
   79    HB2  MET  11           HB2      MET  11  -7.471   2.452   2.329
   80    HB3  MET  11           HB1      MET  11  -7.307   0.936   1.452
   81    HG2  MET  11           HG2      MET  11  -8.478   2.516   0.089
   82    HG3  MET  11           HG1      MET  11  -9.590   1.236   0.570
   83    HE1  MET  11           HE1      MET  11 -10.483   4.052  -0.651
   84    HE2  MET  11           HE2      MET  11 -11.852   4.457   0.383
   85    HE3  MET  11           HE3      MET  11 -11.641   2.803  -0.193
   86    H    THR  12           HN       THR  12 -11.044   0.341   2.460
   87    HA   THR  12           HA       THR  12 -10.639  -2.574   2.343
   88    HB   THR  12           HB       THR  12 -13.163  -0.957   1.939
   89    HG1  THR  12           HG1      THR  12 -12.838  -0.761   4.053
   90   HG21  THR  12          HG21      THR  12 -13.319  -3.131   0.861
   91   HG22  THR  12          HG22      THR  12 -14.307  -3.114   2.321
   92   HG23  THR  12          HG23      THR  12 -12.740  -3.924   2.327
   93    H    PHE  13           HN       PHE  13 -10.042  -3.582   0.571
   94    HA   PHE  13           HA       PHE  13 -10.492  -2.284  -2.051
   95    HB2  PHE  13           HB2      PHE  13  -8.733  -4.526  -1.095
   96    HB3  PHE  13           HB1      PHE  13  -9.043  -4.288  -2.808
   97    HD1  PHE  13           HD2      PHE  13  -9.122  -1.216  -2.670
   98    HD2  PHE  13           HD1      PHE  13  -6.403  -4.119  -1.157
   99    HE1  PHE  13           HE2      PHE  13  -7.307   0.441  -2.766
  100    HE2  PHE  13           HE1      PHE  13  -4.586  -2.470  -1.252
  101    HZ   PHE  13           HZ       PHE  13  -5.034  -0.186  -2.058
  102    H    GLN  14           HN       GLN  14 -11.514  -3.286  -3.782
  103    HA   GLN  14           HA       GLN  14 -13.288  -5.535  -2.957
  104    HB2  GLN  14           HB2      GLN  14 -14.531  -3.439  -3.254
  105    HB3  GLN  14           HB1      GLN  14 -13.889  -3.284  -4.883
  106    HG2  GLN  14           HG2      GLN  14 -14.979  -5.624  -5.236
  107    HG3  GLN  14           HG1      GLN  14 -15.934  -5.176  -3.823
  108   HE21  GLN  14          HE21      GLN  14 -15.187  -4.477  -7.165
  109   HE22  GLN  14          HE22      GLN  14 -16.603  -3.408  -7.455
  110    HA   PRO  15           HA       PRO  15 -10.968  -7.671  -6.179
  111    HB2  PRO  15           HB2      PRO  15 -13.083  -9.684  -5.708
  112    HB3  PRO  15           HB1      PRO  15 -11.326  -9.857  -5.657
  113    HG2  PRO  15           HG2      PRO  15 -12.770  -9.856  -3.415
  114    HG3  PRO  15           HG1      PRO  15 -11.176  -9.084  -3.484
  115    HD2  PRO  15           HD2      PRO  15 -13.892  -7.839  -3.553
  116    HD3  PRO  15           HD1      PRO  15 -12.418  -7.280  -2.735
  117    H    LYS  16           HN       LYS  16 -11.245  -8.121  -8.340
  118    HA   LYS  16           HA       LYS  16 -13.521  -6.850  -9.588
  119    HB2  LYS  16           HB2      LYS  16 -11.305  -8.553 -10.743
  120    HB3  LYS  16           HB1      LYS  16 -12.478  -7.660 -11.700
  121    HG2  LYS  16           HG2      LYS  16 -10.630  -6.355  -9.721
  122    HG3  LYS  16           HG1      LYS  16 -10.232  -6.574 -11.425
  123    HD2  LYS  16           HD2      LYS  16 -12.067  -5.195 -12.100
  124    HD3  LYS  16           HD1      LYS  16 -12.694  -5.133 -10.450
  125    HE2  LYS  16           HE2      LYS  16 -10.703  -3.921  -9.734
  126    HE3  LYS  16           HE1      LYS  16 -10.052  -4.002 -11.367
  127    HZ1  LYS  16           HZ1      LYS  16 -12.545  -2.602 -10.562
  128    HZ2  LYS  16           HZ2      LYS  16 -11.934  -2.687 -12.136
  129    HZ3  LYS  16           HZ3      LYS  16 -11.070  -1.861 -10.937
  130    H    LYS  17           HN       LYS  17 -12.519 -10.189  -8.946
  131    HA   LYS  17           HA       LYS  17 -15.158 -11.077 -10.012
  132    HB2  LYS  17           HB2      LYS  17 -14.111 -13.294 -10.377
  133    HB3  LYS  17           HB1      LYS  17 -13.376 -12.023 -11.340
  134    HG2  LYS  17           HG2      LYS  17 -12.145 -12.678  -8.716
  135    HG3  LYS  17           HG1      LYS  17 -11.932 -13.813 -10.048
  136    HD2  LYS  17           HD2      LYS  17 -11.300 -10.869 -10.231
  137    HD3  LYS  17           HD1      LYS  17 -10.113 -12.106  -9.822
  138    HE2  LYS  17           HE2      LYS  17 -11.739 -12.084 -12.360
  139    HE3  LYS  17           HE1      LYS  17 -10.108 -11.430 -12.222
  140    HZ1  LYS  17           HZ1      LYS  17  -9.331 -13.638 -11.578
  141    HZ2  LYS  17           HZ2      LYS  17 -10.061 -13.664 -13.103
  142    HZ3  LYS  17           HZ3      LYS  17 -10.896 -14.257 -11.758
  143    H    ALA  18           HN       ALA  18 -16.142 -12.945  -8.960
  144    HA   ALA  18           HA       ALA  18 -16.298 -12.558  -6.137
  145    HB1  ALA  18           HB1      ALA  18 -17.260 -14.885  -7.796
  146    HB2  ALA  18           HB2      ALA  18 -18.158 -13.403  -7.466
  147    HB3  ALA  18           HB3      ALA  18 -17.768 -14.509  -6.149
  148    H    SER  19           HN       SER  19 -14.384 -14.752  -8.127
  149    HA   SER  19           HA       SER  19 -13.714 -16.685  -6.193
  150    HB2  SER  19           HB2      SER  19 -13.151 -16.820  -8.613
  151    HB3  SER  19           HB1      SER  19 -11.905 -15.596  -8.365
  152    HG   SER  19           HG       SER  19 -10.950 -17.611  -8.244
  153    H    LEU  20           HN       LEU  20 -12.216 -13.515  -6.858
  154    HA   LEU  20           HA       LEU  20 -10.119 -13.871  -4.910
  155    HB2  LEU  20           HB2      LEU  20 -11.235 -11.437  -6.282
  156    HB3  LEU  20           HB1      LEU  20  -9.868 -11.378  -5.195
  157    HG   LEU  20           HG       LEU  20  -9.961 -12.957  -7.766
  158   HD11  LEU  20          HD11      LEU  20  -8.561 -10.361  -7.137
  159   HD12  LEU  20          HD12      LEU  20  -9.994 -10.537  -8.151
  160   HD13  LEU  20          HD13      LEU  20  -8.465 -11.259  -8.652
  161   HD21  LEU  20          HD21      LEU  20  -8.480 -13.864  -5.976
  162   HD22  LEU  20          HD22      LEU  20  -7.611 -12.328  -5.984
  163   HD23  LEU  20          HD23      LEU  20  -7.621 -13.343  -7.425
  164    H    GLN  21           HN       GLN  21  -9.794 -12.471  -3.020
  165    HA   GLN  21           HA       GLN  21 -12.372 -12.012  -1.589
  166    HB2  GLN  21           HB2      GLN  21  -9.733 -12.914  -0.419
  167    HB3  GLN  21           HB1      GLN  21 -11.207 -12.612   0.489
  168    HG2  GLN  21           HG2      GLN  21 -11.404 -14.849   0.302
  169    HG3  GLN  21           HG1      GLN  21 -12.157 -14.411  -1.230
  170   HE21  GLN  21          HE21      GLN  21 -10.812 -16.887  -0.429
  171   HE22  GLN  21          HE22      GLN  21  -9.469 -17.101  -1.604
  172    HA   PRO  22           HA       PRO  22 -11.259  -7.716  -1.342
  173    HB2  PRO  22           HB2      PRO  22 -12.637  -7.919   1.297
  174    HB3  PRO  22           HB1      PRO  22 -12.884  -6.762  -0.017
  175    HG2  PRO  22           HG2      PRO  22 -14.619  -8.731   0.365
  176    HG3  PRO  22           HG1      PRO  22 -14.141  -8.259  -1.276
  177    HD2  PRO  22           HD2      PRO  22 -13.294 -10.625   0.341
  178    HD3  PRO  22           HD1      PRO  22 -13.612 -10.502  -1.402
  179    H    LEU  23           HN       LEU  23  -9.889  -6.290  -0.245
  180    HA   LEU  23           HA       LEU  23  -8.253  -7.569   1.904
  181    HB2  LEU  23           HB2      LEU  23  -7.112  -7.373  -0.301
  182    HB3  LEU  23           HB1      LEU  23  -7.306  -5.636  -0.211
  183    HG   LEU  23           HG       LEU  23  -5.868  -7.042   2.002
  184   HD11  LEU  23          HD11      LEU  23  -4.675  -6.342  -0.677
  185   HD12  LEU  23          HD12      LEU  23  -4.838  -7.958   0.014
  186   HD13  LEU  23          HD13      LEU  23  -3.756  -6.783   0.763
  187   HD21  LEU  23          HD21      LEU  23  -6.305  -4.700   2.303
  188   HD22  LEU  23          HD22      LEU  23  -5.667  -4.328   0.703
  189   HD23  LEU  23          HD23      LEU  23  -4.586  -4.906   1.970
  190    H    THR  24           HN       THR  24  -7.827  -6.414   3.732
  191    HA   THR  24           HA       THR  24  -8.425  -3.528   3.691
  192    HB   THR  24           HB       THR  24  -9.710  -5.334   5.743
  193    HG1  THR  24           HG1      THR  24 -11.118  -5.598   4.168
  194   HG21  THR  24          HG21      THR  24  -9.211  -3.124   6.618
  195   HG22  THR  24          HG22      THR  24 -10.948  -3.283   6.359
  196   HG23  THR  24          HG23      THR  24  -9.966  -2.370   5.215
  197    H    ILE  25           HN       ILE  25  -6.167  -3.235   3.956
  198    HA   ILE  25           HA       ILE  25  -5.311  -3.706   6.763
  199    HB   ILE  25           HB       ILE  25  -4.368  -5.463   5.173
  200   HG12  ILE  25          HG12      ILE  25  -2.080  -5.312   6.178
  201   HG13  ILE  25          HG11      ILE  25  -2.492  -3.713   6.779
  202   HG21  ILE  25          HG21      ILE  25  -2.566  -3.223   4.290
  203   HG22  ILE  25          HG22      ILE  25  -3.926  -3.822   3.340
  204   HG23  ILE  25          HG23      ILE  25  -2.579  -4.894   3.723
  205   HD11  ILE  25          HD11      ILE  25  -3.974  -6.232   7.490
  206   HD12  ILE  25          HD12      ILE  25  -4.201  -4.629   8.190
  207   HD13  ILE  25          HD13      ILE  25  -2.696  -5.507   8.465
  208    H    SER  26           HN       SER  26  -3.521  -2.346   7.478
  209    HA   SER  26           HA       SER  26  -3.540   0.241   5.998
  210    HB2  SER  26           HB2      SER  26  -4.573   0.321   8.227
  211    HB3  SER  26           HB1      SER  26  -3.081  -0.290   8.940
  212    HG   SER  26           HG       SER  26  -2.399   1.682   8.969
  213    H    LEU  27           HN       LEU  27  -1.601   1.659   6.593
  214    HA   LEU  27           HA       LEU  27   0.759   0.624   5.469
  215    HB2  LEU  27           HB2      LEU  27   0.537   2.881   7.440
  216    HB3  LEU  27           HB1      LEU  27   1.848   2.610   6.308
  217    HG   LEU  27           HG       LEU  27  -0.992   3.379   5.634
  218   HD11  LEU  27          HD11      LEU  27   0.042   5.407   4.758
  219   HD12  LEU  27          HD12      LEU  27   1.625   4.829   5.277
  220   HD13  LEU  27          HD13      LEU  27   0.387   5.203   6.475
  221   HD21  LEU  27          HD21      LEU  27  -0.250   3.432   3.302
  222   HD22  LEU  27          HD22      LEU  27  -0.155   1.805   3.977
  223   HD23  LEU  27          HD23      LEU  27   1.311   2.767   3.785
  224    H    ASP  28           HN       ASP  28   0.293   1.434   8.926
  225    HA   ASP  28           HA       ASP  28   2.751   0.227   9.748
  226    HB2  ASP  28           HB2      ASP  28   1.474   1.950  11.028
  227    HB3  ASP  28           HB1      ASP  28   0.277   0.719  11.420
  228    H    GLU  29           HN       GLU  29  -0.540  -0.999   9.400
  229    HA   GLU  29           HA       GLU  29   0.016  -3.480  10.797
  230    HB2  GLU  29           HB2      GLU  29  -2.272  -2.454   9.143
  231    HB3  GLU  29           HB1      GLU  29  -2.223  -4.122   9.693
  232    HG2  GLU  29           HG2      GLU  29  -3.562  -2.716  11.161
  233    HG3  GLU  29           HG1      GLU  29  -2.170  -3.395  12.000
  234    H    LEU  30           HN       LEU  30   1.010  -2.396   7.755
  235    HA   LEU  30           HA       LEU  30   1.217  -5.231   6.877
  236    HB2  LEU  30           HB2      LEU  30  -0.531  -3.916   5.621
  237    HB3  LEU  30           HB1      LEU  30   0.766  -2.912   5.001
  238    HG   LEU  30           HG       LEU  30   1.781  -4.983   3.997
  239   HD11  LEU  30          HD11      LEU  30  -0.870  -6.188   4.772
  240   HD12  LEU  30          HD12      LEU  30   0.709  -6.636   5.418
  241   HD13  LEU  30          HD13      LEU  30   0.332  -6.935   3.722
  242   HD21  LEU  30          HD21      LEU  30   0.347  -4.984   2.087
  243   HD22  LEU  30          HD22      LEU  30   0.380  -3.347   2.744
  244   HD23  LEU  30          HD23      LEU  30  -1.010  -4.390   3.040
  245    H    PHE  31           HN       PHE  31   3.065  -2.937   8.072
  246    HA   PHE  31           HA       PHE  31   5.249  -3.702   6.253
  247    HB2  PHE  31           HB2      PHE  31   4.924  -0.885   7.326
  248    HB3  PHE  31           HB1      PHE  31   6.293  -1.449   6.376
  249    HD1  PHE  31           HD1      PHE  31   5.061  -2.948   4.221
  250    HD2  PHE  31           HD2      PHE  31   3.796   0.669   6.068
  251    HE1  PHE  31           HE1      PHE  31   3.885  -2.310   2.158
  252    HE2  PHE  31           HE2      PHE  31   2.617   1.311   4.010
  253    HZ   PHE  31           HZ       PHE  31   2.658  -0.180   2.052
  254    H    SER  32           HN       SER  32   7.236  -4.172   7.177
  255    HA   SER  32           HA       SER  32   7.389  -3.806  10.123
  256    HB2  SER  32           HB2      SER  32   8.072  -6.319   8.604
  257    HB3  SER  32           HB1      SER  32   8.327  -6.072  10.331
  258    HG   SER  32           HG       SER  32   6.363  -7.172   9.883
  259    H    SER  33           HN       SER  33   8.643  -2.261   7.939
  260    HA   SER  33           HA       SER  33  11.365  -2.318   8.889
  261    HB2  SER  33           HB2      SER  33  11.603  -4.197   7.379
  262    HB3  SER  33           HB1      SER  33  10.844  -3.285   6.075
  263    HG   SER  33           HG       SER  33  13.371  -2.864   7.276
  264    H    ARG  34           HN       ARG  34  12.313  -0.407   8.741
  265    HA   ARG  34           HA       ARG  34  10.833   1.836   7.827
  266    HB2  ARG  34           HB2      ARG  34  12.760   1.706   9.526
  267    HB3  ARG  34           HB1      ARG  34  13.831   1.781   8.138
  268    HG2  ARG  34           HG2      ARG  34  11.729   3.865   8.630
  269    HG3  ARG  34           HG1      ARG  34  13.332   3.952   9.361
  270    HD2  ARG  34           HD2      ARG  34  14.318   3.819   7.088
  271    HD3  ARG  34           HD1      ARG  34  12.690   3.882   6.417
  272    HE   ARG  34           HE       ARG  34  13.010   6.093   8.153
  273   HH11  ARG  34          HH11      ARG  34  14.253   4.889   5.066
  274   HH12  ARG  34          HH12      ARG  34  14.567   6.470   4.438
  275   HH21  ARG  34          HH21      ARG  34  13.440   8.158   7.286
  276   HH22  ARG  34          HH22      ARG  34  14.106   8.325   5.697
  277    H    GLY  35           HN       GLY  35  13.738   0.255   6.418
  278    HA2  GLY  35           HA2      GLY  35  13.834   1.883   4.084
  279    HA3  GLY  35           HA1      GLY  35  14.537   0.284   4.249
  280    H    GLU  36           HN       GLU  36  12.041  -1.096   4.807
  281    HA   GLU  36           HA       GLU  36  11.244  -1.699   2.156
  282    HB2  GLU  36           HB2      GLU  36  10.929  -3.223   4.067
  283    HB3  GLU  36           HB1      GLU  36   9.716  -2.139   4.732
  284    HG2  GLU  36           HG2      GLU  36   8.716  -4.061   3.616
  285    HG3  GLU  36           HG1      GLU  36   8.266  -2.545   2.838
  286    H    PHE  37           HN       PHE  37   9.843   0.460   4.613
  287    HA   PHE  37           HA       PHE  37   7.485   1.184   3.248
  288    HB2  PHE  37           HB2      PHE  37   8.166   1.790   5.612
  289    HB3  PHE  37           HB1      PHE  37   9.182   3.048   4.921
  290    HD1  PHE  37           HD1      PHE  37   8.204   5.026   3.920
  291    HD2  PHE  37           HD2      PHE  37   5.762   1.985   5.620
  292    HE1  PHE  37           HE1      PHE  37   6.291   6.570   3.925
  293    HE2  PHE  37           HE2      PHE  37   3.842   3.521   5.624
  294    HZ   PHE  37           HZ       PHE  37   4.105   5.819   4.776
  295    H    ILE  38           HN       ILE  38  10.788   2.536   3.046
  296    HA   ILE  38           HA       ILE  38  10.289   4.630   1.262
  297    HB   ILE  38           HB       ILE  38  12.723   2.843   1.403
  298   HG12  ILE  38          HG12      ILE  38  12.263   3.892   3.537
  299   HG13  ILE  38          HG11      ILE  38  13.638   4.701   2.791
  300   HG21  ILE  38          HG21      ILE  38  13.908   4.806   0.425
  301   HG22  ILE  38          HG22      ILE  38  12.334   5.539   0.113
  302   HG23  ILE  38          HG23      ILE  38  12.776   4.026  -0.679
  303   HD11  ILE  38          HD11      ILE  38  12.171   6.317   3.812
  304   HD12  ILE  38          HD12      ILE  38  10.802   5.708   2.883
  305   HD13  ILE  38          HD13      ILE  38  12.139   6.510   2.060
  306    H    SER  39           HN       SER  39  11.246   1.237   0.441
  307    HA   SER  39           HA       SER  39  11.196   1.603  -2.361
  308    HB2  SER  39           HB2      SER  39  10.475  -0.929  -0.817
  309    HB3  SER  39           HB1      SER  39  10.943  -0.856  -2.516
  310    HG   SER  39           HG       SER  39  12.496  -0.736  -0.250
  311    H    VAL  40           HN       VAL  40   8.623  -0.083  -0.445
  312    HA   VAL  40           HA       VAL  40   6.682  -0.393  -2.229
  313    HB   VAL  40           HB       VAL  40   4.958   0.079  -0.504
  314   HG11  VAL  40          HG11      VAL  40   6.117  -2.078  -0.644
  315   HG12  VAL  40          HG12      VAL  40   5.678  -1.672   1.014
  316   HG13  VAL  40          HG13      VAL  40   7.345  -1.483   0.472
  317   HG21  VAL  40          HG21      VAL  40   6.117   2.002   0.549
  318   HG22  VAL  40          HG22      VAL  40   7.289   0.874   1.229
  319   HG23  VAL  40          HG23      VAL  40   5.595   0.778   1.705
  320    H    GLY  41           HN       GLY  41   7.475   2.913  -0.994
  321    HA2  GLY  41           HA2      GLY  41   7.005   4.548  -2.870
  322    HA3  GLY  41           HA1      GLY  41   5.376   3.890  -2.870
  323    H    GLY  42           HN       GLY  42   7.520   4.646  -0.099
  324    HA2  GLY  42           HA2      GLY  42   5.429   6.601   0.765
  325    HA3  GLY  42           HA1      GLY  42   6.255   5.529   1.873
  326    H    ASP  43           HN       ASP  43   6.384   8.456   0.037
  327    HA   ASP  43           HA       ASP  43   9.106   9.086   0.969
  328    HB2  ASP  43           HB2      ASP  43   7.069  10.656  -0.626
  329    HB3  ASP  43           HB1      ASP  43   8.640  11.303  -0.164
  330    H    GLY  44           HN       GLY  44   6.140  11.109   1.071
  331    HA2  GLY  44           HA2      GLY  44   6.192  11.162   3.999
  332    HA3  GLY  44           HA1      GLY  44   6.727  12.655   3.243
  333    H    ARG  45           HN       ARG  45   5.218  13.514   1.489
  334    HA   ARG  45           HA       ARG  45   2.557  13.648   2.703
  335    HB2  ARG  45           HB2      ARG  45   3.903  15.106   0.436
  336    HB3  ARG  45           HB1      ARG  45   2.190  15.306   0.774
  337    HG2  ARG  45           HG2      ARG  45   3.414  17.095   1.803
  338    HG3  ARG  45           HG1      ARG  45   2.758  16.043   3.057
  339    HD2  ARG  45           HD2      ARG  45   5.057  16.724   3.553
  340    HD3  ARG  45           HD1      ARG  45   4.919  14.981   3.341
  341    HE   ARG  45           HE       ARG  45   5.676  16.390   0.911
  342   HH11  ARG  45          HH11      ARG  45   6.866  14.909   3.900
  343   HH12  ARG  45          HH12      ARG  45   8.454  14.630   3.271
  344   HH21  ARG  45          HH21      ARG  45   7.785  15.999   0.124
  345   HH22  ARG  45          HH22      ARG  45   8.976  15.248   1.131
  346    H    MET  46           HN       MET  46   1.396  11.829   2.359
  347    HA   MET  46           HA       MET  46   1.279  10.741  -0.389
  348    HB2  MET  46           HB2      MET  46   1.554   9.345   1.768
  349    HB3  MET  46           HB1      MET  46  -0.163   9.634   2.007
  350    HG2  MET  46           HG2      MET  46   0.226   7.490   0.948
  351    HG3  MET  46           HG1      MET  46  -0.649   8.570  -0.127
  352    HE1  MET  46           HE1      MET  46   2.985   7.127   0.690
  353    HE2  MET  46           HE2      MET  46   3.123   8.886   0.701
  354    HE3  MET  46           HE3      MET  46   3.900   7.948  -0.575
  355    H    SER  47           HN       SER  47  -0.908  10.018  -1.205
  356    HA   SER  47           HA       SER  47  -2.718  12.325  -0.967
  357    HB2  SER  47           HB2      SER  47  -2.058  11.379  -3.192
  358    HB3  SER  47           HB1      SER  47  -2.951   9.914  -2.784
  359    HG   SER  47           HG       SER  47  -4.791  10.937  -3.075
  360    H    HIS  48           HN       HIS  48  -3.330   8.816  -1.238
  361    HA   HIS  48           HA       HIS  48  -4.810   8.363   1.129
  362    HB2  HIS  48           HB2      HIS  48  -6.369  10.083   0.412
  363    HB3  HIS  48           HB1      HIS  48  -6.480   9.350  -1.182
  364    HD1  HIS  48           HD1      HIS  48  -7.596   8.914   2.393
  365    HD2  HIS  48           HD2      HIS  48  -8.205   7.171  -1.371
  366    HE1  HIS  48           HE1      HIS  48  -9.563   7.329   2.644
  367    HE2  HIS  48           HE2      HIS  48  -9.973   6.323   0.346
  368    H    LYS  49           HN       LYS  49  -5.421   7.838  -2.377
  369    HA   LYS  49           HA       LYS  49  -5.787   4.999  -1.957
  370    HB2  LYS  49           HB2      LYS  49  -5.363   6.711  -4.410
  371    HB3  LYS  49           HB1      LYS  49  -5.619   4.978  -4.488
  372    HG2  LYS  49           HG2      LYS  49  -7.537   7.023  -3.391
  373    HG3  LYS  49           HG1      LYS  49  -7.687   6.152  -4.917
  374    HD2  LYS  49           HD2      LYS  49  -7.682   4.885  -2.176
  375    HD3  LYS  49           HD1      LYS  49  -9.119   5.207  -3.144
  376    HE2  LYS  49           HE2      LYS  49  -6.833   3.437  -4.003
  377    HE3  LYS  49           HE1      LYS  49  -8.329   2.856  -3.278
  378    HZ1  LYS  49           HZ1      LYS  49  -8.438   2.674  -5.662
  379    HZ2  LYS  49           HZ2      LYS  49  -8.079   4.316  -5.854
  380    HZ3  LYS  49           HZ3      LYS  49  -9.543   3.848  -5.147
  381    H    GLU  50           HN       GLU  50  -3.078   7.108  -2.639
  382    HA   GLU  50           HA       GLU  50  -1.278   5.189  -3.719
  383    HB2  GLU  50           HB2      GLU  50  -0.760   7.724  -2.159
  384    HB3  GLU  50           HB1      GLU  50   0.455   6.840  -3.066
  385    HG2  GLU  50           HG2      GLU  50  -2.000   8.151  -4.210
  386    HG3  GLU  50           HG1      GLU  50  -0.351   8.763  -4.303
  387    H    ALA  51           HN       ALA  51  -1.567   6.481  -0.375
  388    HA   ALA  51           HA       ALA  51   0.486   5.067   0.824
  389    HB1  ALA  51           HB1      ALA  51  -0.698   5.290   2.927
  390    HB2  ALA  51           HB2      ALA  51  -2.222   5.541   2.075
  391    HB3  ALA  51           HB3      ALA  51  -0.938   6.745   1.960
  392    H    ILE  52           HN       ILE  52  -2.922   3.829   0.644
  393    HA   ILE  52           HA       ILE  52  -2.223   1.369   1.832
  394    HB   ILE  52           HB       ILE  52  -4.436   1.870  -0.190
  395   HG12  ILE  52          HG12      ILE  52  -4.647   3.322   1.747
  396   HG13  ILE  52          HG11      ILE  52  -5.866   2.066   1.825
  397   HG21  ILE  52          HG21      ILE  52  -3.996  -0.418   1.719
  398   HG22  ILE  52          HG22      ILE  52  -4.059  -0.486  -0.042
  399   HG23  ILE  52          HG23      ILE  52  -5.514  -0.106   0.878
  400   HD11  ILE  52          HD11      ILE  52  -4.442   0.832   3.418
  401   HD12  ILE  52          HD12      ILE  52  -4.949   2.415   4.005
  402   HD13  ILE  52          HD13      ILE  52  -3.311   2.184   3.396
  403    H    LEU  53           HN       LEU  53  -2.266   2.331  -1.615
  404    HA   LEU  53           HA       LEU  53  -1.922  -0.229  -2.716
  405    HB2  LEU  53           HB2      LEU  53  -2.333   1.896  -3.977
  406    HB3  LEU  53           HB1      LEU  53  -0.678   2.401  -3.722
  407    HG   LEU  53           HG       LEU  53   0.059   0.382  -5.017
  408   HD11  LEU  53          HD11      LEU  53  -1.602  -0.709  -6.451
  409   HD12  LEU  53          HD12      LEU  53  -2.884   0.187  -5.637
  410   HD13  LEU  53          HD13      LEU  53  -1.923  -0.990  -4.740
  411   HD21  LEU  53          HD21      LEU  53  -0.610   1.344  -7.218
  412   HD22  LEU  53          HD22      LEU  53   0.042   2.525  -6.082
  413   HD23  LEU  53          HD23      LEU  53  -1.697   2.431  -6.354
  414    H    LEU  54           HN       LEU  54   0.541   1.789  -1.081
  415    HA   LEU  54           HA       LEU  54   2.950   0.746  -2.016
  416    HB2  LEU  54           HB2      LEU  54   1.929   1.608   0.699
  417    HB3  LEU  54           HB1      LEU  54   3.483   0.813   0.626
  418    HG   LEU  54           HG       LEU  54   4.301   2.532  -0.924
  419   HD11  LEU  54          HD11      LEU  54   2.263   3.152  -2.040
  420   HD12  LEU  54          HD12      LEU  54   2.946   4.576  -1.255
  421   HD13  LEU  54          HD13      LEU  54   1.573   3.743  -0.529
  422   HD21  LEU  54          HD21      LEU  54   4.393   4.366   0.683
  423   HD22  LEU  54          HD22      LEU  54   4.613   2.810   1.482
  424   HD23  LEU  54          HD23      LEU  54   3.064   3.645   1.590
  425    H    GLY  55           HN       GLY  55   0.536  -0.845   0.144
  426    HA2  GLY  55           HA2      GLY  55   1.983  -2.939   1.234
  427    HA3  GLY  55           HA1      GLY  55   0.310  -3.069   0.735
  428    H    LEU  56           HN       LEU  56   0.480  -2.941  -2.015
  429    HA   LEU  56           HA       LEU  56   0.965  -5.558  -2.765
  430    HB2  LEU  56           HB2      LEU  56   1.425  -3.206  -4.577
  431    HB3  LEU  56           HB1      LEU  56   0.991  -4.840  -5.044
  432    HG   LEU  56           HG       LEU  56  -0.741  -2.782  -3.694
  433   HD11  LEU  56          HD11      LEU  56  -0.770  -2.518  -6.028
  434   HD12  LEU  56          HD12      LEU  56  -2.230  -3.428  -5.644
  435   HD13  LEU  56          HD13      LEU  56  -0.823  -4.256  -6.308
  436   HD21  LEU  56          HD21      LEU  56  -1.196  -5.744  -3.964
  437   HD22  LEU  56          HD22      LEU  56  -2.498  -4.585  -3.700
  438   HD23  LEU  56          HD23      LEU  56  -1.224  -4.770  -2.495
  439    H    ARG  57           HN       ARG  57   3.290  -2.846  -3.153
  440    HA   ARG  57           HA       ARG  57   5.355  -4.493  -4.231
  441    HB2  ARG  57           HB2      ARG  57   5.438  -1.826  -2.827
  442    HB3  ARG  57           HB1      ARG  57   6.866  -2.587  -3.517
  443    HG2  ARG  57           HG2      ARG  57   5.805  -2.582  -5.722
  444    HG3  ARG  57           HG1      ARG  57   4.377  -1.814  -5.029
  445    HD2  ARG  57           HD2      ARG  57   5.688  -0.111  -6.057
  446    HD3  ARG  57           HD1      ARG  57   5.840   0.077  -4.313
  447    HE   ARG  57           HE       ARG  57   7.986  -1.522  -5.059
  448   HH11  ARG  57          HH11      ARG  57   6.796   1.713  -5.871
  449   HH12  ARG  57          HH12      ARG  57   8.372   2.339  -6.215
  450   HH21  ARG  57          HH21      ARG  57  10.046  -0.655  -5.520
  451   HH22  ARG  57          HH22      ARG  57  10.217   0.995  -6.017
  452    H    TYR  58           HN       TYR  58   4.396  -3.778  -0.911
  453    HA   TYR  58           HA       TYR  58   6.764  -4.806   0.347
  454    HB2  TYR  58           HB2      TYR  58   5.267  -3.442   1.639
  455    HB3  TYR  58           HB1      TYR  58   3.907  -4.498   1.293
  456    HD1  TYR  58           HD1      TYR  58   3.615  -6.587   2.483
  457    HD2  TYR  58           HD2      TYR  58   6.912  -4.049   3.335
  458    HE1  TYR  58           HE1      TYR  58   4.031  -7.840   4.555
  459    HE2  TYR  58           HE2      TYR  58   7.344  -5.293   5.409
  460    HH   TYR  58           HH       TYR  58   5.990  -6.730   7.010
  461    H    LYS  59           HN       LYS  59   3.577  -6.221  -0.373
  462    HA   LYS  59           HA       LYS  59   4.281  -8.871   0.520
  463    HB2  LYS  59           HB2      LYS  59   2.034  -7.985  -1.279
  464    HB3  LYS  59           HB1      LYS  59   2.144  -9.520  -0.436
  465    HG2  LYS  59           HG2      LYS  59   1.875  -6.803   0.836
  466    HG3  LYS  59           HG1      LYS  59   0.613  -8.029   0.700
  467    HD2  LYS  59           HD2      LYS  59   3.214  -8.506   2.140
  468    HD3  LYS  59           HD1      LYS  59   1.777  -7.870   2.940
  469    HE2  LYS  59           HE2      LYS  59   0.529  -9.868   2.302
  470    HE3  LYS  59           HE1      LYS  59   1.950 -10.500   1.471
  471    HZ1  LYS  59           HZ1      LYS  59   3.119 -10.525   3.600
  472    HZ2  LYS  59           HZ2      LYS  59   1.728 -11.488   3.649
  473    HZ3  LYS  59           HZ3      LYS  59   1.728  -9.964   4.385
  474    H    LYS  60           HN       LYS  60   5.058  -7.113  -2.293
  475    HA   LYS  60           HA       LYS  60   6.157  -7.713  -4.193
  476    HB2  LYS  60           HB2      LYS  60   6.304 -10.525  -3.091
  477    HB3  LYS  60           HB1      LYS  60   7.292  -9.842  -4.374
  478    HG2  LYS  60           HG2      LYS  60   7.305  -8.968  -1.491
  479    HG3  LYS  60           HG1      LYS  60   8.521  -9.976  -2.275
  480    HD2  LYS  60           HD2      LYS  60   9.192  -8.185  -3.703
  481    HD3  LYS  60           HD1      LYS  60   7.826  -7.191  -3.194
  482    HE2  LYS  60           HE2      LYS  60   8.757  -7.139  -0.909
  483    HE3  LYS  60           HE1      LYS  60  10.146  -8.066  -1.474
  484    HZ1  LYS  60           HZ1      LYS  60   9.359  -5.374  -2.456
  485    HZ2  LYS  60           HZ2      LYS  60  10.705  -6.260  -2.971
  486    HZ3  LYS  60           HZ3      LYS  60  10.623  -5.697  -1.378
  487    H    LEU  61           HN       LEU  61   3.819  -7.266  -4.787
  488    HA   LEU  61           HA       LEU  61   3.120  -9.138  -6.847
  489    HB2  LEU  61           HB2      LEU  61   0.728  -9.498  -5.911
  490    HB3  LEU  61           HB1      LEU  61   2.036 -10.511  -5.339
  491    HG   LEU  61           HG       LEU  61   2.216  -9.126  -3.305
  492   HD11  LEU  61          HD11      LEU  61   1.395  -7.017  -4.222
  493   HD12  LEU  61          HD12      LEU  61   0.492  -7.490  -2.783
  494   HD13  LEU  61          HD13      LEU  61  -0.217  -7.713  -4.381
  495   HD21  LEU  61          HD21      LEU  61   0.127  -9.863  -2.265
  496   HD22  LEU  61          HD22      LEU  61   0.834 -11.123  -3.277
  497   HD23  LEU  61          HD23      LEU  61  -0.547 -10.193  -3.862
  498    H    TYR  62           HN       TYR  62   3.679  -6.280  -6.509
  499    HA   TYR  62           HA       TYR  62   1.267  -4.780  -6.751
  500    HB2  TYR  62           HB2      TYR  62   3.405  -3.760  -6.168
  501    HB3  TYR  62           HB1      TYR  62   4.057  -4.172  -7.750
  502    HD1  TYR  62           HD1      TYR  62   1.095  -2.377  -6.336
  503    HD2  TYR  62           HD2      TYR  62   4.150  -2.464  -9.293
  504    HE1  TYR  62           HE1      TYR  62   0.295  -0.229  -7.216
  505    HE2  TYR  62           HE2      TYR  62   3.360  -0.311 -10.180
  506    HH   TYR  62           HH       TYR  62   1.241   1.697  -8.532
  507    H    ASN  63           HN       ASN  63   2.730  -6.947  -8.966
  508    HA   ASN  63           HA       ASN  63   2.006  -5.611 -11.402
  509    HB2  ASN  63           HB2      ASN  63   2.561  -8.529 -10.841
  510    HB3  ASN  63           HB1      ASN  63   2.402  -7.831 -12.448
  511   HD21  ASN  63          HD21      ASN  63   4.650  -9.222 -11.164
  512   HD22  ASN  63          HD22      ASN  63   6.024  -8.066 -11.250
  513    H    GLN  64           HN       GLN  64   0.535  -8.544  -9.879
  514    HA   GLN  64           HA       GLN  64  -1.859  -8.036 -11.529
  515    HB2  GLN  64           HB2      GLN  64  -0.976 -10.406  -9.901
  516    HB3  GLN  64           HB1      GLN  64  -2.567 -10.303 -10.636
  517    HG2  GLN  64           HG2      GLN  64  -1.524 -10.099 -12.845
  518    HG3  GLN  64           HG1      GLN  64   0.065 -10.237 -12.093
  519   HE21  GLN  64          HE21      GLN  64   0.761 -12.208 -11.248
  520   HE22  GLN  64          HE22      GLN  64  -0.066 -13.744 -11.680
  521    H    ALA  65           HN       ALA  65  -0.842  -7.392  -8.296
  522    HA   ALA  65           HA       ALA  65  -3.372  -7.891  -7.012
  523    HB1  ALA  65           HB1      ALA  65  -2.464  -6.549  -5.179
  524    HB2  ALA  65           HB2      ALA  65  -1.112  -6.069  -6.206
  525    HB3  ALA  65           HB3      ALA  65  -1.315  -7.759  -5.747
  526    H    ARG  66           HN       ARG  66  -1.979  -5.095  -8.690
  527    HA   ARG  66           HA       ARG  66  -4.133  -3.320  -7.850
  528    HB2  ARG  66           HB2      ARG  66  -1.765  -2.626  -8.432
  529    HB3  ARG  66           HB1      ARG  66  -2.189  -2.898 -10.116
  530    HG2  ARG  66           HG2      ARG  66  -3.944  -1.213  -9.955
  531    HG3  ARG  66           HG1      ARG  66  -3.538  -0.948  -8.260
  532    HD2  ARG  66           HD2      ARG  66  -2.483   0.779  -9.492
  533    HD3  ARG  66           HD1      ARG  66  -1.217  -0.350  -9.018
  534    HE   ARG  66           HE       ARG  66  -1.796  -1.293 -11.458
  535   HH11  ARG  66          HH11      ARG  66  -1.333   2.044 -10.355
  536   HH12  ARG  66          HH12      ARG  66  -0.741   2.591 -11.886
  537   HH21  ARG  66          HH21      ARG  66  -1.007  -0.528 -13.449
  538   HH22  ARG  66          HH22      ARG  66  -0.554   1.133 -13.642
  539    H    VAL  67           HN       VAL  67  -3.504  -5.498 -10.514
  540    HA   VAL  67           HA       VAL  67  -5.639  -4.351 -12.165
  541    HB   VAL  67           HB       VAL  67  -4.021  -6.869 -12.581
  542   HG11  VAL  67          HG11      VAL  67  -4.741  -6.698 -14.908
  543   HG12  VAL  67          HG12      VAL  67  -5.725  -5.291 -14.503
  544   HG13  VAL  67          HG13      VAL  67  -6.121  -6.869 -13.823
  545   HG21  VAL  67          HG21      VAL  67  -3.614  -4.088 -13.680
  546   HG22  VAL  67          HG22      VAL  67  -2.711  -5.522 -14.166
  547   HG23  VAL  67          HG23      VAL  67  -2.579  -4.916 -12.516
  548    H    LYS  68           HN       LYS  68  -5.033  -7.365 -10.334
  549    HA   LYS  68           HA       LYS  68  -7.516  -8.609 -10.985
  550    HB2  LYS  68           HB2      LYS  68  -5.638  -8.966  -8.653
  551    HB3  LYS  68           HB1      LYS  68  -7.058  -9.969  -8.900
  552    HG2  LYS  68           HG2      LYS  68  -6.157 -10.656 -11.088
  553    HG3  LYS  68           HG1      LYS  68  -4.712  -9.702 -10.767
  554    HD2  LYS  68           HD2      LYS  68  -4.250 -11.998 -10.235
  555    HD3  LYS  68           HD1      LYS  68  -4.320 -11.074  -8.734
  556    HE2  LYS  68           HE2      LYS  68  -5.483 -13.203  -8.499
  557    HE3  LYS  68           HE1      LYS  68  -6.605 -11.853  -8.357
  558    HZ1  LYS  68           HZ1      LYS  68  -7.501 -13.638  -9.728
  559    HZ2  LYS  68           HZ2      LYS  68  -6.200 -13.496 -10.801
  560    HZ3  LYS  68           HZ3      LYS  68  -7.302 -12.223 -10.634
  561    H    TYR  69           HN       TYR  69  -6.631  -6.247  -8.527
  562    HA   TYR  69           HA       TYR  69  -9.432  -6.382  -7.507
  563    HB2  TYR  69           HB2      TYR  69  -6.903  -5.453  -6.135
  564    HB3  TYR  69           HB1      TYR  69  -8.517  -5.302  -5.452
  565    HD1  TYR  69           HD1      TYR  69  -5.985  -7.759  -6.587
  566    HD2  TYR  69           HD2      TYR  69  -9.530  -7.109  -4.328
  567    HE1  TYR  69           HE1      TYR  69  -5.786 -10.018  -5.638
  568    HE2  TYR  69           HE2      TYR  69  -9.340  -9.365  -3.373
  569    HH   TYR  69           HH       TYR  69  -8.259 -11.572  -4.044
  570    H    SER  70           HN       SER  70 -10.423  -4.353  -6.836
  571    HA   SER  70           HA       SER  70  -9.979  -2.322  -8.871
  572    HB2  SER  70           HB2      SER  70 -11.859  -2.359  -6.497
  573    HB3  SER  70           HB1      SER  70 -11.899  -1.179  -7.806
  574    HG   SER  70           HG       SER  70 -13.363  -3.075  -7.943
  575    H    LEU  71           HN       LEU  71  -7.920  -1.485  -8.529
  576    HA   LEU  71           HA       LEU  71  -7.699   0.193  -6.070
  577    HB2  LEU  71           HB2      LEU  71  -5.580  -1.351  -7.554
  578    HB3  LEU  71           HB1      LEU  71  -5.178  -0.031  -6.474
  579    HG   LEU  71           HG       LEU  71  -6.380  -1.297  -4.646
  580   HD11  LEU  71          HD11      LEU  71  -6.549  -3.762  -5.029
  581   HD12  LEU  71          HD12      LEU  71  -6.346  -3.445  -6.753
  582   HD13  LEU  71          HD13      LEU  71  -7.741  -2.793  -5.894
  583   HD21  LEU  71          HD21      LEU  71  -3.928  -2.451  -5.957
  584   HD22  LEU  71          HD22      LEU  71  -4.500  -2.929  -4.358
  585   HD23  LEU  71          HD23      LEU  71  -4.002  -1.263  -4.655
  586    H    LEU  72           HN       LEU  72  -5.591   0.099  -8.943
  587    HA   LEU  72           HA       LEU  72  -6.608   2.797  -9.689
  588    HB2  LEU  72           HB2      LEU  72  -3.723   1.958  -9.396
  589    HB3  LEU  72           HB1      LEU  72  -4.220   3.393 -10.266
  590    HG   LEU  72           HG       LEU  72  -3.502   4.100  -8.124
  591   HD11  LEU  72          HD11      LEU  72  -5.514   5.205  -8.932
  592   HD12  LEU  72          HD12      LEU  72  -5.509   5.105  -7.172
  593   HD13  LEU  72          HD13      LEU  72  -6.513   4.005  -8.115
  594   HD21  LEU  72          HD21      LEU  72  -5.450   2.281  -6.753
  595   HD22  LEU  72          HD22      LEU  72  -4.074   3.146  -6.074
  596   HD23  LEU  72          HD23      LEU  72  -3.809   1.759  -7.130
  597    H    GLU  73           HN       GLU  73  -7.827   1.707 -11.303
  598    HA   GLU  73           HA       GLU  73  -6.130   0.678 -13.532
  599    HB2  GLU  73           HB2      GLU  73  -9.000   0.007 -12.849
  600    HB3  GLU  73           HB1      GLU  73  -8.134  -0.589 -14.258
  601    HG2  GLU  73           HG2      GLU  73  -7.373  -1.122 -11.393
  602    HG3  GLU  73           HG1      GLU  73  -8.241  -2.238 -12.444
  Start of MODEL    7
    1    H1   SER   1           HT1      SER   1  -0.020  16.621   8.321
    2    H2   SER   1           HT2      SER   1   1.023  16.014   9.506
    3    H3   SER   1           HT3      SER   1  -0.585  16.361   9.895
    4    HA   SER   1           HA       SER   1  -0.245  13.991   9.665
    5    HB2  SER   1           HB2      SER   1  -1.930  15.273   7.499
    6    HB3  SER   1           HB1      SER   1  -2.032  13.574   7.957
    7    HG   SER   1           HG       SER   1  -3.111  14.109   9.687
    8    H    ASP   2           HN       ASP   2   1.465  12.840   9.064
    9    HA   ASP   2           HA       ASP   2   2.339  13.053   6.217
   10    HB2  ASP   2           HB2      ASP   2   3.994  13.603   8.057
   11    HB3  ASP   2           HB1      ASP   2   3.913  11.911   8.536
   12    H    VAL   3           HN       VAL   3   3.046  11.080   5.136
   13    HA   VAL   3           HA       VAL   3   1.122   9.021   5.298
   14    HB   VAL   3           HB       VAL   3   2.585   9.514   3.323
   15   HG11  VAL   3          HG11      VAL   3   4.638   7.855   4.780
   16   HG12  VAL   3          HG12      VAL   3   4.726   9.603   4.569
   17   HG13  VAL   3          HG13      VAL   3   4.781   8.542   3.162
   18   HG21  VAL   3          HG21      VAL   3   2.773   7.154   2.608
   19   HG22  VAL   3          HG22      VAL   3   1.217   7.529   3.346
   20   HG23  VAL   3          HG23      VAL   3   2.440   6.654   4.265
   21    H    TRP   4           HN       TRP   4   4.350   9.269   6.779
   22    HA   TRP   4           HA       TRP   4   4.256   6.548   7.797
   23    HB2  TRP   4           HB2      TRP   4   6.273   8.326   7.361
   24    HB3  TRP   4           HB1      TRP   4   6.073   8.471   9.104
   25    HD1  TRP   4           HD1      TRP   4   5.758   5.675  10.166
   26    HE1  TRP   4           HE1      TRP   4   7.529   3.804   9.862
   27    HE3  TRP   4           HE3      TRP   4   8.185   7.596   6.094
   28    HZ2  TRP   4           HZ2      TRP   4   9.666   3.272   8.089
   29    HZ3  TRP   4           HZ3      TRP   4  10.084   6.342   5.157
   30    HH2  TRP   4           HH2      TRP   4  10.807   4.226   6.136
   31    H    SER   5           HN       SER   5   3.517   9.799   9.043
   32    HA   SER   5           HA       SER   5   3.196   9.053  11.769
   33    HB2  SER   5           HB2      SER   5   3.306  11.403  10.937
   34    HB3  SER   5           HB1      SER   5   1.693  11.203  10.251
   35    HG   SER   5           HG       SER   5   0.859  11.446  12.168
   36    H    LEU   6           HN       LEU   6   0.782   9.367   9.133
   37    HA   LEU   6           HA       LEU   6  -1.195   7.953  10.819
   38    HB2  LEU   6           HB2      LEU   6  -1.414   9.305   8.129
   39    HB3  LEU   6           HB1      LEU   6  -2.735   8.441   8.891
   40    HG   LEU   6           HG       LEU   6  -2.410  10.067  10.864
   41   HD11  LEU   6          HD11      LEU   6  -1.508  12.270  10.189
   42   HD12  LEU   6          HD12      LEU   6  -0.917  11.536   8.697
   43   HD13  LEU   6          HD13      LEU   6  -0.282  11.004  10.255
   44   HD21  LEU   6          HD21      LEU   6  -3.447  11.033   8.203
   45   HD22  LEU   6          HD22      LEU   6  -3.819  11.757   9.768
   46   HD23  LEU   6          HD23      LEU   6  -4.344  10.111   9.410
   47    H    SER   7           HN       SER   7  -0.209   5.905  10.862
   48    HA   SER   7           HA       SER   7  -0.345   4.465   8.247
   49    HB2  SER   7           HB2      SER   7   1.519   4.067  10.591
   50    HB3  SER   7           HB1      SER   7   1.369   2.919   9.263
   51    HG   SER   7           HG       SER   7   2.474   5.480   9.291
   52    H    LYS   8           HN       LYS   8  -2.130   4.864  10.925
   53    HA   LYS   8           HA       LYS   8  -2.706   1.992  11.327
   54    HB2  LYS   8           HB2      LYS   8  -3.763   4.442  12.749
   55    HB3  LYS   8           HB1      LYS   8  -4.141   2.780  13.178
   56    HG2  LYS   8           HG2      LYS   8  -1.424   4.077  13.285
   57    HG3  LYS   8           HG1      LYS   8  -2.453   3.679  14.660
   58    HD2  LYS   8           HD2      LYS   8  -1.350   1.658  12.710
   59    HD3  LYS   8           HD1      LYS   8  -0.618   2.043  14.267
   60    HE2  LYS   8           HE2      LYS   8  -2.741   1.377  15.370
   61    HE3  LYS   8           HE1      LYS   8  -3.361   0.881  13.797
   62    HZ1  LYS   8           HZ1      LYS   8  -2.485  -1.000  15.022
   63    HZ2  LYS   8           HZ2      LYS   8  -0.974  -0.254  15.152
   64    HZ3  LYS   8           HZ3      LYS   8  -1.555  -0.723  13.636
   65    H    THR   9           HN       THR   9  -3.992   4.842   9.761
   66    HA   THR   9           HA       THR   9  -6.713   3.927   9.559
   67    HB   THR   9           HB       THR   9  -6.914   5.639   7.754
   68    HG1  THR   9           HG1      THR   9  -5.142   6.761   7.095
   69   HG21  THR   9          HG21      THR   9  -7.237   6.278  10.090
   70   HG22  THR   9          HG22      THR   9  -6.469   7.584   9.187
   71   HG23  THR   9          HG23      THR   9  -5.506   6.569  10.261
   72    H    SER  10           HN       SER  10  -7.112   1.968   8.696
   73    HA   SER  10           HA       SER  10  -5.609   1.072   6.341
   74    HB2  SER  10           HB2      SER  10  -7.906  -0.269   7.789
   75    HB3  SER  10           HB1      SER  10  -6.846  -1.018   6.596
   76    HG   SER  10           HG       SER  10  -5.828  -1.568   8.382
   77    H    MET  11           HN       MET  11  -6.896  -0.061   4.561
   78    HA   MET  11           HA       MET  11  -9.327   1.496   3.856
   79    HB2  MET  11           HB2      MET  11  -7.375   2.552   2.744
   80    HB3  MET  11           HB1      MET  11  -7.000   1.011   1.986
   81    HG2  MET  11           HG2      MET  11  -8.126   2.451   0.421
   82    HG3  MET  11           HG1      MET  11  -9.149   1.072   0.813
   83    HE1  MET  11           HE1      MET  11 -11.774   3.908   0.243
   84    HE2  MET  11           HE2      MET  11 -11.248   2.289  -0.217
   85    HE3  MET  11           HE3      MET  11 -10.259   3.690  -0.631
   86    H    THR  12           HN       THR  12 -10.843   0.408   2.616
   87    HA   THR  12           HA       THR  12 -10.374  -2.517   2.503
   88    HB   THR  12           HB       THR  12 -12.957  -0.968   2.242
   89    HG1  THR  12           HG1      THR  12 -11.909  -2.509   4.406
   90   HG21  THR  12          HG21      THR  12 -14.032  -3.169   2.526
   91   HG22  THR  12          HG22      THR  12 -12.446  -3.938   2.471
   92   HG23  THR  12          HG23      THR  12 -13.066  -3.092   1.053
   93    H    PHE  13           HN       PHE  13  -9.877  -3.491   0.687
   94    HA   PHE  13           HA       PHE  13 -10.458  -2.125  -1.883
   95    HB2  PHE  13           HB2      PHE  13  -8.546  -4.292  -1.058
   96    HB3  PHE  13           HB1      PHE  13  -8.946  -4.043  -2.750
   97    HD1  PHE  13           HD2      PHE  13  -9.144  -1.021  -2.688
   98    HD2  PHE  13           HD1      PHE  13  -6.279  -3.725  -1.077
   99    HE1  PHE  13           HE2      PHE  13  -7.421   0.729  -2.828
  100    HE2  PHE  13           HE1      PHE  13  -4.554  -1.983  -1.216
  101    HZ   PHE  13           HZ       PHE  13  -5.119   0.248  -2.090
  102    H    GLN  14           HN       GLN  14 -11.464  -3.189  -3.619
  103    HA   GLN  14           HA       GLN  14 -13.052  -5.563  -2.763
  104    HB2  GLN  14           HB2      GLN  14 -14.441  -3.532  -2.853
  105    HB3  GLN  14           HB1      GLN  14 -13.970  -3.288  -4.528
  106    HG2  GLN  14           HG2      GLN  14 -16.172  -4.256  -4.423
  107    HG3  GLN  14           HG1      GLN  14 -15.043  -5.413  -5.124
  108   HE21  GLN  14          HE21      GLN  14 -17.005  -4.585  -2.344
  109   HE22  GLN  14          HE22      GLN  14 -16.930  -6.209  -1.574
  110    HA   PRO  15           HA       PRO  15 -10.654  -7.372  -6.173
  111    HB2  PRO  15           HB2      PRO  15 -12.247  -9.673  -6.062
  112    HB3  PRO  15           HB1      PRO  15 -10.694  -9.433  -5.261
  113    HG2  PRO  15           HG2      PRO  15 -13.449  -9.168  -4.169
  114    HG3  PRO  15           HG1      PRO  15 -11.973  -9.749  -3.378
  115    HD2  PRO  15           HD2      PRO  15 -12.947  -7.326  -2.853
  116    HD3  PRO  15           HD1      PRO  15 -11.196  -7.592  -2.975
  117    H    LYS  16           HN       LYS  16 -11.000  -7.765  -8.328
  118    HA   LYS  16           HA       LYS  16 -13.390  -6.566  -9.428
  119    HB2  LYS  16           HB2      LYS  16 -11.159  -8.124 -10.756
  120    HB3  LYS  16           HB1      LYS  16 -12.407  -7.233 -11.611
  121    HG2  LYS  16           HG2      LYS  16 -10.394  -6.030  -9.724
  122    HG3  LYS  16           HG1      LYS  16 -10.296  -6.002 -11.485
  123    HD2  LYS  16           HD2      LYS  16 -12.423  -4.758 -11.557
  124    HD3  LYS  16           HD1      LYS  16 -12.456  -4.746  -9.793
  125    HE2  LYS  16           HE2      LYS  16 -10.305  -3.538  -9.796
  126    HE3  LYS  16           HE1      LYS  16 -10.356  -3.491 -11.557
  127    HZ1  LYS  16           HZ1      LYS  16 -11.154  -1.428 -10.557
  128    HZ2  LYS  16           HZ2      LYS  16 -12.382  -2.272  -9.759
  129    HZ3  LYS  16           HZ3      LYS  16 -12.373  -2.192 -11.448
  130    H    LYS  17           HN       LYS  17 -12.152  -9.875  -9.041
  131    HA   LYS  17           HA       LYS  17 -14.678 -10.923 -10.212
  132    HB2  LYS  17           HB2      LYS  17 -12.096 -12.367  -9.578
  133    HB3  LYS  17           HB1      LYS  17 -13.502 -13.073 -10.361
  134    HG2  LYS  17           HG2      LYS  17 -12.124 -12.637 -12.150
  135    HG3  LYS  17           HG1      LYS  17 -13.144 -11.198 -12.124
  136    HD2  LYS  17           HD2      LYS  17 -11.381 -10.016 -10.853
  137    HD3  LYS  17           HD1      LYS  17 -10.360 -11.448 -10.981
  138    HE2  LYS  17           HE2      LYS  17 -10.391 -11.258 -13.415
  139    HE3  LYS  17           HE1      LYS  17 -11.435  -9.842 -13.297
  140    HZ1  LYS  17           HZ1      LYS  17  -8.670 -10.040 -12.227
  141    HZ2  LYS  17           HZ2      LYS  17  -9.670  -8.679 -12.126
  142    HZ3  LYS  17           HZ3      LYS  17  -9.126  -9.219 -13.634
  143    H    ALA  18           HN       ALA  18 -15.447 -13.034  -9.185
  144    HA   ALA  18           HA       ALA  18 -16.048 -12.454  -6.409
  145    HB1  ALA  18           HB1      ALA  18 -17.692 -13.447  -7.932
  146    HB2  ALA  18           HB2      ALA  18 -17.426 -14.453  -6.509
  147    HB3  ALA  18           HB3      ALA  18 -16.697 -14.897  -8.052
  148    H    SER  19           HN       SER  19 -13.962 -14.751  -8.133
  149    HA   SER  19           HA       SER  19 -13.344 -16.482  -6.001
  150    HB2  SER  19           HB2      SER  19 -12.687 -16.866  -8.351
  151    HB3  SER  19           HB1      SER  19 -11.503 -15.566  -8.224
  152    HG   SER  19           HG       SER  19 -10.236 -16.810  -7.031
  153    H    LEU  20           HN       LEU  20 -11.989 -13.298  -6.815
  154    HA   LEU  20           HA       LEU  20  -9.908 -13.464  -4.804
  155    HB2  LEU  20           HB2      LEU  20 -11.032 -11.059  -6.230
  156    HB3  LEU  20           HB1      LEU  20  -9.540 -11.108  -5.325
  157    HG   LEU  20           HG       LEU  20 -10.062 -12.707  -7.828
  158   HD11  LEU  20          HD11      LEU  20  -8.484 -10.165  -7.460
  159   HD12  LEU  20          HD12      LEU  20 -10.031 -10.310  -8.294
  160   HD13  LEU  20          HD13      LEU  20  -8.600 -11.111  -8.943
  161   HD21  LEU  20          HD21      LEU  20  -7.679 -13.140  -7.791
  162   HD22  LEU  20          HD22      LEU  20  -8.414 -13.691  -6.285
  163   HD23  LEU  20          HD23      LEU  20  -7.502 -12.182  -6.321
  164    H    GLN  21           HN       GLN  21  -9.727 -12.271  -2.867
  165    HA   GLN  21           HA       GLN  21 -12.380 -11.625  -1.660
  166    HB2  GLN  21           HB2      GLN  21  -9.971 -13.020  -0.615
  167    HB3  GLN  21           HB1      GLN  21 -10.870 -12.015   0.509
  168    HG2  GLN  21           HG2      GLN  21 -11.609 -14.299   0.665
  169    HG3  GLN  21           HG1      GLN  21 -12.901 -13.293   0.014
  170   HE21  GLN  21          HE21      GLN  21 -13.636 -13.597  -2.056
  171   HE22  GLN  21          HE22      GLN  21 -13.127 -15.002  -3.053
  172    HA   PRO  22           HA       PRO  22 -11.244  -7.374  -1.165
  173    HB2  PRO  22           HB2      PRO  22 -12.589  -7.657   1.481
  174    HB3  PRO  22           HB1      PRO  22 -12.867  -6.474   0.199
  175    HG2  PRO  22           HG2      PRO  22 -14.580  -8.464   0.576
  176    HG3  PRO  22           HG1      PRO  22 -14.145  -7.949  -1.065
  177    HD2  PRO  22           HD2      PRO  22 -13.232 -10.340   0.478
  178    HD3  PRO  22           HD1      PRO  22 -13.609 -10.187  -1.251
  179    H    LEU  23           HN       LEU  23  -9.810  -6.022  -0.049
  180    HA   LEU  23           HA       LEU  23  -8.241  -7.391   2.092
  181    HB2  LEU  23           HB2      LEU  23  -7.181  -7.165  -0.240
  182    HB3  LEU  23           HB1      LEU  23  -7.046  -5.459   0.129
  183    HG   LEU  23           HG       LEU  23  -5.852  -7.597   1.886
  184   HD11  LEU  23          HD11      LEU  23  -4.880  -7.815  -0.328
  185   HD12  LEU  23          HD12      LEU  23  -3.714  -7.114   0.794
  186   HD13  LEU  23          HD13      LEU  23  -4.546  -6.084  -0.371
  187   HD21  LEU  23          HD21      LEU  23  -6.093  -5.512   3.022
  188   HD22  LEU  23          HD22      LEU  23  -5.457  -4.621   1.642
  189   HD23  LEU  23          HD23      LEU  23  -4.397  -5.679   2.572
  190    H    THR  24           HN       THR  24  -8.094  -6.346   3.963
  191    HA   THR  24           HA       THR  24  -8.487  -3.400   3.901
  192    HB   THR  24           HB       THR  24  -9.675  -5.268   5.956
  193    HG1  THR  24           HG1      THR  24 -11.116  -5.366   4.367
  194   HG21  THR  24          HG21      THR  24 -10.748  -3.258   6.858
  195   HG22  THR  24          HG22      THR  24  -9.892  -2.265   5.677
  196   HG23  THR  24          HG23      THR  24  -8.991  -3.124   6.927
  197    H    ILE  25           HN       ILE  25  -6.363  -2.815   4.189
  198    HA   ILE  25           HA       ILE  25  -5.306  -3.281   6.890
  199    HB   ILE  25           HB       ILE  25  -4.524  -5.191   5.347
  200   HG12  ILE  25          HG12      ILE  25  -2.296  -3.633   6.647
  201   HG13  ILE  25          HG11      ILE  25  -3.540  -4.446   7.590
  202   HG21  ILE  25          HG21      ILE  25  -3.978  -3.655   3.450
  203   HG22  ILE  25          HG22      ILE  25  -2.694  -4.781   3.886
  204   HG23  ILE  25          HG23      ILE  25  -2.591  -3.094   4.386
  205   HD11  ILE  25          HD11      ILE  25  -1.569  -5.823   7.428
  206   HD12  ILE  25          HD12      ILE  25  -1.626  -5.743   5.668
  207   HD13  ILE  25          HD13      ILE  25  -2.903  -6.575   6.554
  208    H    SER  26           HN       SER  26  -3.262  -2.012   7.294
  209    HA   SER  26           HA       SER  26  -3.226   0.398   5.535
  210    HB2  SER  26           HB2      SER  26  -4.349   0.761   7.751
  211    HB3  SER  26           HB1      SER  26  -2.810   0.397   8.528
  212    HG   SER  26           HG       SER  26  -3.107   2.644   8.229
  213    H    LEU  27           HN       LEU  27  -1.251   1.834   6.349
  214    HA   LEU  27           HA       LEU  27   1.107   0.682   5.336
  215    HB2  LEU  27           HB2      LEU  27   0.910   2.963   7.277
  216    HB3  LEU  27           HB1      LEU  27   2.218   2.644   6.155
  217    HG   LEU  27           HG       LEU  27  -0.605   3.377   5.366
  218   HD11  LEU  27          HD11      LEU  27   0.385   5.513   4.677
  219   HD12  LEU  27          HD12      LEU  27   1.925   5.010   5.376
  220   HD13  LEU  27          HD13      LEU  27   0.520   5.244   6.414
  221   HD21  LEU  27          HD21      LEU  27   0.499   1.969   3.707
  222   HD22  LEU  27          HD22      LEU  27   1.888   3.057   3.698
  223   HD23  LEU  27          HD23      LEU  27   0.322   3.623   3.120
  224    H    ASP  28           HN       ASP  28   0.419   1.461   8.769
  225    HA   ASP  28           HA       ASP  28   2.832   0.239   9.710
  226    HB2  ASP  28           HB2      ASP  28   1.740   1.934  11.031
  227    HB3  ASP  28           HB1      ASP  28   0.271   0.971  11.139
  228    H    GLU  29           HN       GLU  29  -0.506  -0.936   9.395
  229    HA   GLU  29           HA       GLU  29   0.035  -3.426  10.746
  230    HB2  GLU  29           HB2      GLU  29  -2.209  -2.521   8.948
  231    HB3  GLU  29           HB1      GLU  29  -2.161  -4.116   9.681
  232    HG2  GLU  29           HG2      GLU  29  -3.481  -2.953  11.152
  233    HG3  GLU  29           HG1      GLU  29  -1.894  -2.810  11.904
  234    H    LEU  30           HN       LEU  30   0.914  -2.317   7.617
  235    HA   LEU  30           HA       LEU  30   1.225  -5.160   6.783
  236    HB2  LEU  30           HB2      LEU  30  -0.506  -3.956   5.489
  237    HB3  LEU  30           HB1      LEU  30   0.700  -2.789   4.987
  238    HG   LEU  30           HG       LEU  30   1.887  -4.499   3.726
  239   HD11  LEU  30          HD11      LEU  30  -0.271  -6.382   4.664
  240   HD12  LEU  30          HD12      LEU  30   1.422  -6.417   5.157
  241   HD13  LEU  30          HD13      LEU  30   0.984  -6.749   3.481
  242   HD21  LEU  30          HD21      LEU  30   0.275  -4.857   1.980
  243   HD22  LEU  30          HD22      LEU  30   0.017  -3.259   2.683
  244   HD23  LEU  30          HD23      LEU  30  -1.058  -4.592   3.104
  245    H    PHE  31           HN       PHE  31   3.074  -2.916   8.035
  246    HA   PHE  31           HA       PHE  31   5.277  -3.672   6.231
  247    HB2  PHE  31           HB2      PHE  31   4.931  -0.861   7.309
  248    HB3  PHE  31           HB1      PHE  31   6.350  -1.425   6.438
  249    HD1  PHE  31           HD1      PHE  31   5.127  -2.975   4.251
  250    HD2  PHE  31           HD2      PHE  31   3.999   0.758   5.952
  251    HE1  PHE  31           HE1      PHE  31   4.072  -2.327   2.126
  252    HE2  PHE  31           HE2      PHE  31   2.940   1.408   3.831
  253    HZ   PHE  31           HZ       PHE  31   2.974  -0.137   1.916
  254    H    SER  32           HN       SER  32   7.254  -4.144   7.157
  255    HA   SER  32           HA       SER  32   7.397  -3.825  10.109
  256    HB2  SER  32           HB2      SER  32   8.092  -6.309   8.544
  257    HB3  SER  32           HB1      SER  32   8.349  -6.091  10.275
  258    HG   SER  32           HG       SER  32   6.336  -6.575  10.583
  259    H    SER  33           HN       SER  33   8.644  -2.293   7.866
  260    HA   SER  33           HA       SER  33  11.361  -2.310   8.844
  261    HB2  SER  33           HB2      SER  33  11.581  -4.220   7.352
  262    HB3  SER  33           HB1      SER  33  10.873  -3.296   6.028
  263    HG   SER  33           HG       SER  33  12.934  -2.935   5.646
  264    H    ARG  34           HN       ARG  34  12.404  -0.411   8.515
  265    HA   ARG  34           HA       ARG  34  10.861   1.802   7.591
  266    HB2  ARG  34           HB2      ARG  34  13.831   1.531   8.083
  267    HB3  ARG  34           HB1      ARG  34  13.027   3.057   7.750
  268    HG2  ARG  34           HG2      ARG  34  11.650   2.745   9.768
  269    HG3  ARG  34           HG1      ARG  34  12.532   1.255  10.112
  270    HD2  ARG  34           HD2      ARG  34  14.605   2.490  10.316
  271    HD3  ARG  34           HD1      ARG  34  13.790   3.985   9.858
  272    HE   ARG  34           HE       ARG  34  12.620   2.712  12.192
  273   HH11  ARG  34          HH11      ARG  34  15.180   4.884  11.060
  274   HH12  ARG  34          HH12      ARG  34  15.338   5.686  12.587
  275   HH21  ARG  34          HH21      ARG  34  12.862   3.796  14.181
  276   HH22  ARG  34          HH22      ARG  34  14.024   5.068  14.357
  277    H    GLY  35           HN       GLY  35  13.677   0.122   6.126
  278    HA2  GLY  35           HA2      GLY  35  13.717   1.664   3.735
  279    HA3  GLY  35           HA1      GLY  35  14.369   0.043   3.917
  280    H    GLU  36           HN       GLU  36  11.850  -1.212   4.645
  281    HA   GLU  36           HA       GLU  36  10.878  -1.877   2.069
  282    HB2  GLU  36           HB2      GLU  36  10.557  -3.361   3.953
  283    HB3  GLU  36           HB1      GLU  36   9.599  -2.156   4.797
  284    HG2  GLU  36           HG2      GLU  36   8.143  -3.827   3.922
  285    HG3  GLU  36           HG1      GLU  36   7.885  -2.333   3.024
  286    H    PHE  37           HN       PHE  37   9.697   0.417   4.522
  287    HA   PHE  37           HA       PHE  37   7.320   1.220   3.218
  288    HB2  PHE  37           HB2      PHE  37   8.143   1.801   5.569
  289    HB3  PHE  37           HB1      PHE  37   9.110   3.061   4.812
  290    HD1  PHE  37           HD1      PHE  37   7.963   4.913   3.592
  291    HD2  PHE  37           HD2      PHE  37   5.844   2.091   5.970
  292    HE1  PHE  37           HE1      PHE  37   6.038   6.442   3.687
  293    HE2  PHE  37           HE2      PHE  37   3.916   3.613   6.067
  294    HZ   PHE  37           HZ       PHE  37   4.011   5.792   4.925
  295    H    ILE  38           HN       ILE  38  10.652   2.501   2.981
  296    HA   ILE  38           HA       ILE  38  10.172   4.590   1.181
  297    HB   ILE  38           HB       ILE  38  12.598   2.793   1.307
  298   HG12  ILE  38          HG12      ILE  38  12.174   3.756   3.474
  299   HG13  ILE  38          HG11      ILE  38  13.512   4.632   2.741
  300   HG21  ILE  38          HG21      ILE  38  12.620   4.057  -0.741
  301   HG22  ILE  38          HG22      ILE  38  13.792   4.758   0.376
  302   HG23  ILE  38          HG23      ILE  38  12.233   5.544   0.127
  303   HD11  ILE  38          HD11      ILE  38  10.651   5.560   2.890
  304   HD12  ILE  38          HD12      ILE  38  11.975   6.436   2.122
  305   HD13  ILE  38          HD13      ILE  38  12.000   6.150   3.861
  306    H    SER  39           HN       SER  39  11.080   1.180   0.409
  307    HA   SER  39           HA       SER  39  11.104   1.528  -2.397
  308    HB2  SER  39           HB2      SER  39  10.361  -0.972  -0.815
  309    HB3  SER  39           HB1      SER  39  10.795  -0.942  -2.523
  310    HG   SER  39           HG       SER  39  12.399  -0.666  -0.270
  311    H    VAL  40           HN       VAL  40   8.462  -0.098  -0.518
  312    HA   VAL  40           HA       VAL  40   6.563  -0.408  -2.345
  313    HB   VAL  40           HB       VAL  40   4.807   0.120  -0.667
  314   HG11  VAL  40          HG11      VAL  40   5.897  -2.063  -0.751
  315   HG12  VAL  40          HG12      VAL  40   5.487  -1.616   0.904
  316   HG13  VAL  40          HG13      VAL  40   7.153  -1.483   0.342
  317   HG21  VAL  40          HG21      VAL  40   5.419   0.825   1.551
  318   HG22  VAL  40          HG22      VAL  40   5.972   2.032   0.388
  319   HG23  VAL  40          HG23      VAL  40   7.120   0.898   1.097
  320    H    GLY  41           HN       GLY  41   7.373   2.908  -1.146
  321    HA2  GLY  41           HA2      GLY  41   6.965   4.522  -3.053
  322    HA3  GLY  41           HA1      GLY  41   5.330   3.879  -3.085
  323    H    GLY  42           HN       GLY  42   7.426   4.670  -0.284
  324    HA2  GLY  42           HA2      GLY  42   5.343   6.669   0.493
  325    HA3  GLY  42           HA1      GLY  42   6.088   5.583   1.646
  326    H    ASP  43           HN       ASP  43   6.406   8.468  -0.250
  327    HA   ASP  43           HA       ASP  43   9.115   9.029   0.726
  328    HB2  ASP  43           HB2      ASP  43   7.091  10.746  -0.742
  329    HB3  ASP  43           HB1      ASP  43   8.721  11.278  -0.333
  330    H    GLY  44           HN       GLY  44   6.171  11.084   0.978
  331    HA2  GLY  44           HA2      GLY  44   6.353  11.046   3.908
  332    HA3  GLY  44           HA1      GLY  44   6.838  12.563   3.169
  333    H    ARG  45           HN       ARG  45   5.239  13.477   1.534
  334    HA   ARG  45           HA       ARG  45   2.630  13.492   2.876
  335    HB2  ARG  45           HB2      ARG  45   3.771  15.120   0.601
  336    HB3  ARG  45           HB1      ARG  45   2.129  15.314   1.200
  337    HG2  ARG  45           HG2      ARG  45   3.415  17.003   2.227
  338    HG3  ARG  45           HG1      ARG  45   3.129  15.779   3.464
  339    HD2  ARG  45           HD2      ARG  45   5.442  16.606   3.492
  340    HD3  ARG  45           HD1      ARG  45   5.353  14.882   3.144
  341    HE   ARG  45           HE       ARG  45   5.439  16.555   0.761
  342   HH11  ARG  45          HH11      ARG  45   7.375  14.888   3.217
  343   HH12  ARG  45          HH12      ARG  45   8.781  14.791   2.212
  344   HH21  ARG  45          HH21      ARG  45   7.313  16.401  -0.526
  345   HH22  ARG  45          HH22      ARG  45   8.745  15.645   0.088
  346    H    MET  46           HN       MET  46   1.529  11.640   2.444
  347    HA   MET  46           HA       MET  46   1.328  10.746  -0.359
  348    HB2  MET  46           HB2      MET  46   1.685   9.211   1.669
  349    HB3  MET  46           HB1      MET  46  -0.012   9.492   2.031
  350    HG2  MET  46           HG2      MET  46   0.273   7.418   0.825
  351    HG3  MET  46           HG1      MET  46  -0.628   8.575  -0.145
  352    HE1  MET  46           HE1      MET  46   3.865   7.780  -0.835
  353    HE2  MET  46           HE2      MET  46   2.953   6.975   0.440
  354    HE3  MET  46           HE3      MET  46   3.216   8.717   0.510
  355    H    SER  47           HN       SER  47  -0.867  10.070  -1.187
  356    HA   SER  47           HA       SER  47  -2.693  12.336  -0.739
  357    HB2  SER  47           HB2      SER  47  -2.098  11.625  -3.044
  358    HB3  SER  47           HB1      SER  47  -2.888  10.077  -2.747
  359    HG   SER  47           HG       SER  47  -4.062  12.651  -2.858
  360    H    HIS  48           HN       HIS  48  -3.304   8.853  -1.280
  361    HA   HIS  48           HA       HIS  48  -4.708   8.242   1.107
  362    HB2  HIS  48           HB2      HIS  48  -6.333   9.928   0.541
  363    HB3  HIS  48           HB1      HIS  48  -6.427   9.339  -1.114
  364    HD1  HIS  48           HD1      HIS  48  -7.150   8.092   2.432
  365    HD2  HIS  48           HD2      HIS  48  -8.453   7.581  -1.521
  366    HE1  HIS  48           HE1      HIS  48  -9.160   6.549   2.533
  367    HE2  HIS  48           HE2      HIS  48 -10.011   6.321   0.149
  368    H    LYS  49           HN       LYS  49  -5.672   7.794  -2.325
  369    HA   LYS  49           HA       LYS  49  -5.859   4.970  -2.031
  370    HB2  LYS  49           HB2      LYS  49  -5.793   6.899  -4.295
  371    HB3  LYS  49           HB1      LYS  49  -5.472   5.214  -4.670
  372    HG2  LYS  49           HG2      LYS  49  -7.921   6.241  -3.252
  373    HG3  LYS  49           HG1      LYS  49  -7.833   5.811  -4.962
  374    HD2  LYS  49           HD2      LYS  49  -7.277   3.508  -4.358
  375    HD3  LYS  49           HD1      LYS  49  -7.336   3.935  -2.647
  376    HE2  LYS  49           HE2      LYS  49  -9.704   4.534  -2.892
  377    HE3  LYS  49           HE1      LYS  49  -9.637   4.073  -4.593
  378    HZ1  LYS  49           HZ1      LYS  49  -9.182   2.259  -2.285
  379    HZ2  LYS  49           HZ2      LYS  49  -9.094   1.812  -3.913
  380    HZ3  LYS  49           HZ3      LYS  49 -10.570   2.305  -3.251
  381    H    GLU  50           HN       GLU  50  -3.183   7.117  -2.699
  382    HA   GLU  50           HA       GLU  50  -1.372   5.217  -3.821
  383    HB2  GLU  50           HB2      GLU  50  -0.870   7.759  -2.266
  384    HB3  GLU  50           HB1      GLU  50   0.348   6.886  -3.178
  385    HG2  GLU  50           HG2      GLU  50  -2.118   8.195  -4.298
  386    HG3  GLU  50           HG1      GLU  50  -0.464   8.787  -4.426
  387    H    ALA  51           HN       ALA  51  -1.643   6.518  -0.479
  388    HA   ALA  51           HA       ALA  51   0.423   5.116   0.722
  389    HB1  ALA  51           HB1      ALA  51  -0.741   5.364   2.821
  390    HB2  ALA  51           HB2      ALA  51  -2.282   5.563   1.988
  391    HB3  ALA  51           HB3      ALA  51  -1.033   6.797   1.837
  392    H    ILE  52           HN       ILE  52  -2.970   3.903   0.422
  393    HA   ILE  52           HA       ILE  52  -2.343   1.444   1.672
  394    HB   ILE  52           HB       ILE  52  -4.480   1.835  -0.450
  395   HG12  ILE  52          HG12      ILE  52  -4.603   3.563   1.328
  396   HG13  ILE  52          HG11      ILE  52  -5.981   2.479   1.351
  397   HG21  ILE  52          HG21      ILE  52  -4.296  -0.109   1.849
  398   HG22  ILE  52          HG22      ILE  52  -4.079  -0.495   0.142
  399   HG23  ILE  52          HG23      ILE  52  -5.652   0.042   0.731
  400   HD11  ILE  52          HD11      ILE  52  -5.212   2.965   3.596
  401   HD12  ILE  52          HD12      ILE  52  -3.606   2.358   3.194
  402   HD13  ILE  52          HD13      ILE  52  -4.985   1.258   3.220
  403    H    LEU  53           HN       LEU  53  -2.338   2.372  -1.795
  404    HA   LEU  53           HA       LEU  53  -1.990  -0.197  -2.858
  405    HB2  LEU  53           HB2      LEU  53  -2.363   1.901  -4.168
  406    HB3  LEU  53           HB1      LEU  53  -0.706   2.394  -3.895
  407    HG   LEU  53           HG       LEU  53   0.044   0.356  -5.132
  408   HD11  LEU  53          HD11      LEU  53  -2.901   0.095  -5.706
  409   HD12  LEU  53          HD12      LEU  53  -1.883  -1.055  -4.840
  410   HD13  LEU  53          HD13      LEU  53  -1.627  -0.772  -6.563
  411   HD21  LEU  53          HD21      LEU  53  -0.021   2.486  -6.259
  412   HD22  LEU  53          HD22      LEU  53  -1.743   2.297  -6.590
  413   HD23  LEU  53          HD23      LEU  53  -0.575   1.227  -7.363
  414    H    LEU  54           HN       LEU  54   0.447   1.796  -1.185
  415    HA   LEU  54           HA       LEU  54   2.851   0.699  -2.112
  416    HB2  LEU  54           HB2      LEU  54   1.851   1.654   0.584
  417    HB3  LEU  54           HB1      LEU  54   3.403   0.859   0.514
  418    HG   LEU  54           HG       LEU  54   4.218   2.534  -1.070
  419   HD11  LEU  54          HD11      LEU  54   2.881   4.535  -1.540
  420   HD12  LEU  54          HD12      LEU  54   1.505   3.797  -0.724
  421   HD13  LEU  54          HD13      LEU  54   2.143   3.077  -2.202
  422   HD21  LEU  54          HD21      LEU  54   2.958   3.702   1.406
  423   HD22  LEU  54          HD22      LEU  54   4.255   4.441   0.471
  424   HD23  LEU  54          HD23      LEU  54   4.532   2.914   1.307
  425    H    GLY  55           HN       GLY  55   0.368  -0.808   0.009
  426    HA2  GLY  55           HA2      GLY  55   1.754  -2.891   1.199
  427    HA3  GLY  55           HA1      GLY  55   0.099  -3.014   0.640
  428    H    LEU  56           HN       LEU  56   0.391  -2.939  -2.117
  429    HA   LEU  56           HA       LEU  56   0.827  -5.565  -2.805
  430    HB2  LEU  56           HB2      LEU  56   1.536  -3.275  -4.621
  431    HB3  LEU  56           HB1      LEU  56   1.044  -4.891  -5.088
  432    HG   LEU  56           HG       LEU  56  -0.658  -2.715  -3.895
  433   HD11  LEU  56          HD11      LEU  56  -0.731  -4.269  -6.472
  434   HD12  LEU  56          HD12      LEU  56  -0.416  -2.547  -6.261
  435   HD13  LEU  56          HD13      LEU  56  -2.020  -3.199  -5.927
  436   HD21  LEU  56          HD21      LEU  56  -1.209  -5.661  -4.112
  437   HD22  LEU  56          HD22      LEU  56  -2.502  -4.463  -4.066
  438   HD23  LEU  56          HD23      LEU  56  -1.386  -4.610  -2.708
  439    H    ARG  57           HN       ARG  57   3.318  -2.990  -3.178
  440    HA   ARG  57           HA       ARG  57   5.350  -4.727  -4.093
  441    HB2  ARG  57           HB2      ARG  57   5.424  -2.081  -2.673
  442    HB3  ARG  57           HB1      ARG  57   6.904  -2.914  -3.132
  443    HG2  ARG  57           HG2      ARG  57   6.256  -2.866  -5.459
  444    HG3  ARG  57           HG1      ARG  57   4.706  -2.137  -5.040
  445    HD2  ARG  57           HD2      ARG  57   5.830  -0.155  -4.219
  446    HD3  ARG  57           HD1      ARG  57   7.401  -0.889  -4.520
  447    HE   ARG  57           HE       ARG  57   7.177  -0.491  -6.809
  448   HH11  ARG  57          HH11      ARG  57   4.185   0.335  -5.096
  449   HH12  ARG  57          HH12      ARG  57   3.521   1.203  -6.436
  450   HH21  ARG  57          HH21      ARG  57   6.259   0.658  -8.543
  451   HH22  ARG  57          HH22      ARG  57   4.697   1.390  -8.392
  452    H    TYR  58           HN       TYR  58   4.252  -4.019  -0.810
  453    HA   TYR  58           HA       TYR  58   6.471  -5.199   0.557
  454    HB2  TYR  58           HB2      TYR  58   4.901  -3.791   1.749
  455    HB3  TYR  58           HB1      TYR  58   3.572  -4.875   1.367
  456    HD1  TYR  58           HD2      TYR  58   6.615  -4.473   3.401
  457    HD2  TYR  58           HD1      TYR  58   3.174  -6.855   2.650
  458    HE1  TYR  58           HE2      TYR  58   7.018  -5.697   5.493
  459    HE2  TYR  58           HE1      TYR  58   3.565  -8.088   4.741
  460    HH   TYR  58           HH       TYR  58   5.548  -8.598   6.242
  461    H    LYS  59           HN       LYS  59   3.292  -6.482  -0.417
  462    HA   LYS  59           HA       LYS  59   3.892  -9.177   0.456
  463    HB2  LYS  59           HB2      LYS  59   1.691  -7.969  -1.203
  464    HB3  LYS  59           HB1      LYS  59   1.766  -9.683  -0.826
  465    HG2  LYS  59           HG2      LYS  59   1.755  -7.551   1.287
  466    HG3  LYS  59           HG1      LYS  59   0.283  -8.282   0.647
  467    HD2  LYS  59           HD2      LYS  59   0.956 -10.454   1.410
  468    HD3  LYS  59           HD1      LYS  59   2.551  -9.854   1.867
  469    HE2  LYS  59           HE2      LYS  59   1.581  -8.482   3.600
  470    HE3  LYS  59           HE1      LYS  59  -0.047  -8.937   3.097
  471    HZ1  LYS  59           HZ1      LYS  59   1.995 -10.828   4.137
  472    HZ2  LYS  59           HZ2      LYS  59   0.390 -11.196   3.751
  473    HZ3  LYS  59           HZ3      LYS  59   0.732 -10.172   5.052
  474    H    LYS  60           HN       LYS  60   4.888  -7.383  -2.237
  475    HA   LYS  60           HA       LYS  60   6.003  -7.973  -4.133
  476    HB2  LYS  60           HB2      LYS  60   5.960 -10.813  -3.091
  477    HB3  LYS  60           HB1      LYS  60   7.005 -10.182  -4.354
  478    HG2  LYS  60           HG2      LYS  60   7.031  -9.258  -1.490
  479    HG3  LYS  60           HG1      LYS  60   8.136 -10.447  -2.177
  480    HD2  LYS  60           HD2      LYS  60   9.013  -8.801  -3.717
  481    HD3  LYS  60           HD1      LYS  60   7.834  -7.611  -3.162
  482    HE2  LYS  60           HE2      LYS  60   9.894  -8.883  -1.371
  483    HE3  LYS  60           HE1      LYS  60  10.147  -7.358  -2.215
  484    HZ1  LYS  60           HZ1      LYS  60   8.019  -7.914  -0.215
  485    HZ2  LYS  60           HZ2      LYS  60   8.211  -6.456  -1.051
  486    HZ3  LYS  60           HZ3      LYS  60   9.401  -6.970   0.035
  487    H    LEU  61           HN       LEU  61   3.657  -7.402  -4.762
  488    HA   LEU  61           HA       LEU  61   2.970  -9.186  -6.905
  489    HB2  LEU  61           HB2      LEU  61   0.524  -9.451  -6.040
  490    HB3  LEU  61           HB1      LEU  61   1.767 -10.558  -5.497
  491    HG   LEU  61           HG       LEU  61   1.988  -9.276  -3.398
  492   HD11  LEU  61          HD11      LEU  61   1.264  -7.093  -4.295
  493   HD12  LEU  61          HD12      LEU  61   0.419  -7.549  -2.817
  494   HD13  LEU  61          HD13      LEU  61  -0.387  -7.704  -4.376
  495   HD21  LEU  61          HD21      LEU  61  -0.828 -10.150  -4.028
  496   HD22  LEU  61          HD22      LEU  61  -0.138  -9.963  -2.415
  497   HD23  LEU  61          HD23      LEU  61   0.491 -11.198  -3.506
  498    H    TYR  62           HN       TYR  62   3.618  -6.348  -6.436
  499    HA   TYR  62           HA       TYR  62   1.290  -4.748  -6.754
  500    HB2  TYR  62           HB2      TYR  62   3.414  -3.799  -6.085
  501    HB3  TYR  62           HB1      TYR  62   4.151  -4.276  -7.610
  502    HD1  TYR  62           HD1      TYR  62   1.513  -2.084  -6.168
  503    HD2  TYR  62           HD2      TYR  62   4.127  -2.820  -9.441
  504    HE1  TYR  62           HE1      TYR  62   0.904   0.090  -7.136
  505    HE2  TYR  62           HE2      TYR  62   3.529  -0.646 -10.417
  506    HH   TYR  62           HH       TYR  62   1.921   1.758  -8.712
  507    H    ASN  63           HN       ASN  63   2.823  -6.894  -8.975
  508    HA   ASN  63           HA       ASN  63   2.101  -5.488 -11.384
  509    HB2  ASN  63           HB2      ASN  63   3.915  -7.200 -11.207
  510    HB3  ASN  63           HB1      ASN  63   2.672  -8.437 -11.049
  511   HD21  ASN  63          HD21      ASN  63   1.427  -9.031 -12.816
  512   HD22  ASN  63          HD22      ASN  63   1.874  -8.536 -14.485
  513    H    GLN  64           HN       GLN  64   0.686  -8.429  -9.811
  514    HA   GLN  64           HA       GLN  64  -1.627  -8.104 -11.608
  515    HB2  GLN  64           HB2      GLN  64  -0.875 -10.341  -9.734
  516    HB3  GLN  64           HB1      GLN  64  -2.336 -10.328 -10.708
  517    HG2  GLN  64           HG2      GLN  64  -0.937 -10.213 -12.740
  518    HG3  GLN  64           HG1      GLN  64   0.496 -10.338 -11.721
  519   HE21  GLN  64          HE21      GLN  64   0.973 -12.272 -10.652
  520   HE22  GLN  64          HE22      GLN  64   0.203 -13.816 -11.159
  521    H    ALA  65           HN       ALA  65  -0.799  -7.457  -8.280
  522    HA   ALA  65           HA       ALA  65  -3.395  -7.841  -7.156
  523    HB1  ALA  65           HB1      ALA  65  -1.444  -7.664  -5.765
  524    HB2  ALA  65           HB2      ALA  65  -2.591  -6.396  -5.338
  525    HB3  ALA  65           HB3      ALA  65  -1.167  -6.009  -6.302
  526    H    ARG  66           HN       ARG  66  -1.867  -5.020  -8.705
  527    HA   ARG  66           HA       ARG  66  -4.006  -3.211  -8.073
  528    HB2  ARG  66           HB2      ARG  66  -1.708  -2.512  -8.661
  529    HB3  ARG  66           HB1      ARG  66  -1.978  -3.058 -10.310
  530    HG2  ARG  66           HG2      ARG  66  -3.612  -1.369 -10.685
  531    HG3  ARG  66           HG1      ARG  66  -3.634  -0.930  -8.978
  532    HD2  ARG  66           HD2      ARG  66  -1.488   0.024  -9.085
  533    HD3  ARG  66           HD1      ARG  66  -1.137  -0.732 -10.638
  534    HE   ARG  66           HE       ARG  66  -3.225   0.829 -11.309
  535   HH11  ARG  66          HH11      ARG  66  -0.323   1.542  -9.406
  536   HH12  ARG  66          HH12      ARG  66  -0.303   3.216  -9.845
  537   HH21  ARG  66          HH21      ARG  66  -3.154   3.038 -11.860
  538   HH22  ARG  66          HH22      ARG  66  -1.906   4.064 -11.237
  539    H    VAL  67           HN       VAL  67  -3.422  -5.432 -10.777
  540    HA   VAL  67           HA       VAL  67  -5.686  -4.328 -12.287
  541    HB   VAL  67           HB       VAL  67  -5.203  -6.079 -13.942
  542   HG11  VAL  67          HG11      VAL  67  -2.978  -5.281 -14.610
  543   HG12  VAL  67          HG12      VAL  67  -2.777  -4.550 -13.017
  544   HG13  VAL  67          HG13      VAL  67  -4.036  -3.963 -14.102
  545   HG21  VAL  67          HG21      VAL  67  -3.034  -6.934 -12.027
  546   HG22  VAL  67          HG22      VAL  67  -3.232  -7.523 -13.677
  547   HG23  VAL  67          HG23      VAL  67  -4.468  -7.863 -12.466
  548    H    LYS  68           HN       LYS  68  -4.947  -7.276 -10.420
  549    HA   LYS  68           HA       LYS  68  -7.404  -8.611 -11.064
  550    HB2  LYS  68           HB2      LYS  68  -5.482  -8.954  -8.761
  551    HB3  LYS  68           HB1      LYS  68  -6.847 -10.018  -9.058
  552    HG2  LYS  68           HG2      LYS  68  -4.591  -9.541 -10.996
  553    HG3  LYS  68           HG1      LYS  68  -4.700 -10.911  -9.888
  554    HD2  LYS  68           HD2      LYS  68  -6.829 -11.565 -10.959
  555    HD3  LYS  68           HD1      LYS  68  -6.639 -10.233 -12.100
  556    HE2  LYS  68           HE2      LYS  68  -4.706 -12.524 -11.756
  557    HE3  LYS  68           HE1      LYS  68  -5.912 -12.394 -13.036
  558    HZ1  LYS  68           HZ1      LYS  68  -3.635 -10.537 -12.586
  559    HZ2  LYS  68           HZ2      LYS  68  -4.813 -10.359 -13.786
  560    HZ3  LYS  68           HZ3      LYS  68  -3.760 -11.682 -13.825
  561    H    TYR  69           HN       TYR  69  -6.411  -6.517  -8.363
  562    HA   TYR  69           HA       TYR  69  -9.206  -6.636  -7.352
  563    HB2  TYR  69           HB2      TYR  69  -6.643  -5.757  -6.014
  564    HB3  TYR  69           HB1      TYR  69  -8.236  -5.644  -5.277
  565    HD1  TYR  69           HD1      TYR  69  -5.667  -7.994  -6.503
  566    HD2  TYR  69           HD2      TYR  69  -9.280  -7.544  -4.306
  567    HE1  TYR  69           HE1      TYR  69  -5.437 -10.295  -5.665
  568    HE2  TYR  69           HE2      TYR  69  -9.060  -9.840  -3.464
  569    HH   TYR  69           HH       TYR  69  -7.935 -11.966  -4.158
  570    H    SER  70           HN       SER  70 -10.147  -4.628  -6.482
  571    HA   SER  70           HA       SER  70  -9.737  -2.480  -8.428
  572    HB2  SER  70           HB2      SER  70 -12.012  -3.204  -7.735
  573    HB3  SER  70           HB1      SER  70 -11.675  -2.612  -6.108
  574    HG   SER  70           HG       SER  70 -12.749  -1.011  -7.233
  575    H    LEU  71           HN       LEU  71  -7.732  -1.612  -7.974
  576    HA   LEU  71           HA       LEU  71  -7.601  -0.114  -5.394
  577    HB2  LEU  71           HB2      LEU  71  -5.381  -1.316  -7.053
  578    HB3  LEU  71           HB1      LEU  71  -5.098  -0.162  -5.765
  579    HG   LEU  71           HG       LEU  71  -6.257  -1.808  -4.211
  580   HD11  LEU  71          HD11      LEU  71  -7.405  -3.202  -5.755
  581   HD12  LEU  71          HD12      LEU  71  -6.151  -4.181  -4.996
  582   HD13  LEU  71          HD13      LEU  71  -5.917  -3.562  -6.630
  583   HD21  LEU  71          HD21      LEU  71  -4.246  -3.190  -3.972
  584   HD22  LEU  71          HD22      LEU  71  -3.850  -1.488  -4.208
  585   HD23  LEU  71          HD23      LEU  71  -3.680  -2.625  -5.544
  586    H    LEU  72           HN       LEU  72  -5.985  -0.044  -8.589
  587    HA   LEU  72           HA       LEU  72  -6.834   2.799  -8.854
  588    HB2  LEU  72           HB2      LEU  72  -4.090   1.635  -9.276
  589    HB3  LEU  72           HB1      LEU  72  -4.579   3.146 -10.012
  590    HG   LEU  72           HG       LEU  72  -3.332   3.686  -8.067
  591   HD11  LEU  72          HD11      LEU  72  -5.319   5.056  -8.437
  592   HD12  LEU  72          HD12      LEU  72  -4.937   4.919  -6.720
  593   HD13  LEU  72          HD13      LEU  72  -6.258   3.976  -7.408
  594   HD21  LEU  72          HD21      LEU  72  -3.595   2.757  -5.943
  595   HD22  LEU  72          HD22      LEU  72  -3.732   1.378  -7.035
  596   HD23  LEU  72          HD23      LEU  72  -5.180   2.091  -6.328
  597    H    GLU  73           HN       GLU  73  -5.241   0.103 -10.598
  598    HA   GLU  73           HA       GLU  73  -7.234   0.408 -12.756
  599    HB2  GLU  73           HB2      GLU  73  -4.250   0.487 -13.251
  600    HB3  GLU  73           HB1      GLU  73  -5.485   0.395 -14.498
  601    HG2  GLU  73           HG2      GLU  73  -6.361   2.575 -13.741
  602    HG3  GLU  73           HG1      GLU  73  -5.042   2.666 -12.575
  Start of MODEL    8
    1    H1   SER   1           HT1      SER   1   0.700  15.689  10.029
    2    H2   SER   1           HT2      SER   1  -0.937  16.110  10.061
    3    H3   SER   1           HT3      SER   1   0.040  16.616   8.777
    4    HA   SER   1           HA       SER   1  -0.655  13.811   9.423
    5    HB2  SER   1           HB2      SER   1  -1.946  13.903   7.292
    6    HB3  SER   1           HB1      SER   1  -2.584  14.986   8.528
    7    HG   SER   1           HG       SER   1  -1.447  15.564   6.089
    8    H    ASP   2           HN       ASP   2   0.529  12.267   8.500
    9    HA   ASP   2           HA       ASP   2   2.126  12.864   6.110
   10    HB2  ASP   2           HB2      ASP   2   3.524  13.575   8.102
   11    HB3  ASP   2           HB1      ASP   2   3.525  11.890   8.611
   12    H    VAL   3           HN       VAL   3   3.000  10.953   5.087
   13    HA   VAL   3           HA       VAL   3   1.245   8.736   5.244
   14    HB   VAL   3           HB       VAL   3   2.697   9.392   3.284
   15   HG11  VAL   3          HG11      VAL   3   4.806   7.807   4.741
   16   HG12  VAL   3          HG12      VAL   3   4.819   9.557   4.531
   17   HG13  VAL   3          HG13      VAL   3   4.932   8.500   3.124
   18   HG21  VAL   3          HG21      VAL   3   3.017   7.043   2.535
   19   HG22  VAL   3          HG22      VAL   3   1.422   7.362   3.215
   20   HG23  VAL   3          HG23      VAL   3   2.634   6.513   4.173
   21    H    TRP   4           HN       TRP   4   4.402   9.317   6.776
   22    HA   TRP   4           HA       TRP   4   4.465   6.601   7.829
   23    HB2  TRP   4           HB2      TRP   4   6.409   8.479   7.280
   24    HB3  TRP   4           HB1      TRP   4   6.329   8.495   9.037
   25    HD1  TRP   4           HD1      TRP   4   6.040   5.531   9.792
   26    HE1  TRP   4           HE1      TRP   4   7.880   3.776   9.272
   27    HE3  TRP   4           HE3      TRP   4   8.407   8.025   6.006
   28    HZ2  TRP   4           HZ2      TRP   4  10.042   3.547   7.464
   29    HZ3  TRP   4           HZ3      TRP   4  10.354   6.969   4.937
   30    HH2  TRP   4           HH2      TRP   4  11.154   4.775   5.652
   31    H    SER   5           HN       SER   5   3.941   9.898   9.089
   32    HA   SER   5           HA       SER   5   3.665   9.169  11.821
   33    HB2  SER   5           HB2      SER   5   3.873  11.506  11.057
   34    HB3  SER   5           HB1      SER   5   2.279  11.407  10.311
   35    HG   SER   5           HG       SER   5   1.574  12.025  12.186
   36    H    LEU   6           HN       LEU   6   1.182   9.614   9.278
   37    HA   LEU   6           HA       LEU   6  -0.778   8.232  11.022
   38    HB2  LEU   6           HB2      LEU   6  -1.196   9.619   8.370
   39    HB3  LEU   6           HB1      LEU   6  -2.453   9.008   9.428
   40    HG   LEU   6           HG       LEU   6  -0.585  11.303  10.032
   41   HD11  LEU   6          HD11      LEU   6  -2.620  12.661   9.921
   42   HD12  LEU   6          HD12      LEU   6  -3.539  11.236   9.437
   43   HD13  LEU   6          HD13      LEU   6  -2.274  11.869   8.383
   44   HD21  LEU   6          HD21      LEU   6  -2.827  10.118  11.667
   45   HD22  LEU   6          HD22      LEU   6  -1.983  11.623  12.034
   46   HD23  LEU   6          HD23      LEU   6  -1.108  10.093  12.064
   47    H    SER   7           HN       SER   7  -0.009   6.122  10.883
   48    HA   SER   7           HA       SER   7  -0.315   4.896   8.174
   49    HB2  SER   7           HB2      SER   7   1.599   4.173  10.399
   50    HB3  SER   7           HB1      SER   7   1.340   3.186   8.963
   51    HG   SER   7           HG       SER   7   2.938   4.413   8.278
   52    H    LYS   8           HN       LYS   8  -2.102   5.246  10.776
   53    HA   LYS   8           HA       LYS   8  -2.791   2.364  11.009
   54    HB2  LYS   8           HB2      LYS   8  -3.590   4.704  12.746
   55    HB3  LYS   8           HB1      LYS   8  -4.047   3.032  13.022
   56    HG2  LYS   8           HG2      LYS   8  -1.308   4.253  13.202
   57    HG3  LYS   8           HG1      LYS   8  -2.256   3.506  14.489
   58    HD2  LYS   8           HD2      LYS   8  -1.121   2.074  12.083
   59    HD3  LYS   8           HD1      LYS   8  -0.438   2.046  13.709
   60    HE2  LYS   8           HE2      LYS   8  -2.439   0.966  14.560
   61    HE3  LYS   8           HE1      LYS   8  -3.195   1.066  12.970
   62    HZ1  LYS   8           HZ1      LYS   8  -2.287  -1.134  13.392
   63    HZ2  LYS   8           HZ2      LYS   8  -0.742  -0.483  13.618
   64    HZ3  LYS   8           HZ3      LYS   8  -1.483  -0.397  12.099
   65    H    THR   9           HN       THR   9  -3.487   4.013   8.672
   66    HA   THR   9           HA       THR   9  -6.459   3.982   8.948
   67    HB   THR   9           HB       THR   9  -6.495   5.516   6.987
   68    HG1  THR   9           HG1      THR   9  -3.689   5.777   7.426
   69   HG21  THR   9          HG21      THR   9  -5.773   7.522   8.197
   70   HG22  THR   9          HG22      THR   9  -4.892   6.515   9.346
   71   HG23  THR   9          HG23      THR   9  -6.650   6.418   9.255
   72    H    SER  10           HN       SER  10  -7.065   1.979   8.328
   73    HA   SER  10           HA       SER  10  -5.727   0.665   6.082
   74    HB2  SER  10           HB2      SER  10  -7.320  -1.185   6.547
   75    HB3  SER  10           HB1      SER  10  -6.417  -0.688   7.976
   76    HG   SER  10           HG       SER  10  -8.357  -0.575   8.805
   77    H    MET  11           HN       MET  11  -6.988  -0.378   4.331
   78    HA   MET  11           HA       MET  11  -9.317   1.267   3.486
   79    HB2  MET  11           HB2      MET  11  -7.231   2.091   2.376
   80    HB3  MET  11           HB1      MET  11  -7.028   0.495   1.667
   81    HG2  MET  11           HG2      MET  11  -8.001   1.958   0.044
   82    HG3  MET  11           HG1      MET  11  -9.199   0.759   0.529
   83    HE1  MET  11           HE1      MET  11  -8.039   4.479   0.758
   84    HE2  MET  11           HE2      MET  11  -8.022   4.017   2.460
   85    HE3  MET  11           HE3      MET  11  -9.214   5.176   1.873
   86    H    THR  12           HN       THR  12 -10.852   0.209   2.202
   87    HA   THR  12           HA       THR  12 -10.660  -2.732   2.405
   88    HB   THR  12           HB       THR  12 -13.019  -1.011   1.616
   89    HG1  THR  12           HG1      THR  12 -13.221  -0.729   3.698
   90   HG21  THR  12          HG21      THR  12 -13.226  -3.268   0.738
   91   HG22  THR  12          HG22      THR  12 -14.336  -3.052   2.090
   92   HG23  THR  12          HG23      THR  12 -12.833  -3.946   2.318
   93    H    PHE  13           HN       PHE  13 -10.173  -4.014   0.789
   94    HA   PHE  13           HA       PHE  13 -10.079  -2.912  -1.957
   95    HB2  PHE  13           HB2      PHE  13  -9.000  -5.443  -0.712
   96    HB3  PHE  13           HB1      PHE  13  -8.906  -5.100  -2.434
   97    HD1  PHE  13           HD1      PHE  13  -7.961  -3.671   0.871
   98    HD2  PHE  13           HD2      PHE  13  -7.069  -3.987  -3.278
   99    HE1  PHE  13           HE1      PHE  13  -5.852  -2.464   1.236
  100    HE2  PHE  13           HE2      PHE  13  -4.958  -2.778  -2.918
  101    HZ   PHE  13           HZ       PHE  13  -4.346  -2.016  -0.659
  102    H    GLN  14           HN       GLN  14 -11.207  -3.729  -3.688
  103    HA   GLN  14           HA       GLN  14 -13.315  -5.710  -2.964
  104    HB2  GLN  14           HB2      GLN  14 -14.287  -3.500  -3.329
  105    HB3  GLN  14           HB1      GLN  14 -13.505  -3.394  -4.899
  106    HG2  GLN  14           HG2      GLN  14 -15.905  -3.961  -5.021
  107    HG3  GLN  14           HG1      GLN  14 -14.857  -5.161  -5.771
  108   HE21  GLN  14          HE21      GLN  14 -15.398  -4.754  -2.288
  109   HE22  GLN  14          HE22      GLN  14 -16.227  -6.333  -2.068
  110    HA   PRO  15           HA       PRO  15 -11.020  -8.104  -6.010
  111    HB2  PRO  15           HB2      PRO  15 -13.248  -9.996  -5.554
  112    HB3  PRO  15           HB1      PRO  15 -11.507 -10.245  -5.406
  113    HG2  PRO  15           HG2      PRO  15 -13.085 -10.074  -3.251
  114    HG3  PRO  15           HG1      PRO  15 -11.434  -9.430  -3.254
  115    HD2  PRO  15           HD2      PRO  15 -14.035  -7.985  -3.480
  116    HD3  PRO  15           HD1      PRO  15 -12.550  -7.509  -2.635
  117    H    LYS  16           HN       LYS  16 -11.280  -8.639  -8.169
  118    HA   LYS  16           HA       LYS  16 -13.505  -7.318  -9.494
  119    HB2  LYS  16           HB2      LYS  16 -11.245  -9.012 -10.578
  120    HB3  LYS  16           HB1      LYS  16 -12.406  -8.152 -11.575
  121    HG2  LYS  16           HG2      LYS  16 -10.396  -6.947  -9.689
  122    HG3  LYS  16           HG1      LYS  16 -10.385  -6.874 -11.451
  123    HD2  LYS  16           HD2      LYS  16 -12.448  -5.567 -11.416
  124    HD3  LYS  16           HD1      LYS  16 -12.491  -5.666  -9.654
  125    HE2  LYS  16           HE2      LYS  16 -10.271  -4.518  -9.617
  126    HE3  LYS  16           HE1      LYS  16 -10.424  -4.282 -11.356
  127    HZ1  LYS  16           HZ1      LYS  16 -12.297  -3.239  -9.300
  128    HZ2  LYS  16           HZ2      LYS  16 -12.444  -3.011 -10.970
  129    HZ3  LYS  16           HZ3      LYS  16 -11.141  -2.329 -10.135
  130    H    LYS  17           HN       LYS  17 -12.509 -10.677  -8.872
  131    HA   LYS  17           HA       LYS  17 -15.126 -11.550 -10.007
  132    HB2  LYS  17           HB2      LYS  17 -14.000 -13.818 -10.208
  133    HB3  LYS  17           HB1      LYS  17 -13.457 -12.574 -11.321
  134    HG2  LYS  17           HG2      LYS  17 -11.957 -12.879  -8.783
  135    HG3  LYS  17           HG1      LYS  17 -11.778 -14.143  -9.998
  136    HD2  LYS  17           HD2      LYS  17 -11.350 -11.197 -10.494
  137    HD3  LYS  17           HD1      LYS  17 -10.067 -12.368 -10.192
  138    HE2  LYS  17           HE2      LYS  17 -10.766 -13.622 -12.190
  139    HE3  LYS  17           HE1      LYS  17 -12.011 -12.413 -12.499
  140    HZ1  LYS  17           HZ1      LYS  17 -10.257 -10.745 -12.720
  141    HZ2  LYS  17           HZ2      LYS  17 -10.069 -11.992 -13.845
  142    HZ3  LYS  17           HZ3      LYS  17  -9.079 -11.935 -12.476
  143    H    ALA  18           HN       ALA  18 -16.110 -13.474  -9.007
  144    HA   ALA  18           HA       ALA  18 -16.452 -13.073  -6.214
  145    HB1  ALA  18           HB1      ALA  18 -17.159 -15.503  -7.856
  146    HB2  ALA  18           HB2      ALA  18 -18.155 -14.060  -7.668
  147    HB3  ALA  18           HB3      ALA  18 -17.817 -15.086  -6.274
  148    H    SER  19           HN       SER  19 -14.439 -15.384  -8.025
  149    HA   SER  19           HA       SER  19 -13.747 -17.124  -5.942
  150    HB2  SER  19           HB2      SER  19 -11.671 -17.563  -7.214
  151    HB3  SER  19           HB1      SER  19 -13.087 -17.516  -8.261
  152    HG   SER  19           HG       SER  19 -10.931 -16.184  -8.629
  153    H    LEU  20           HN       LEU  20 -12.364 -13.944  -6.746
  154    HA   LEU  20           HA       LEU  20 -10.320 -14.112  -4.699
  155    HB2  LEU  20           HB2      LEU  20 -11.411 -11.770  -6.253
  156    HB3  LEU  20           HB1      LEU  20 -10.006 -11.704  -5.216
  157    HG   LEU  20           HG       LEU  20 -10.218 -13.462  -7.658
  158   HD11  LEU  20          HD11      LEU  20  -8.787 -11.844  -8.762
  159   HD12  LEU  20          HD12      LEU  20  -8.817 -10.813  -7.332
  160   HD13  LEU  20          HD13      LEU  20 -10.296 -11.085  -8.254
  161   HD21  LEU  20          HD21      LEU  20  -7.871 -12.699  -5.921
  162   HD22  LEU  20          HD22      LEU  20  -7.789 -13.657  -7.400
  163   HD23  LEU  20          HD23      LEU  20  -8.645 -14.282  -5.990
  164    H    GLN  21           HN       GLN  21 -10.147 -12.834  -2.792
  165    HA   GLN  21           HA       GLN  21 -12.808 -12.099  -1.662
  166    HB2  GLN  21           HB2      GLN  21 -11.912 -12.708   0.546
  167    HB3  GLN  21           HB1      GLN  21 -11.906 -14.071  -0.562
  168    HG2  GLN  21           HG2      GLN  21  -9.557 -13.920  -0.869
  169    HG3  GLN  21           HG1      GLN  21  -9.485 -12.366  -0.044
  170   HE21  GLN  21          HE21      GLN  21 -11.393 -15.144   1.038
  171   HE22  GLN  21          HE22      GLN  21 -10.417 -15.450   2.516
  172    HA   PRO  22           HA       PRO  22 -11.462  -7.926  -1.134
  173    HB2  PRO  22           HB2      PRO  22 -12.887  -8.050   1.475
  174    HB3  PRO  22           HB1      PRO  22 -13.094  -6.923   0.130
  175    HG2  PRO  22           HG2      PRO  22 -14.889  -8.829   0.564
  176    HG3  PRO  22           HG1      PRO  22 -14.400  -8.412  -1.088
  177    HD2  PRO  22           HD2      PRO  22 -13.571 -10.742   0.602
  178    HD3  PRO  22           HD1      PRO  22 -13.964 -10.689  -1.129
  179    H    LEU  23           HN       LEU  23 -10.353  -6.450   0.392
  180    HA   LEU  23           HA       LEU  23  -8.797  -7.876   2.478
  181    HB2  LEU  23           HB2      LEU  23  -7.576  -7.809   0.247
  182    HB3  LEU  23           HB1      LEU  23  -7.477  -6.076   0.460
  183    HG   LEU  23           HG       LEU  23  -6.449  -7.802   2.658
  184   HD11  LEU  23          HD11      LEU  23  -5.542  -8.862   0.660
  185   HD12  LEU  23          HD12      LEU  23  -4.282  -8.007   1.548
  186   HD13  LEU  23          HD13      LEU  23  -4.962  -7.300   0.083
  187   HD21  LEU  23          HD21      LEU  23  -4.813  -5.982   2.829
  188   HD22  LEU  23          HD22      LEU  23  -6.468  -5.381   2.915
  189   HD23  LEU  23          HD23      LEU  23  -5.541  -5.202   1.426
  190    H    THR  24           HN       THR  24  -8.037  -6.605   4.172
  191    HA   THR  24           HA       THR  24  -8.640  -3.703   4.039
  192    HB   THR  24           HB       THR  24  -9.628  -5.395   6.346
  193    HG1  THR  24           HG1      THR  24 -11.186  -5.840   4.956
  194   HG21  THR  24          HG21      THR  24 -10.066  -2.498   5.601
  195   HG22  THR  24          HG22      THR  24  -9.096  -3.095   6.947
  196   HG23  THR  24          HG23      THR  24 -10.842  -3.333   6.946
  197    H    ILE  25           HN       ILE  25  -6.412  -3.361   4.012
  198    HA   ILE  25           HA       ILE  25  -5.117  -3.873   6.649
  199    HB   ILE  25           HB       ILE  25  -4.314  -5.414   4.802
  200   HG12  ILE  25          HG12      ILE  25  -1.887  -5.046   5.381
  201   HG13  ILE  25          HG11      ILE  25  -2.373  -3.577   6.212
  202   HG21  ILE  25          HG21      ILE  25  -2.858  -4.577   3.110
  203   HG22  ILE  25          HG22      ILE  25  -2.920  -2.948   3.780
  204   HG23  ILE  25          HG23      ILE  25  -4.356  -3.651   3.033
  205   HD11  ILE  25          HD11      ILE  25  -3.713  -4.851   7.759
  206   HD12  ILE  25          HD12      ILE  25  -2.067  -5.484   7.725
  207   HD13  ILE  25          HD13      ILE  25  -3.357  -6.338   6.881
  208    H    SER  26           HN       SER  26  -3.417  -2.415   7.254
  209    HA   SER  26           HA       SER  26  -3.663   0.234   5.897
  210    HB2  SER  26           HB2      SER  26  -4.694   0.212   8.131
  211    HB3  SER  26           HB1      SER  26  -3.181  -0.361   8.829
  212    HG   SER  26           HG       SER  26  -3.427   2.075   7.402
  213    H    LEU  27           HN       LEU  27  -1.798   1.720   6.351
  214    HA   LEU  27           HA       LEU  27   0.608   0.805   5.289
  215    HB2  LEU  27           HB2      LEU  27   0.269   3.028   7.285
  216    HB3  LEU  27           HB1      LEU  27   1.608   2.832   6.172
  217    HG   LEU  27           HG       LEU  27  -1.257   3.449   5.440
  218   HD11  LEU  27          HD11      LEU  27   1.261   5.091   5.230
  219   HD12  LEU  27          HD12      LEU  27  -0.054   5.344   6.376
  220   HD13  LEU  27          HD13      LEU  27  -0.334   5.568   4.650
  221   HD21  LEU  27          HD21      LEU  27  -0.208   1.979   3.780
  222   HD22  LEU  27          HD22      LEU  27   1.140   3.107   3.641
  223   HD23  LEU  27          HD23      LEU  27  -0.478   3.602   3.144
  224    H    ASP  28           HN       ASP  28   0.175   1.611   8.748
  225    HA   ASP  28           HA       ASP  28   2.645   0.455   9.561
  226    HB2  ASP  28           HB2      ASP  28   1.370   2.129  10.865
  227    HB3  ASP  28           HB1      ASP  28   0.152   0.908  11.212
  228    H    GLU  29           HN       GLU  29  -0.629  -0.877   9.307
  229    HA   GLU  29           HA       GLU  29   0.048  -3.327  10.689
  230    HB2  GLU  29           HB2      GLU  29  -2.253  -2.288  10.483
  231    HB3  GLU  29           HB1      GLU  29  -2.276  -2.864   8.823
  232    HG2  GLU  29           HG2      GLU  29  -3.486  -4.372  10.273
  233    HG3  GLU  29           HG1      GLU  29  -2.058  -5.163   9.613
  234    H    LEU  30           HN       LEU  30   0.814  -2.187   7.562
  235    HA   LEU  30           HA       LEU  30   1.131  -5.012   6.677
  236    HB2  LEU  30           HB2      LEU  30  -0.562  -3.680   5.399
  237    HB3  LEU  30           HB1      LEU  30   0.726  -2.610   4.889
  238    HG   LEU  30           HG       LEU  30   1.809  -4.461   3.698
  239   HD11  LEU  30          HD11      LEU  30   0.576  -6.582   3.400
  240   HD12  LEU  30          HD12      LEU  30  -0.563  -6.062   4.640
  241   HD13  LEU  30          HD13      LEU  30   1.129  -6.328   5.055
  242   HD21  LEU  30          HD21      LEU  30  -1.102  -4.160   2.985
  243   HD22  LEU  30          HD22      LEU  30   0.193  -4.676   1.905
  244   HD23  LEU  30          HD23      LEU  30   0.181  -3.034   2.548
  245    H    PHE  31           HN       PHE  31   2.952  -2.721   7.958
  246    HA   PHE  31           HA       PHE  31   5.207  -3.569   6.275
  247    HB2  PHE  31           HB2      PHE  31   4.911  -0.694   7.191
  248    HB3  PHE  31           HB1      PHE  31   6.273  -1.342   6.287
  249    HD1  PHE  31           HD1      PHE  31   5.215  -2.811   4.123
  250    HD2  PHE  31           HD2      PHE  31   3.651   0.719   5.915
  251    HE1  PHE  31           HE1      PHE  31   4.071  -2.250   2.018
  252    HE2  PHE  31           HE2      PHE  31   2.503   1.281   3.814
  253    HZ   PHE  31           HZ       PHE  31   2.711  -0.207   1.864
  254    H    SER  32           HN       SER  32   7.166  -3.961   7.327
  255    HA   SER  32           HA       SER  32   7.147  -3.445  10.249
  256    HB2  SER  32           HB2      SER  32   6.439  -5.780   9.713
  257    HB3  SER  32           HB1      SER  32   8.034  -6.042   9.010
  258    HG   SER  32           HG       SER  32   7.311  -5.637  11.695
  259    H    SER  33           HN       SER  33   8.547  -2.026   8.068
  260    HA   SER  33           HA       SER  33  11.214  -2.096   9.178
  261    HB2  SER  33           HB2      SER  33  11.500  -4.024   7.755
  262    HB3  SER  33           HB1      SER  33  10.812  -3.163   6.381
  263    HG   SER  33           HG       SER  33  12.966  -2.985   6.106
  264    H    ARG  34           HN       ARG  34  12.377  -0.254   8.807
  265    HA   ARG  34           HA       ARG  34  10.925   1.990   7.779
  266    HB2  ARG  34           HB2      ARG  34  12.737   2.057   9.526
  267    HB3  ARG  34           HB1      ARG  34  13.908   1.809   8.239
  268    HG2  ARG  34           HG2      ARG  34  13.363   3.899   7.233
  269    HG3  ARG  34           HG1      ARG  34  11.979   4.118   8.306
  270    HD2  ARG  34           HD2      ARG  34  13.792   5.498   9.074
  271    HD3  ARG  34           HD1      ARG  34  13.537   4.191  10.229
  272    HE   ARG  34           HE       ARG  34  15.551   3.542   8.253
  273   HH11  ARG  34          HH11      ARG  34  14.970   5.257  11.297
  274   HH12  ARG  34          HH12      ARG  34  16.621   5.156  11.807
  275   HH21  ARG  34          HH21      ARG  34  17.712   3.432   8.964
  276   HH22  ARG  34          HH22      ARG  34  18.178   4.121  10.483
  277    H    GLY  35           HN       GLY  35  13.852   0.306   6.546
  278    HA2  GLY  35           HA2      GLY  35  14.002   1.734   4.099
  279    HA3  GLY  35           HA1      GLY  35  14.648   0.124   4.381
  280    H    GLU  36           HN       GLU  36  12.125  -1.119   5.029
  281    HA   GLU  36           HA       GLU  36  11.267  -1.902   2.442
  282    HB2  GLU  36           HB2      GLU  36  10.951  -3.278   4.438
  283    HB3  GLU  36           HB1      GLU  36   9.852  -2.084   5.110
  284    HG2  GLU  36           HG2      GLU  36   8.296  -2.510   3.250
  285    HG3  GLU  36           HG1      GLU  36   9.387  -3.765   2.658
  286    H    PHE  37           HN       PHE  37   9.915   0.395   4.800
  287    HA   PHE  37           HA       PHE  37   7.578   1.115   3.391
  288    HB2  PHE  37           HB2      PHE  37   8.242   1.739   5.758
  289    HB3  PHE  37           HB1      PHE  37   9.278   2.978   5.062
  290    HD1  PHE  37           HD1      PHE  37   8.296   4.910   3.911
  291    HD2  PHE  37           HD2      PHE  37   5.881   2.004   5.867
  292    HE1  PHE  37           HE1      PHE  37   6.401   6.477   3.890
  293    HE2  PHE  37           HE2      PHE  37   3.980   3.565   5.848
  294    HZ   PHE  37           HZ       PHE  37   4.239   5.804   4.859
  295    H    ILE  38           HN       ILE  38  10.908   2.380   3.192
  296    HA   ILE  38           HA       ILE  38  10.457   4.484   1.391
  297    HB   ILE  38           HB       ILE  38  12.873   2.680   1.589
  298   HG12  ILE  38          HG12      ILE  38  12.388   3.732   3.710
  299   HG13  ILE  38          HG11      ILE  38  13.767   4.548   2.985
  300   HG21  ILE  38          HG21      ILE  38  12.558   5.398   0.320
  301   HG22  ILE  38          HG22      ILE  38  12.916   3.882  -0.506
  302   HG23  ILE  38          HG23      ILE  38  14.097   4.583   0.600
  303   HD11  ILE  38          HD11      ILE  38  10.924   5.540   3.014
  304   HD12  ILE  38          HD12      ILE  38  12.284   6.355   2.241
  305   HD13  ILE  38          HD13      ILE  38  12.261   6.146   3.993
  306    H    SER  39           HN       SER  39  11.389   1.073   0.624
  307    HA   SER  39           HA       SER  39  11.425   1.408  -2.181
  308    HB2  SER  39           HB2      SER  39  12.284  -0.608  -1.040
  309    HB3  SER  39           HB1      SER  39  10.644  -1.084  -0.609
  310    HG   SER  39           HG       SER  39  10.575  -2.024  -2.476
  311    H    VAL  40           HN       VAL  40   8.765  -0.233  -0.339
  312    HA   VAL  40           HA       VAL  40   6.872  -0.512  -2.163
  313    HB   VAL  40           HB       VAL  40   5.106   0.017  -0.507
  314   HG11  VAL  40          HG11      VAL  40   7.441  -1.543   0.591
  315   HG12  VAL  40          HG12      VAL  40   6.241  -2.156  -0.545
  316   HG13  VAL  40          HG13      VAL  40   5.756  -1.697   1.086
  317   HG21  VAL  40          HG21      VAL  40   7.389   0.846   1.275
  318   HG22  VAL  40          HG22      VAL  40   5.682   0.766   1.708
  319   HG23  VAL  40          HG23      VAL  40   6.238   1.957   0.533
  320    H    GLY  41           HN       GLY  41   7.688   2.782  -0.929
  321    HA2  GLY  41           HA2      GLY  41   7.344   4.424  -2.823
  322    HA3  GLY  41           HA1      GLY  41   5.706   3.794  -2.912
  323    H    GLY  42           HN       GLY  42   7.702   4.506  -0.024
  324    HA2  GLY  42           HA2      GLY  42   5.609   6.505   0.721
  325    HA3  GLY  42           HA1      GLY  42   6.338   5.408   1.874
  326    H    ASP  43           HN       ASP  43   6.643   8.340   0.076
  327    HA   ASP  43           HA       ASP  43   9.335   8.901   1.113
  328    HB2  ASP  43           HB2      ASP  43   7.350  10.611  -0.410
  329    HB3  ASP  43           HB1      ASP  43   8.957  11.156   0.060
  330    H    GLY  44           HN       GLY  44   6.390  10.956   1.276
  331    HA2  GLY  44           HA2      GLY  44   6.382  10.870   4.194
  332    HA3  GLY  44           HA1      GLY  44   7.022  12.372   3.548
  333    H    ARG  45           HN       ARG  45   5.617  13.388   1.770
  334    HA   ARG  45           HA       ARG  45   2.924  13.593   2.926
  335    HB2  ARG  45           HB2      ARG  45   4.027  15.104   0.555
  336    HB3  ARG  45           HB1      ARG  45   2.663  15.548   1.571
  337    HG2  ARG  45           HG2      ARG  45   5.546  15.455   2.440
  338    HG3  ARG  45           HG1      ARG  45   4.627  16.907   2.048
  339    HD2  ARG  45           HD2      ARG  45   3.090  16.437   3.888
  340    HD3  ARG  45           HD1      ARG  45   3.987  14.968   4.269
  341    HE   ARG  45           HE       ARG  45   5.680  17.309   4.282
  342   HH11  ARG  45          HH11      ARG  45   3.331  15.479   6.198
  343   HH12  ARG  45          HH12      ARG  45   3.943  16.052   7.713
  344   HH21  ARG  45          HH21      ARG  45   6.453  18.035   6.294
  345   HH22  ARG  45          HH22      ARG  45   5.715  17.502   7.768
  346    H    MET  46           HN       MET  46   1.951  11.631   2.395
  347    HA   MET  46           HA       MET  46   1.804  10.880  -0.442
  348    HB2  MET  46           HB2      MET  46   1.969   9.321   1.662
  349    HB3  MET  46           HB1      MET  46   0.225   9.535   1.717
  350    HG2  MET  46           HG2      MET  46   0.026   7.908   0.239
  351    HG3  MET  46           HG1      MET  46   0.845   8.923  -0.945
  352    HE1  MET  46           HE1      MET  46   4.576   7.852  -0.535
  353    HE2  MET  46           HE2      MET  46   3.762   9.184   0.283
  354    HE3  MET  46           HE3      MET  46   3.438   8.866  -1.421
  355    H    SER  47           HN       SER  47  -0.399  10.215  -1.327
  356    HA   SER  47           HA       SER  47  -2.164  12.542  -0.972
  357    HB2  SER  47           HB2      SER  47  -1.963  10.357  -3.028
  358    HB3  SER  47           HB1      SER  47  -3.357  11.433  -2.967
  359    HG   SER  47           HG       SER  47  -0.674  12.017  -3.561
  360    H    HIS  48           HN       HIS  48  -3.023   9.162  -1.675
  361    HA   HIS  48           HA       HIS  48  -4.540   8.634   0.711
  362    HB2  HIS  48           HB2      HIS  48  -6.001  10.406  -0.102
  363    HB3  HIS  48           HB1      HIS  48  -6.078   9.637  -1.681
  364    HD1  HIS  48           HD1      HIS  48  -7.541   9.581   1.736
  365    HD2  HIS  48           HD2      HIS  48  -7.652   7.247  -1.746
  366    HE1  HIS  48           HE1      HIS  48  -9.503   7.994   1.998
  367    HE2  HIS  48           HE2      HIS  48  -9.609   6.621  -0.139
  368    H    LYS  49           HN       LYS  49  -5.131   8.117  -2.805
  369    HA   LYS  49           HA       LYS  49  -5.487   5.296  -2.412
  370    HB2  LYS  49           HB2      LYS  49  -5.146   7.112  -4.766
  371    HB3  LYS  49           HB1      LYS  49  -5.014   5.378  -5.003
  372    HG2  LYS  49           HG2      LYS  49  -7.379   6.776  -3.776
  373    HG3  LYS  49           HG1      LYS  49  -7.272   6.242  -5.455
  374    HD2  LYS  49           HD2      LYS  49  -7.038   3.931  -4.722
  375    HD3  LYS  49           HD1      LYS  49  -7.076   4.446  -3.035
  376    HE2  LYS  49           HE2      LYS  49  -9.245   3.621  -3.613
  377    HE3  LYS  49           HE1      LYS  49  -9.351   5.370  -3.436
  378    HZ1  LYS  49           HZ1      LYS  49 -10.547   4.545  -5.390
  379    HZ2  LYS  49           HZ2      LYS  49  -9.103   3.939  -6.028
  380    HZ3  LYS  49           HZ3      LYS  49  -9.301   5.606  -5.821
  381    H    GLU  50           HN       GLU  50  -2.700   7.348  -2.956
  382    HA   GLU  50           HA       GLU  50  -0.905   5.375  -3.952
  383    HB2  GLU  50           HB2      GLU  50  -0.466   7.944  -2.430
  384    HB3  GLU  50           HB1      GLU  50   0.846   6.979  -3.083
  385    HG2  GLU  50           HG2      GLU  50  -0.171   7.242  -5.340
  386    HG3  GLU  50           HG1      GLU  50  -1.340   8.351  -4.623
  387    H    ALA  51           HN       ALA  51  -1.364   6.658  -0.626
  388    HA   ALA  51           HA       ALA  51   0.584   5.177   0.684
  389    HB1  ALA  51           HB1      ALA  51  -0.794   6.916   1.744
  390    HB2  ALA  51           HB2      ALA  51  -0.732   5.445   2.713
  391    HB3  ALA  51           HB3      ALA  51  -2.167   5.810   1.755
  392    H    ILE  52           HN       ILE  52  -2.861   4.103   0.292
  393    HA   ILE  52           HA       ILE  52  -2.347   1.611   1.515
  394    HB   ILE  52           HB       ILE  52  -4.426   2.258  -0.611
  395   HG12  ILE  52          HG12      ILE  52  -4.555   3.622   1.455
  396   HG13  ILE  52          HG11      ILE  52  -5.950   2.574   1.254
  397   HG21  ILE  52          HG21      ILE  52  -4.290  -0.093   1.274
  398   HG22  ILE  52          HG22      ILE  52  -4.082  -0.142  -0.477
  399   HG23  ILE  52          HG23      ILE  52  -5.644   0.296   0.214
  400   HD11  ILE  52          HD11      ILE  52  -4.996   1.010   2.875
  401   HD12  ILE  52          HD12      ILE  52  -5.224   2.617   3.560
  402   HD13  ILE  52          HD13      ILE  52  -3.612   2.083   3.083
  403    H    LEU  53           HN       LEU  53  -2.209   2.582  -1.930
  404    HA   LEU  53           HA       LEU  53  -1.888   0.026  -3.031
  405    HB2  LEU  53           HB2      LEU  53  -2.176   2.169  -4.293
  406    HB3  LEU  53           HB1      LEU  53  -0.516   2.617  -3.963
  407    HG   LEU  53           HG       LEU  53   0.235   0.623  -5.249
  408   HD11  LEU  53          HD11      LEU  53  -1.393  -0.498  -6.706
  409   HD12  LEU  53          HD12      LEU  53  -2.696   0.385  -5.911
  410   HD13  LEU  53          HD13      LEU  53  -1.729  -0.773  -4.996
  411   HD21  LEU  53          HD21      LEU  53  -1.554   2.554  -6.719
  412   HD22  LEU  53          HD22      LEU  53  -0.304   1.550  -7.454
  413   HD23  LEU  53          HD23      LEU  53   0.140   2.811  -6.302
  414    H    LEU  54           HN       LEU  54   0.557   1.928  -1.241
  415    HA   LEU  54           HA       LEU  54   2.956   0.779  -2.112
  416    HB2  LEU  54           HB2      LEU  54   1.900   1.735   0.553
  417    HB3  LEU  54           HB1      LEU  54   3.403   0.847   0.552
  418    HG   LEU  54           HG       LEU  54   4.376   2.485  -1.002
  419   HD11  LEU  54          HD11      LEU  54   3.183   4.580  -1.446
  420   HD12  LEU  54          HD12      LEU  54   1.748   3.918  -0.667
  421   HD13  LEU  54          HD13      LEU  54   2.360   3.191  -2.154
  422   HD21  LEU  54          HD21      LEU  54   4.690   2.798   1.375
  423   HD22  LEU  54          HD22      LEU  54   3.149   3.645   1.495
  424   HD23  LEU  54          HD23      LEU  54   4.481   4.363   0.592
  425    H    GLY  55           HN       GLY  55   0.352  -0.703  -0.137
  426    HA2  GLY  55           HA2      GLY  55   1.633  -2.862   1.044
  427    HA3  GLY  55           HA1      GLY  55  -0.006  -2.915   0.426
  428    H    LEU  56           HN       LEU  56   0.424  -2.735  -2.333
  429    HA   LEU  56           HA       LEU  56   0.851  -5.376  -3.052
  430    HB2  LEU  56           HB2      LEU  56   1.623  -3.067  -4.826
  431    HB3  LEU  56           HB1      LEU  56   1.089  -4.661  -5.321
  432    HG   LEU  56           HG       LEU  56  -0.564  -2.456  -4.113
  433   HD11  LEU  56          HD11      LEU  56  -0.632  -3.938  -6.730
  434   HD12  LEU  56          HD12      LEU  56  -0.277  -2.232  -6.467
  435   HD13  LEU  56          HD13      LEU  56  -1.903  -2.849  -6.180
  436   HD21  LEU  56          HD21      LEU  56  -1.413  -4.306  -2.984
  437   HD22  LEU  56          HD22      LEU  56  -1.156  -5.382  -4.355
  438   HD23  LEU  56          HD23      LEU  56  -2.448  -4.183  -4.407
  439    H    ARG  57           HN       ARG  57   3.300  -2.766  -3.065
  440    HA   ARG  57           HA       ARG  57   5.438  -4.353  -4.042
  441    HB2  ARG  57           HB2      ARG  57   5.427  -1.933  -2.237
  442    HB3  ARG  57           HB1      ARG  57   6.893  -2.632  -2.911
  443    HG2  ARG  57           HG2      ARG  57   4.607  -1.698  -4.622
  444    HG3  ARG  57           HG1      ARG  57   5.926  -0.639  -4.122
  445    HD2  ARG  57           HD2      ARG  57   6.295  -3.237  -5.606
  446    HD3  ARG  57           HD1      ARG  57   6.232  -1.652  -6.376
  447    HE   ARG  57           HE       ARG  57   8.443  -2.806  -4.854
  448   HH11  ARG  57          HH11      ARG  57   6.980   0.166  -6.111
  449   HH12  ARG  57          HH12      ARG  57   8.462   1.058  -6.063
  450   HH21  ARG  57          HH21      ARG  57  10.370  -1.590  -4.803
  451   HH22  ARG  57          HH22      ARG  57  10.386   0.062  -5.321
  452    H    TYR  58           HN       TYR  58   4.135  -3.926  -0.784
  453    HA   TYR  58           HA       TYR  58   6.254  -5.206   0.632
  454    HB2  TYR  58           HB2      TYR  58   4.620  -3.887   1.814
  455    HB3  TYR  58           HB1      TYR  58   3.309  -4.910   1.249
  456    HD1  TYR  58           HD2      TYR  58   6.227  -4.768   3.501
  457    HD2  TYR  58           HD1      TYR  58   2.736  -6.919   2.386
  458    HE1  TYR  58           HE2      TYR  58   6.435  -6.141   5.530
  459    HE2  TYR  58           HE1      TYR  58   2.930  -8.299   4.411
  460    HH   TYR  58           HH       TYR  58   4.728  -9.001   6.000
  461    H    LYS  59           HN       LYS  59   3.148  -6.436  -0.610
  462    HA   LYS  59           HA       LYS  59   3.758  -9.177   0.124
  463    HB2  LYS  59           HB2      LYS  59   1.559  -7.950  -1.524
  464    HB3  LYS  59           HB1      LYS  59   1.642  -9.654  -1.112
  465    HG2  LYS  59           HG2      LYS  59   1.552  -7.444   0.925
  466    HG3  LYS  59           HG1      LYS  59   0.127  -8.296   0.330
  467    HD2  LYS  59           HD2      LYS  59   1.046 -10.411   1.143
  468    HD3  LYS  59           HD1      LYS  59   2.488  -9.571   1.717
  469    HE2  LYS  59           HE2      LYS  59   1.128  -8.271   3.264
  470    HE3  LYS  59           HE1      LYS  59  -0.329  -9.066   2.673
  471    HZ1  LYS  59           HZ1      LYS  59   1.935 -10.379   4.078
  472    HZ2  LYS  59           HZ2      LYS  59   0.580 -11.182   3.461
  473    HZ3  LYS  59           HZ3      LYS  59   0.401 -10.071   4.722
  474    H    LYS  60           HN       LYS  60   4.879  -7.251  -2.379
  475    HA   LYS  60           HA       LYS  60   5.971  -7.727  -4.322
  476    HB2  LYS  60           HB2      LYS  60   5.898 -10.591  -3.347
  477    HB3  LYS  60           HB1      LYS  60   6.879 -10.000  -4.678
  478    HG2  LYS  60           HG2      LYS  60   7.171  -8.705  -2.015
  479    HG3  LYS  60           HG1      LYS  60   7.872 -10.303  -2.264
  480    HD2  LYS  60           HD2      LYS  60   9.582  -8.752  -2.774
  481    HD3  LYS  60           HD1      LYS  60   8.991  -9.349  -4.325
  482    HE2  LYS  60           HE2      LYS  60   7.668  -7.347  -4.630
  483    HE3  LYS  60           HE1      LYS  60   8.122  -6.768  -3.027
  484    HZ1  LYS  60           HZ1      LYS  60  10.429  -6.663  -3.775
  485    HZ2  LYS  60           HZ2      LYS  60   9.428  -5.688  -4.730
  486    HZ3  LYS  60           HZ3      LYS  60   9.966  -7.179  -5.320
  487    H    LEU  61           HN       LEU  61   3.704  -7.084  -5.047
  488    HA   LEU  61           HA       LEU  61   3.029  -8.792  -7.254
  489    HB2  LEU  61           HB2      LEU  61   0.535  -8.960  -6.430
  490    HB3  LEU  61           HB1      LEU  61   1.717 -10.171  -5.982
  491    HG   LEU  61           HG       LEU  61   2.030  -8.996  -3.803
  492   HD11  LEU  61          HD11      LEU  61   1.232  -6.777  -4.608
  493   HD12  LEU  61          HD12      LEU  61   0.505  -7.307  -3.091
  494   HD13  LEU  61          HD13      LEU  61  -0.408  -7.421  -4.593
  495   HD21  LEU  61          HD21      LEU  61  -0.781  -9.880  -4.441
  496   HD22  LEU  61          HD22      LEU  61  -0.076  -9.762  -2.828
  497   HD23  LEU  61          HD23      LEU  61   0.563 -10.928  -3.987
  498    H    TYR  62           HN       TYR  62   3.735  -5.978  -6.663
  499    HA   TYR  62           HA       TYR  62   1.498  -4.280  -6.971
  500    HB2  TYR  62           HB2      TYR  62   3.733  -3.515  -6.317
  501    HB3  TYR  62           HB1      TYR  62   4.340  -3.887  -7.925
  502    HD1  TYR  62           HD1      TYR  62   1.905  -1.731  -6.119
  503    HD2  TYR  62           HD2      TYR  62   4.258  -2.278  -9.620
  504    HE1  TYR  62           HE1      TYR  62   1.342   0.546  -6.847
  505    HE2  TYR  62           HE2      TYR  62   3.700  -0.001 -10.359
  506    HH   TYR  62           HH       TYR  62   1.905   1.677  -9.978
  507    H    ASN  63           HN       ASN  63   2.796  -6.496  -9.246
  508    HA   ASN  63           HA       ASN  63   2.133  -4.965 -11.616
  509    HB2  ASN  63           HB2      ASN  63   2.751  -7.900 -11.242
  510    HB3  ASN  63           HB1      ASN  63   2.560  -7.112 -12.805
  511   HD21  ASN  63          HD21      ASN  63   4.564  -7.517  -9.982
  512   HD22  ASN  63          HD22      ASN  63   6.020  -6.713 -10.664
  513    H    GLN  64           HN       GLN  64   0.733  -8.040 -10.329
  514    HA   GLN  64           HA       GLN  64  -1.683  -7.459 -11.921
  515    HB2  GLN  64           HB2      GLN  64  -0.736  -9.930 -10.488
  516    HB3  GLN  64           HB1      GLN  64  -2.321  -9.810 -11.238
  517    HG2  GLN  64           HG2      GLN  64  -1.294  -9.444 -13.406
  518    HG3  GLN  64           HG1      GLN  64   0.308  -9.486 -12.669
  519   HE21  GLN  64          HE21      GLN  64  -2.524 -11.343 -13.570
  520   HE22  GLN  64          HE22      GLN  64  -1.736 -12.954 -13.446
  521    H    ALA  65           HN       ALA  65  -0.698  -6.901  -8.715
  522    HA   ALA  65           HA       ALA  65  -3.146  -7.648  -7.389
  523    HB1  ALA  65           HB1      ALA  65  -1.070  -7.371  -6.176
  524    HB2  ALA  65           HB2      ALA  65  -2.316  -6.302  -5.536
  525    HB3  ALA  65           HB3      ALA  65  -1.045  -5.653  -6.571
  526    H    ARG  66           HN       ARG  66  -1.922  -4.544  -8.681
  527    HA   ARG  66           HA       ARG  66  -4.164  -2.997  -7.831
  528    HB2  ARG  66           HB2      ARG  66  -1.938  -2.107  -8.531
  529    HB3  ARG  66           HB1      ARG  66  -2.365  -2.475 -10.197
  530    HG2  ARG  66           HG2      ARG  66  -4.237  -0.922 -10.075
  531    HG3  ARG  66           HG1      ARG  66  -3.842  -0.569  -8.391
  532    HD2  ARG  66           HD2      ARG  66  -2.972   1.176  -9.819
  533    HD3  ARG  66           HD1      ARG  66  -1.642   0.269  -9.105
  534    HE   ARG  66           HE       ARG  66  -2.315  -0.835 -11.655
  535   HH11  ARG  66          HH11      ARG  66  -0.751   1.980 -10.183
  536   HH12  ARG  66          HH12      ARG  66   0.280   2.270 -11.543
  537   HH21  ARG  66          HH21      ARG  66  -0.940  -0.419 -13.424
  538   HH22  ARG  66          HH22      ARG  66   0.174   0.907 -13.384
  539    H    VAL  67           HN       VAL  67  -3.615  -4.986 -10.697
  540    HA   VAL  67           HA       VAL  67  -6.027  -3.925 -12.005
  541    HB   VAL  67           HB       VAL  67  -4.053  -4.501 -13.359
  542   HG11  VAL  67          HG11      VAL  67  -3.245  -6.410 -12.074
  543   HG12  VAL  67          HG12      VAL  67  -3.457  -6.833 -13.772
  544   HG13  VAL  67          HG13      VAL  67  -4.646  -7.354 -12.578
  545   HG21  VAL  67          HG21      VAL  67  -6.454  -6.223 -13.972
  546   HG22  VAL  67          HG22      VAL  67  -5.226  -5.696 -15.124
  547   HG23  VAL  67          HG23      VAL  67  -6.287  -4.511 -14.363
  548    H    LYS  68           HN       LYS  68  -4.978  -6.899 -10.352
  549    HA   LYS  68           HA       LYS  68  -7.378  -8.368 -10.962
  550    HB2  LYS  68           HB2      LYS  68  -5.105  -9.289 -10.267
  551    HB3  LYS  68           HB1      LYS  68  -5.545  -8.863  -8.620
  552    HG2  LYS  68           HG2      LYS  68  -5.990 -11.187  -8.995
  553    HG3  LYS  68           HG1      LYS  68  -7.517 -10.327  -8.801
  554    HD2  LYS  68           HD2      LYS  68  -7.631 -11.956 -10.626
  555    HD3  LYS  68           HD1      LYS  68  -7.827 -10.307 -11.222
  556    HE2  LYS  68           HE2      LYS  68  -6.369 -11.575 -12.695
  557    HE3  LYS  68           HE1      LYS  68  -5.469 -10.284 -11.905
  558    HZ1  LYS  68           HZ1      LYS  68  -4.546 -11.877 -10.370
  559    HZ2  LYS  68           HZ2      LYS  68  -4.251 -12.394 -11.954
  560    HZ3  LYS  68           HZ3      LYS  68  -5.471 -13.127 -11.040
  561    H    TYR  69           HN       TYR  69  -6.622  -5.935  -8.599
  562    HA   TYR  69           HA       TYR  69  -9.254  -6.479  -7.305
  563    HB2  TYR  69           HB2      TYR  69  -6.620  -5.746  -6.055
  564    HB3  TYR  69           HB1      TYR  69  -8.138  -5.361  -5.252
  565    HD1  TYR  69           HD1      TYR  69  -5.989  -8.114  -6.444
  566    HD2  TYR  69           HD2      TYR  69  -9.435  -7.055  -4.183
  567    HE1  TYR  69           HE1      TYR  69  -6.064 -10.385  -5.504
  568    HE2  TYR  69           HE2      TYR  69  -9.517  -9.321  -3.238
  569    HH   TYR  69           HH       TYR  69  -8.731 -11.601  -3.829
  570    H    SER  70           HN       SER  70 -10.128  -4.512  -6.133
  571    HA   SER  70           HA       SER  70 -10.026  -2.278  -8.028
  572    HB2  SER  70           HB2      SER  70 -12.191  -3.048  -7.152
  573    HB3  SER  70           HB1      SER  70 -11.675  -2.653  -5.513
  574    HG   SER  70           HG       SER  70 -12.272  -0.684  -5.885
  575    H    LEU  71           HN       LEU  71  -8.109  -1.211  -7.829
  576    HA   LEU  71           HA       LEU  71  -7.614   0.032  -5.159
  577    HB2  LEU  71           HB2      LEU  71  -5.650  -0.876  -7.261
  578    HB3  LEU  71           HB1      LEU  71  -5.207   0.200  -5.950
  579    HG   LEU  71           HG       LEU  71  -6.024  -1.634  -4.370
  580   HD11  LEU  71          HD11      LEU  71  -7.288  -3.018  -5.815
  581   HD12  LEU  71          HD12      LEU  71  -5.844  -3.932  -5.379
  582   HD13  LEU  71          HD13      LEU  71  -5.956  -3.158  -6.960
  583   HD21  LEU  71          HD21      LEU  71  -3.615  -2.059  -6.128
  584   HD22  LEU  71          HD22      LEU  71  -3.903  -2.897  -4.603
  585   HD23  LEU  71          HD23      LEU  71  -3.689  -1.147  -4.620
  586    H    LEU  72           HN       LEU  72  -6.351   0.614  -8.468
  587    HA   LEU  72           HA       LEU  72  -7.121   3.466  -8.107
  588    HB2  LEU  72           HB2      LEU  72  -5.019   2.118  -9.786
  589    HB3  LEU  72           HB1      LEU  72  -5.522   3.768 -10.094
  590    HG   LEU  72           HG       LEU  72  -3.480   3.747  -8.793
  591   HD11  LEU  72          HD11      LEU  72  -4.168   5.153  -6.934
  592   HD12  LEU  72          HD12      LEU  72  -5.831   4.592  -7.107
  593   HD13  LEU  72          HD13      LEU  72  -5.085   5.546  -8.388
  594   HD21  LEU  72          HD21      LEU  72  -3.779   1.549  -7.733
  595   HD22  LEU  72          HD22      LEU  72  -5.031   2.233  -6.696
  596   HD23  LEU  72          HD23      LEU  72  -3.369   2.805  -6.564
  597    H    GLU  73           HN       GLU  73  -8.929   4.088  -9.044
  598    HA   GLU  73           HA       GLU  73  -9.534   2.972 -11.737
  599    HB2  GLU  73           HB2      GLU  73 -11.605   3.484  -9.596
  600    HB3  GLU  73           HB1      GLU  73 -11.880   2.790 -11.188
  601    HG2  GLU  73           HG2      GLU  73 -10.474   0.859 -10.544
  602    HG3  GLU  73           HG1      GLU  73 -10.333   1.545  -8.926
  Start of MODEL    9
    1    H1   SER   1           HT1      SER   1  -0.054  16.679   7.239
    2    H2   SER   1           HT2      SER   1   0.906  16.353   8.593
    3    H3   SER   1           HT3      SER   1  -0.745  16.670   8.784
    4    HA   SER   1           HA       SER   1  -0.278  14.318   9.015
    5    HB2  SER   1           HB2      SER   1  -2.455  15.053   8.112
    6    HB3  SER   1           HB1      SER   1  -1.794  14.996   6.479
    7    HG   SER   1           HG       SER   1  -2.927  13.088   6.969
    8    H    ASP   2           HN       ASP   2   1.347  12.964   8.701
    9    HA   ASP   2           HA       ASP   2   2.585  12.903   5.987
   10    HB2  ASP   2           HB2      ASP   2   3.733  12.140   8.684
   11    HB3  ASP   2           HB1      ASP   2   4.565  11.917   7.149
   12    H    VAL   3           HN       VAL   3   3.374  10.849   5.183
   13    HA   VAL   3           HA       VAL   3   1.349   8.838   5.333
   14    HB   VAL   3           HB       VAL   3   2.854   9.263   3.372
   15   HG11  VAL   3          HG11      VAL   3   4.862   7.669   4.959
   16   HG12  VAL   3          HG12      VAL   3   4.975   9.393   4.605
   17   HG13  VAL   3          HG13      VAL   3   5.039   8.218   3.292
   18   HG21  VAL   3          HG21      VAL   3   2.653   6.438   4.403
   19   HG22  VAL   3          HG22      VAL   3   3.038   6.876   2.739
   20   HG23  VAL   3          HG23      VAL   3   1.467   7.296   3.420
   21    H    TRP   4           HN       TRP   4   4.481   9.216   6.956
   22    HA   TRP   4           HA       TRP   4   4.344   6.520   8.057
   23    HB2  TRP   4           HB2      TRP   4   6.363   8.490   7.724
   24    HB3  TRP   4           HB1      TRP   4   6.251   8.133   9.444
   25    HD1  TRP   4           HD1      TRP   4   5.910   5.116   9.613
   26    HE1  TRP   4           HE1      TRP   4   7.683   3.438   8.732
   27    HE3  TRP   4           HE3      TRP   4   8.293   8.210   6.311
   28    HZ2  TRP   4           HZ2      TRP   4   9.807   3.492   6.864
   29    HZ3  TRP   4           HZ3      TRP   4  10.186   7.319   5.018
   30    HH2  TRP   4           HH2      TRP   4  10.926   5.008   5.290
   31    H    SER   5           HN       SER   5   3.876   9.863   9.226
   32    HA   SER   5           HA       SER   5   3.430   9.198  11.948
   33    HB2  SER   5           HB2      SER   5   2.203  11.446  10.320
   34    HB3  SER   5           HB1      SER   5   2.245  11.365  12.080
   35    HG   SER   5           HG       SER   5   3.960  12.616  11.390
   36    H    LEU   6           HN       LEU   6   1.084   9.657   9.271
   37    HA   LEU   6           HA       LEU   6  -0.992   8.385  10.955
   38    HB2  LEU   6           HB2      LEU   6  -1.119   9.815   8.300
   39    HB3  LEU   6           HB1      LEU   6  -2.496   9.001   9.014
   40    HG   LEU   6           HG       LEU   6  -2.699  11.338   9.467
   41   HD11  LEU   6          HD11      LEU   6  -3.349   9.818  11.276
   42   HD12  LEU   6          HD12      LEU   6  -2.783  11.372  11.888
   43   HD13  LEU   6          HD13      LEU   6  -1.731   9.959  11.966
   44   HD21  LEU   6          HD21      LEU   6   0.016  11.252  10.768
   45   HD22  LEU   6          HD22      LEU   6  -1.023  12.659  10.557
   46   HD23  LEU   6          HD23      LEU   6  -0.296  11.880   9.151
   47    H    SER   7           HN       SER   7  -0.009   6.296  10.938
   48    HA   SER   7           HA       SER   7  -0.278   4.899   8.315
   49    HB2  SER   7           HB2      SER   7   1.475   4.309  10.702
   50    HB3  SER   7           HB1      SER   7   1.252   3.183   9.363
   51    HG   SER   7           HG       SER   7   2.586   4.329   8.221
   52    H    LYS   8           HN       LYS   8  -2.183   5.453  10.810
   53    HA   LYS   8           HA       LYS   8  -3.012   2.629  11.191
   54    HB2  LYS   8           HB2      LYS   8  -3.968   5.110  12.630
   55    HB3  LYS   8           HB1      LYS   8  -4.315   3.445  13.068
   56    HG2  LYS   8           HG2      LYS   8  -1.618   4.784  13.138
   57    HG3  LYS   8           HG1      LYS   8  -2.624   4.369  14.527
   58    HD2  LYS   8           HD2      LYS   8  -2.388   2.015  14.055
   59    HD3  LYS   8           HD1      LYS   8  -1.516   2.366  12.560
   60    HE2  LYS   8           HE2      LYS   8  -0.576   3.091  15.334
   61    HE3  LYS   8           HE1      LYS   8  -0.022   1.699  14.406
   62    HZ1  LYS   8           HZ1      LYS   8   0.351   4.562  13.714
   63    HZ2  LYS   8           HZ2      LYS   8   0.750   3.282  12.685
   64    HZ3  LYS   8           HZ3      LYS   8   1.551   3.457  14.163
   65    H    THR   9           HN       THR   9  -3.478   3.947   8.650
   66    HA   THR   9           HA       THR   9  -6.457   4.140   8.723
   67    HB   THR   9           HB       THR   9  -6.255   5.432   6.591
   68    HG1  THR   9           HG1      THR   9  -4.305   5.145   5.734
   69   HG21  THR   9          HG21      THR   9  -6.562   6.606   8.706
   70   HG22  THR   9          HG22      THR   9  -5.497   7.526   7.643
   71   HG23  THR   9          HG23      THR   9  -4.821   6.598   8.982
   72    H    SER  10           HN       SER  10  -7.168   2.125   8.270
   73    HA   SER  10           HA       SER  10  -5.793   0.512   6.246
   74    HB2  SER  10           HB2      SER  10  -8.385  -0.083   7.691
   75    HB3  SER  10           HB1      SER  10  -7.379  -1.230   6.811
   76    HG   SER  10           HG       SER  10  -6.149  -1.414   8.501
   77    H    MET  11           HN       MET  11  -7.066  -0.603   4.520
   78    HA   MET  11           HA       MET  11  -9.267   1.070   3.458
   79    HB2  MET  11           HB2      MET  11  -7.119   1.878   2.468
   80    HB3  MET  11           HB1      MET  11  -6.872   0.273   1.795
   81    HG2  MET  11           HG2      MET  11  -7.787   1.297  -0.005
   82    HG3  MET  11           HG1      MET  11  -9.259   0.714   0.768
   83    HE1  MET  11           HE1      MET  11 -10.761   3.890   2.380
   84    HE2  MET  11           HE2      MET  11  -9.654   2.811   3.227
   85    HE3  MET  11           HE3      MET  11 -10.877   2.146   2.143
   86    H    THR  12           HN       THR  12 -10.715   0.008   2.114
   87    HA   THR  12           HA       THR  12 -10.544  -2.934   2.345
   88    HB   THR  12           HB       THR  12 -12.863  -1.199   1.474
   89    HG1  THR  12           HG1      THR  12 -13.485  -1.252   3.539
   90   HG21  THR  12          HG21      THR  12 -13.016  -3.450   0.545
   91   HG22  THR  12          HG22      THR  12 -14.212  -3.231   1.822
   92   HG23  THR  12          HG23      THR  12 -12.737  -4.145   2.142
   93    H    PHE  13           HN       PHE  13 -10.028  -4.231   0.749
   94    HA   PHE  13           HA       PHE  13  -9.794  -3.127  -1.988
   95    HB2  PHE  13           HB2      PHE  13  -8.836  -5.697  -0.721
   96    HB3  PHE  13           HB1      PHE  13  -8.635  -5.319  -2.426
   97    HD1  PHE  13           HD1      PHE  13  -7.870  -3.944   0.953
   98    HD2  PHE  13           HD2      PHE  13  -6.710  -4.264  -3.128
   99    HE1  PHE  13           HE1      PHE  13  -5.766  -2.784   1.465
  100    HE2  PHE  13           HE2      PHE  13  -4.601  -3.103  -2.622
  101    HZ   PHE  13           HZ       PHE  13  -4.127  -2.361  -0.323
  102    H    GLN  14           HN       GLN  14 -10.885  -3.897  -3.759
  103    HA   GLN  14           HA       GLN  14 -13.115  -5.773  -3.112
  104    HB2  GLN  14           HB2      GLN  14 -13.898  -3.488  -3.554
  105    HB3  GLN  14           HB1      GLN  14 -13.086  -3.504  -5.111
  106    HG2  GLN  14           HG2      GLN  14 -14.543  -5.374  -5.809
  107    HG3  GLN  14           HG1      GLN  14 -15.396  -5.243  -4.270
  108   HE21  GLN  14          HE21      GLN  14 -16.716  -3.464  -3.847
  109   HE22  GLN  14          HE22      GLN  14 -17.286  -2.400  -5.180
  110    HA   PRO  15           HA       PRO  15 -10.914  -8.275  -6.111
  111    HB2  PRO  15           HB2      PRO  15 -12.670 -10.378  -6.040
  112    HB3  PRO  15           HB1      PRO  15 -11.392 -10.122  -4.850
  113    HG2  PRO  15           HG2      PRO  15 -14.303  -9.485  -4.674
  114    HG3  PRO  15           HG1      PRO  15 -13.222 -10.148  -3.435
  115    HD2  PRO  15           HD2      PRO  15 -13.966  -7.546  -3.486
  116    HD3  PRO  15           HD1      PRO  15 -12.387  -8.075  -2.878
  117    H    LYS  16           HN       LYS  16 -11.112  -8.671  -8.289
  118    HA   LYS  16           HA       LYS  16 -13.251  -7.299  -9.654
  119    HB2  LYS  16           HB2      LYS  16 -11.092  -9.135 -10.702
  120    HB3  LYS  16           HB1      LYS  16 -12.172  -8.190 -11.715
  121    HG2  LYS  16           HG2      LYS  16 -10.150  -7.115  -9.763
  122    HG3  LYS  16           HG1      LYS  16 -10.033  -7.092 -11.520
  123    HD2  LYS  16           HD2      LYS  16 -11.901  -5.585 -11.678
  124    HD3  LYS  16           HD1      LYS  16 -12.207  -5.715  -9.945
  125    HE2  LYS  16           HE2      LYS  16  -9.953  -4.741  -9.540
  126    HE3  LYS  16           HE1      LYS  16  -9.795  -4.489 -11.277
  127    HZ1  LYS  16           HZ1      LYS  16 -10.535  -2.481 -10.189
  128    HZ2  LYS  16           HZ2      LYS  16 -11.863  -3.283  -9.518
  129    HZ3  LYS  16           HZ3      LYS  16 -11.764  -3.067 -11.194
  130    H    LYS  17           HN       LYS  17 -12.571 -10.686  -8.877
  131    HA   LYS  17           HA       LYS  17 -15.246 -11.348 -10.013
  132    HB2  LYS  17           HB2      LYS  17 -14.360 -13.574 -10.629
  133    HB3  LYS  17           HB1      LYS  17 -13.578 -12.264 -11.502
  134    HG2  LYS  17           HG2      LYS  17 -11.682 -12.398  -9.910
  135    HG3  LYS  17           HG1      LYS  17 -12.457 -13.796  -9.165
  136    HD2  LYS  17           HD2      LYS  17 -10.779 -14.542 -10.738
  137    HD3  LYS  17           HD1      LYS  17 -12.383 -14.956 -11.345
  138    HE2  LYS  17           HE2      LYS  17 -12.334 -12.984 -12.802
  139    HE3  LYS  17           HE1      LYS  17 -10.726 -12.583 -12.201
  140    HZ1  LYS  17           HZ1      LYS  17  -9.913 -14.677 -13.107
  141    HZ2  LYS  17           HZ2      LYS  17 -10.610 -13.728 -14.320
  142    HZ3  LYS  17           HZ3      LYS  17 -11.458 -15.048 -13.691
  143    H    ALA  18           HN       ALA  18 -16.073 -13.516  -9.161
  144    HA   ALA  18           HA       ALA  18 -16.385 -13.293  -6.348
  145    HB1  ALA  18           HB1      ALA  18 -16.910 -15.686  -8.106
  146    HB2  ALA  18           HB2      ALA  18 -18.028 -14.353  -7.815
  147    HB3  ALA  18           HB3      ALA  18 -17.563 -15.420  -6.489
  148    H    SER  19           HN       SER  19 -14.198 -15.282  -8.317
  149    HA   SER  19           HA       SER  19 -13.302 -17.061  -6.334
  150    HB2  SER  19           HB2      SER  19 -11.721 -15.817  -8.598
  151    HB3  SER  19           HB1      SER  19 -11.231 -17.243  -7.682
  152    HG   SER  19           HG       SER  19 -13.106 -16.985  -9.682
  153    H    LEU  20           HN       LEU  20 -12.203 -13.755  -7.079
  154    HA   LEU  20           HA       LEU  20 -10.124 -13.815  -5.057
  155    HB2  LEU  20           HB2      LEU  20 -11.390 -11.544  -6.584
  156    HB3  LEU  20           HB1      LEU  20 -10.011 -11.365  -5.524
  157    HG   LEU  20           HG       LEU  20 -10.027 -13.124  -7.974
  158   HD11  LEU  20          HD11      LEU  20 -10.320 -10.802  -8.627
  159   HD12  LEU  20          HD12      LEU  20  -8.697 -11.361  -9.034
  160   HD13  LEU  20          HD13      LEU  20  -8.949 -10.332  -7.624
  161   HD21  LEU  20          HD21      LEU  20  -8.411 -13.737  -6.213
  162   HD22  LEU  20          HD22      LEU  20  -7.748 -12.105  -6.281
  163   HD23  LEU  20          HD23      LEU  20  -7.625 -13.166  -7.684
  164    H    GLN  21           HN       GLN  21 -10.038 -12.684  -3.097
  165    HA   GLN  21           HA       GLN  21 -12.729 -12.047  -1.967
  166    HB2  GLN  21           HB2      GLN  21 -10.339 -13.266  -0.579
  167    HB3  GLN  21           HB1      GLN  21 -11.823 -12.777   0.228
  168    HG2  GLN  21           HG2      GLN  21 -13.061 -14.392  -1.199
  169    HG3  GLN  21           HG1      GLN  21 -11.515 -14.942  -1.841
  170   HE21  GLN  21          HE21      GLN  21 -10.079 -14.694   0.685
  171   HE22  GLN  21          HE22      GLN  21 -10.670 -16.042   1.713
  172    HA   PRO  22           HA       PRO  22 -11.389  -7.905  -1.189
  173    HB2  PRO  22           HB2      PRO  22 -12.929  -8.189   1.345
  174    HB3  PRO  22           HB1      PRO  22 -13.059  -6.963   0.080
  175    HG2  PRO  22           HG2      PRO  22 -14.897  -8.864   0.282
  176    HG3  PRO  22           HG1      PRO  22 -14.316  -8.341  -1.310
  177    HD2  PRO  22           HD2      PRO  22 -13.618 -10.801   0.246
  178    HD3  PRO  22           HD1      PRO  22 -13.903 -10.612  -1.496
  179    H    LEU  23           HN       LEU  23 -10.243  -6.556   0.369
  180    HA   LEU  23           HA       LEU  23  -8.852  -8.080   2.504
  181    HB2  LEU  23           HB2      LEU  23  -7.513  -8.061   0.353
  182    HB3  LEU  23           HB1      LEU  23  -7.373  -6.328   0.550
  183    HG   LEU  23           HG       LEU  23  -6.494  -8.063   2.811
  184   HD11  LEU  23          HD11      LEU  23  -4.846  -7.593   0.328
  185   HD12  LEU  23          HD12      LEU  23  -5.536  -9.140   0.823
  186   HD13  LEU  23          HD13      LEU  23  -4.299  -8.367   1.816
  187   HD21  LEU  23          HD21      LEU  23  -5.470  -5.491   1.608
  188   HD22  LEU  23          HD22      LEU  23  -4.814  -6.285   3.040
  189   HD23  LEU  23          HD23      LEU  23  -6.455  -5.642   3.061
  190    H    THR  24           HN       THR  24  -8.090  -6.862   4.241
  191    HA   THR  24           HA       THR  24  -8.642  -3.944   4.139
  192    HB   THR  24           HB       THR  24  -9.688  -5.709   6.364
  193    HG1  THR  24           HG1      THR  24 -11.070  -4.353   4.264
  194   HG21  THR  24          HG21      THR  24 -10.818  -3.628   7.091
  195   HG22  THR  24          HG22      THR  24  -9.952  -2.747   5.832
  196   HG23  THR  24          HG23      THR  24  -9.060  -3.505   7.152
  197    H    ILE  25           HN       ILE  25  -6.633  -3.187   4.435
  198    HA   ILE  25           HA       ILE  25  -5.360  -3.771   7.015
  199    HB   ILE  25           HB       ILE  25  -4.527  -5.512   5.359
  200   HG12  ILE  25          HG12      ILE  25  -2.306  -3.766   6.402
  201   HG13  ILE  25          HG11      ILE  25  -3.360  -4.660   7.493
  202   HG21  ILE  25          HG21      ILE  25  -4.372  -3.958   3.436
  203   HG22  ILE  25          HG22      ILE  25  -2.888  -4.864   3.728
  204   HG23  ILE  25          HG23      ILE  25  -3.001  -3.175   4.222
  205   HD11  ILE  25          HD11      ILE  25  -1.294  -5.861   7.064
  206   HD12  ILE  25          HD12      ILE  25  -1.639  -5.857   5.335
  207   HD13  ILE  25          HD13      ILE  25  -2.685  -6.748   6.441
  208    H    SER  26           HN       SER  26  -3.563  -2.345   7.526
  209    HA   SER  26           HA       SER  26  -3.726   0.197   5.966
  210    HB2  SER  26           HB2      SER  26  -4.767   0.409   8.163
  211    HB3  SER  26           HB1      SER  26  -3.311  -0.208   8.939
  212    HG   SER  26           HG       SER  26  -2.534   1.730   8.877
  213    H    LEU  27           HN       LEU  27  -1.815   1.697   6.649
  214    HA   LEU  27           HA       LEU  27   0.578   0.726   5.531
  215    HB2  LEU  27           HB2      LEU  27   0.311   2.942   7.541
  216    HB3  LEU  27           HB1      LEU  27   1.605   2.726   6.379
  217    HG   LEU  27           HG       LEU  27  -1.264   3.452   5.786
  218   HD11  LEU  27          HD11      LEU  27  -0.306   5.512   4.927
  219   HD12  LEU  27          HD12      LEU  27   1.313   4.954   5.350
  220   HD13  LEU  27          HD13      LEU  27   0.132   5.281   6.618
  221   HD21  LEU  27          HD21      LEU  27  -0.360   1.886   4.102
  222   HD22  LEU  27          HD22      LEU  27   0.985   2.994   3.830
  223   HD23  LEU  27          HD23      LEU  27  -0.663   3.496   3.449
  224    H    ASP  28           HN       ASP  28   0.131   1.550   8.980
  225    HA   ASP  28           HA       ASP  28   2.547   0.337   9.832
  226    HB2  ASP  28           HB2      ASP  28   1.293   2.013  11.129
  227    HB3  ASP  28           HB1      ASP  28   0.018   0.836  11.418
  228    H    GLU  29           HN       GLU  29  -0.695  -1.003   9.411
  229    HA   GLU  29           HA       GLU  29  -0.105  -3.444  10.859
  230    HB2  GLU  29           HB2      GLU  29  -2.375  -2.519  10.664
  231    HB3  GLU  29           HB1      GLU  29  -2.338  -2.802   8.931
  232    HG2  GLU  29           HG2      GLU  29  -3.615  -4.524  10.018
  233    HG3  GLU  29           HG1      GLU  29  -2.142  -5.212   9.340
  234    H    LEU  30           HN       LEU  30   0.456  -2.365   7.581
  235    HA   LEU  30           HA       LEU  30   0.861  -5.205   6.798
  236    HB2  LEU  30           HB2      LEU  30  -0.711  -3.998   5.388
  237    HB3  LEU  30           HB1      LEU  30   0.461  -2.731   5.101
  238    HG   LEU  30           HG       LEU  30   1.152  -5.507   4.253
  239   HD11  LEU  30          HD11      LEU  30   0.042  -5.111   2.089
  240   HD12  LEU  30          HD12      LEU  30  -0.719  -3.671   2.766
  241   HD13  LEU  30          HD13      LEU  30  -1.102  -5.263   3.421
  242   HD21  LEU  30          HD21      LEU  30   2.844  -3.830   4.013
  243   HD22  LEU  30          HD22      LEU  30   1.714  -2.739   3.214
  244   HD23  LEU  30          HD23      LEU  30   2.223  -4.222   2.410
  245    H    PHE  31           HN       PHE  31   2.484  -2.077   6.975
  246    HA   PHE  31           HA       PHE  31   4.869  -3.361   5.855
  247    HB2  PHE  31           HB2      PHE  31   4.659  -0.487   6.791
  248    HB3  PHE  31           HB1      PHE  31   5.952  -1.171   5.809
  249    HD1  PHE  31           HD1      PHE  31   5.168  -2.267   3.559
  250    HD2  PHE  31           HD2      PHE  31   2.946   0.625   5.748
  251    HE1  PHE  31           HE1      PHE  31   3.914  -1.694   1.523
  252    HE2  PHE  31           HE2      PHE  31   1.687   1.200   3.718
  253    HZ   PHE  31           HZ       PHE  31   2.167   0.039   1.606
  254    H    SER  32           HN       SER  32   6.787  -3.818   6.949
  255    HA   SER  32           HA       SER  32   6.717  -3.303   9.869
  256    HB2  SER  32           HB2      SER  32   7.389  -5.928   8.555
  257    HB3  SER  32           HB1      SER  32   7.530  -5.590  10.279
  258    HG   SER  32           HG       SER  32   5.329  -5.383  10.414
  259    H    SER  33           HN       SER  33   8.252  -2.113   7.513
  260    HA   SER  33           HA       SER  33  10.883  -2.242   8.769
  261    HB2  SER  33           HB2      SER  33  11.083  -4.180   7.334
  262    HB3  SER  33           HB1      SER  33  10.482  -3.265   5.953
  263    HG   SER  33           HG       SER  33  12.662  -3.243   5.752
  264    H    ARG  34           HN       ARG  34  11.992  -0.392   8.599
  265    HA   ARG  34           HA       ARG  34  10.715   1.888   7.463
  266    HB2  ARG  34           HB2      ARG  34  12.401   1.869   9.335
  267    HB3  ARG  34           HB1      ARG  34  13.650   1.604   8.128
  268    HG2  ARG  34           HG2      ARG  34  13.179   3.726   7.100
  269    HG3  ARG  34           HG1      ARG  34  11.805   3.982   8.178
  270    HD2  ARG  34           HD2      ARG  34  13.321   4.004  10.100
  271    HD3  ARG  34           HD1      ARG  34  14.694   3.747   9.023
  272    HE   ARG  34           HE       ARG  34  13.460   6.020   8.040
  273   HH11  ARG  34          HH11      ARG  34  14.830   5.043  11.157
  274   HH12  ARG  34          HH12      ARG  34  15.274   6.656  11.601
  275   HH21  ARG  34          HH21      ARG  34  14.066   8.125   8.665
  276   HH22  ARG  34          HH22      ARG  34  14.842   8.405  10.188
  277    H    GLY  35           HN       GLY  35  13.573   0.005   6.393
  278    HA2  GLY  35           HA2      GLY  35  14.022   1.490   4.007
  279    HA3  GLY  35           HA1      GLY  35  14.538  -0.163   4.297
  280    H    GLU  36           HN       GLU  36  11.961  -1.338   4.676
  281    HA   GLU  36           HA       GLU  36  11.253  -1.879   1.979
  282    HB2  GLU  36           HB2      GLU  36  10.747  -3.405   3.845
  283    HB3  GLU  36           HB1      GLU  36   9.600  -2.241   4.491
  284    HG2  GLU  36           HG2      GLU  36   8.466  -4.037   3.323
  285    HG3  GLU  36           HG1      GLU  36   8.205  -2.494   2.514
  286    H    PHE  37           HN       PHE  37   9.866   0.305   4.421
  287    HA   PHE  37           HA       PHE  37   7.633   1.211   2.961
  288    HB2  PHE  37           HB2      PHE  37   8.465   1.711   5.404
  289    HB3  PHE  37           HB1      PHE  37   9.235   3.103   4.652
  290    HD1  PHE  37           HD2      PHE  37   6.052   1.532   5.532
  291    HD2  PHE  37           HD1      PHE  37   7.924   4.939   3.799
  292    HE1  PHE  37           HE2      PHE  37   3.933   2.771   5.687
  293    HE2  PHE  37           HE1      PHE  37   5.808   6.184   3.954
  294    HZ   PHE  37           HZ       PHE  37   3.810   5.099   4.899
  295    H    ILE  38           HN       ILE  38  11.008   2.416   3.010
  296    HA   ILE  38           HA       ILE  38  10.736   4.565   1.254
  297    HB   ILE  38           HB       ILE  38  13.050   2.628   1.444
  298   HG12  ILE  38          HG12      ILE  38  12.586   3.608   3.596
  299   HG13  ILE  38          HG11      ILE  38  14.004   4.408   2.929
  300   HG21  ILE  38          HG21      ILE  38  13.237   3.898  -0.594
  301   HG22  ILE  38          HG22      ILE  38  14.403   4.513   0.578
  302   HG23  ILE  38          HG23      ILE  38  12.911   5.402   0.268
  303   HD11  ILE  38          HD11      ILE  38  12.524   6.001   3.996
  304   HD12  ILE  38          HD12      ILE  38  11.197   5.501   2.948
  305   HD13  ILE  38          HD13      ILE  38  12.609   6.304   2.261
  306    H    SER  39           HN       SER  39  11.474   1.136   0.400
  307    HA   SER  39           HA       SER  39  11.531   1.595  -2.409
  308    HB2  SER  39           HB2      SER  39  10.785  -0.945  -0.909
  309    HB3  SER  39           HB1      SER  39  11.209  -0.859  -2.619
  310    HG   SER  39           HG       SER  39  12.826  -0.728  -0.378
  311    H    VAL  40           HN       VAL  40   8.913  -0.119  -0.594
  312    HA   VAL  40           HA       VAL  40   6.985  -0.333  -2.385
  313    HB   VAL  40           HB       VAL  40   5.243   0.112  -0.691
  314   HG11  VAL  40          HG11      VAL  40   6.365  -2.040  -0.751
  315   HG12  VAL  40          HG12      VAL  40   5.986  -1.587   0.909
  316   HG13  VAL  40          HG13      VAL  40   7.634  -1.427   0.307
  317   HG21  VAL  40          HG21      VAL  40   6.332   2.059   0.375
  318   HG22  VAL  40          HG22      VAL  40   7.518   0.966   1.085
  319   HG23  VAL  40          HG23      VAL  40   5.819   0.833   1.532
  320    H    GLY  41           HN       GLY  41   7.756   2.927  -1.003
  321    HA2  GLY  41           HA2      GLY  41   7.394   4.627  -2.862
  322    HA3  GLY  41           HA1      GLY  41   5.752   4.000  -2.926
  323    H    GLY  42           HN       GLY  42   7.822   4.621  -0.069
  324    HA2  GLY  42           HA2      GLY  42   5.755   6.601   0.790
  325    HA3  GLY  42           HA1      GLY  42   6.501   5.463   1.890
  326    H    ASP  43           HN       ASP  43   6.813   8.431   0.133
  327    HA   ASP  43           HA       ASP  43   9.505   8.947   1.212
  328    HB2  ASP  43           HB2      ASP  43   7.594  10.646  -0.410
  329    HB3  ASP  43           HB1      ASP  43   9.171  11.212   0.135
  330    H    GLY  44           HN       GLY  44   6.613  11.095   1.282
  331    HA2  GLY  44           HA2      GLY  44   6.676  11.061   4.229
  332    HA3  GLY  44           HA1      GLY  44   7.154  12.574   3.481
  333    H    ARG  45           HN       ARG  45   5.570  13.439   1.792
  334    HA   ARG  45           HA       ARG  45   2.919  13.372   3.072
  335    HB2  ARG  45           HB2      ARG  45   4.137  15.126   0.940
  336    HB3  ARG  45           HB1      ARG  45   2.444  15.232   1.402
  337    HG2  ARG  45           HG2      ARG  45   3.549  16.924   2.604
  338    HG3  ARG  45           HG1      ARG  45   3.244  15.632   3.765
  339    HD2  ARG  45           HD2      ARG  45   5.490  16.543   4.027
  340    HD3  ARG  45           HD1      ARG  45   5.542  14.857   3.522
  341    HE   ARG  45           HE       ARG  45   5.688  16.770   1.324
  342   HH11  ARG  45          HH11      ARG  45   7.528  14.918   3.717
  343   HH12  ARG  45          HH12      ARG  45   9.000  14.978   2.808
  344   HH21  ARG  45          HH21      ARG  45   7.648  16.821   0.161
  345   HH22  ARG  45          HH22      ARG  45   9.068  16.056   0.791
  346    H    MET  46           HN       MET  46   1.821  11.565   2.522
  347    HA   MET  46           HA       MET  46   1.804  10.692  -0.284
  348    HB2  MET  46           HB2      MET  46   1.768   9.258   1.946
  349    HB3  MET  46           HB1      MET  46   0.032   9.489   1.797
  350    HG2  MET  46           HG2      MET  46   0.129   7.622   0.577
  351    HG3  MET  46           HG1      MET  46   0.644   8.704  -0.712
  352    HE1  MET  46           HE1      MET  46   3.584   9.500   0.296
  353    HE2  MET  46           HE2      MET  46   3.201   9.102  -1.378
  354    HE3  MET  46           HE3      MET  46   4.552   8.306  -0.570
  355    H    SER  47           HN       SER  47  -0.396  10.068  -1.247
  356    HA   SER  47           HA       SER  47  -2.071  12.483  -1.068
  357    HB2  SER  47           HB2      SER  47  -1.358  11.636  -3.281
  358    HB3  SER  47           HB1      SER  47  -2.248  10.144  -2.984
  359    HG   SER  47           HG       SER  47  -3.188  12.698  -3.585
  360    H    HIS  48           HN       HIS  48  -2.912   9.048  -1.531
  361    HA   HIS  48           HA       HIS  48  -4.584   8.659   0.740
  362    HB2  HIS  48           HB2      HIS  48  -5.985  10.445  -0.107
  363    HB3  HIS  48           HB1      HIS  48  -5.987   9.721  -1.709
  364    HD1  HIS  48           HD1      HIS  48  -7.352   9.214   1.792
  365    HD2  HIS  48           HD2      HIS  48  -7.876   7.739  -2.098
  366    HE1  HIS  48           HE1      HIS  48  -9.424   7.752   1.852
  367    HE2  HIS  48           HE2      HIS  48  -9.683   6.777  -0.482
  368    H    LYS  49           HN       LYS  49  -4.855   8.138  -2.816
  369    HA   LYS  49           HA       LYS  49  -5.401   5.329  -2.397
  370    HB2  LYS  49           HB2      LYS  49  -4.894   7.106  -4.755
  371    HB3  LYS  49           HB1      LYS  49  -4.835   5.365  -4.966
  372    HG2  LYS  49           HG2      LYS  49  -7.181   6.876  -3.839
  373    HG3  LYS  49           HG1      LYS  49  -7.031   6.347  -5.516
  374    HD2  LYS  49           HD2      LYS  49  -6.897   4.019  -4.763
  375    HD3  LYS  49           HD1      LYS  49  -7.049   4.550  -3.088
  376    HE2  LYS  49           HE2      LYS  49  -9.110   5.036  -5.235
  377    HE3  LYS  49           HE1      LYS  49  -9.171   3.712  -4.072
  378    HZ1  LYS  49           HZ1      LYS  49  -9.190   5.393  -2.288
  379    HZ2  LYS  49           HZ2      LYS  49 -10.537   5.504  -3.303
  380    HZ3  LYS  49           HZ3      LYS  49  -9.271   6.616  -3.455
  381    H    GLU  50           HN       GLU  50  -2.539   7.296  -2.814
  382    HA   GLU  50           HA       GLU  50  -0.765   5.277  -3.753
  383    HB2  GLU  50           HB2      GLU  50  -0.265   7.800  -2.172
  384    HB3  GLU  50           HB1      GLU  50   1.003   6.822  -2.887
  385    HG2  GLU  50           HG2      GLU  50  -0.006   7.219  -5.111
  386    HG3  GLU  50           HG1      GLU  50  -1.175   8.293  -4.346
  387    H    ALA  51           HN       ALA  51  -1.264   6.589  -0.439
  388    HA   ALA  51           HA       ALA  51   0.593   5.048   0.923
  389    HB1  ALA  51           HB1      ALA  51  -0.773   6.816   1.954
  390    HB2  ALA  51           HB2      ALA  51  -0.773   5.339   2.916
  391    HB3  ALA  51           HB3      ALA  51  -2.172   5.742   1.921
  392    H    ILE  52           HN       ILE  52  -2.858   4.061   0.398
  393    HA   ILE  52           HA       ILE  52  -2.427   1.540   1.613
  394    HB   ILE  52           HB       ILE  52  -4.453   2.252  -0.544
  395   HG12  ILE  52          HG12      ILE  52  -4.623   3.644   1.479
  396   HG13  ILE  52          HG11      ILE  52  -6.007   2.578   1.320
  397   HG21  ILE  52          HG21      ILE  52  -4.133  -0.169  -0.356
  398   HG22  ILE  52          HG22      ILE  52  -5.728   0.325   0.210
  399   HG23  ILE  52          HG23      ILE  52  -4.466  -0.076   1.374
  400   HD11  ILE  52          HD11      ILE  52  -3.657   2.202   3.157
  401   HD12  ILE  52          HD12      ILE  52  -4.987   1.060   2.968
  402   HD13  ILE  52          HD13      ILE  52  -5.294   2.673   3.613
  403    H    LEU  53           HN       LEU  53  -2.225   2.577  -1.810
  404    HA   LEU  53           HA       LEU  53  -1.920   0.003  -2.920
  405    HB2  LEU  53           HB2      LEU  53  -2.272   2.093  -4.218
  406    HB3  LEU  53           HB1      LEU  53  -0.648   2.638  -3.867
  407    HG   LEU  53           HG       LEU  53   0.210   0.629  -5.111
  408   HD11  LEU  53          HD11      LEU  53  -1.737  -0.791  -4.971
  409   HD12  LEU  53          HD12      LEU  53  -1.357  -0.468  -6.662
  410   HD13  LEU  53          HD13      LEU  53  -2.693   0.380  -5.882
  411   HD21  LEU  53          HD21      LEU  53   0.216   2.779  -6.172
  412   HD22  LEU  53          HD22      LEU  53  -1.497   2.639  -6.569
  413   HD23  LEU  53          HD23      LEU  53  -0.322   1.579  -7.346
  414    H    LEU  54           HN       LEU  54   0.547   1.978  -1.206
  415    HA   LEU  54           HA       LEU  54   2.908   0.812  -2.131
  416    HB2  LEU  54           HB2      LEU  54   1.939   1.912   0.494
  417    HB3  LEU  54           HB1      LEU  54   3.394   0.948   0.559
  418    HG   LEU  54           HG       LEU  54   4.463   2.446  -1.073
  419   HD11  LEU  54          HD11      LEU  54   3.421   4.521  -1.725
  420   HD12  LEU  54          HD12      LEU  54   1.971   4.116  -0.808
  421   HD13  LEU  54          HD13      LEU  54   2.407   3.168  -2.230
  422   HD21  LEU  54          HD21      LEU  54   3.279   3.771   1.362
  423   HD22  LEU  54          HD22      LEU  54   4.627   4.413   0.426
  424   HD23  LEU  54          HD23      LEU  54   4.796   2.876   1.273
  425    H    GLY  55           HN       GLY  55   0.396  -0.634  -0.002
  426    HA2  GLY  55           HA2      GLY  55   1.737  -2.754   1.177
  427    HA3  GLY  55           HA1      GLY  55   0.084  -2.851   0.607
  428    H    LEU  56           HN       LEU  56   0.489  -2.663  -2.173
  429    HA   LEU  56           HA       LEU  56   0.932  -5.319  -2.894
  430    HB2  LEU  56           HB2      LEU  56   1.537  -2.956  -4.656
  431    HB3  LEU  56           HB1      LEU  56   1.130  -4.583  -5.171
  432    HG   LEU  56           HG       LEU  56  -0.682  -2.524  -3.933
  433   HD11  LEU  56          HD11      LEU  56  -0.468  -2.298  -6.291
  434   HD12  LEU  56          HD12      LEU  56  -2.024  -3.063  -5.973
  435   HD13  LEU  56          HD13      LEU  56  -0.664  -4.032  -6.537
  436   HD21  LEU  56          HD21      LEU  56  -2.440  -4.334  -4.093
  437   HD22  LEU  56          HD22      LEU  56  -1.277  -4.497  -2.778
  438   HD23  LEU  56          HD23      LEU  56  -1.111  -5.486  -4.228
  439    H    ARG  57           HN       ARG  57   3.291  -2.636  -2.965
  440    HA   ARG  57           HA       ARG  57   5.441  -4.159  -4.025
  441    HB2  ARG  57           HB2      ARG  57   5.188  -1.611  -2.504
  442    HB3  ARG  57           HB1      ARG  57   6.784  -2.338  -2.617
  443    HG2  ARG  57           HG2      ARG  57   6.414  -0.668  -4.358
  444    HG3  ARG  57           HG1      ARG  57   6.674  -2.274  -5.037
  445    HD2  ARG  57           HD2      ARG  57   4.892  -1.341  -6.263
  446    HD3  ARG  57           HD1      ARG  57   4.158  -2.489  -5.149
  447    HE   ARG  57           HE       ARG  57   3.323  -0.678  -3.825
  448   HH11  ARG  57          HH11      ARG  57   4.904   0.360  -6.827
  449   HH12  ARG  57          HH12      ARG  57   4.115   1.898  -6.845
  450   HH21  ARG  57          HH21      ARG  57   2.309   1.358  -3.903
  451   HH22  ARG  57          HH22      ARG  57   2.647   2.466  -5.189
  452    H    TYR  58           HN       TYR  58   4.327  -3.666  -0.686
  453    HA   TYR  58           HA       TYR  58   6.552  -4.977   0.567
  454    HB2  TYR  58           HB2      TYR  58   5.073  -3.513   1.829
  455    HB3  TYR  58           HB1      TYR  58   3.702  -4.560   1.497
  456    HD1  TYR  58           HD1      TYR  58   3.483  -6.726   2.632
  457    HD2  TYR  58           HD2      TYR  58   6.674  -4.068   3.556
  458    HE1  TYR  58           HE1      TYR  58   3.927  -7.988   4.692
  459    HE2  TYR  58           HE2      TYR  58   7.131  -5.325   5.618
  460    HH   TYR  58           HH       TYR  58   5.777  -6.846   7.191
  461    H    LYS  59           HN       LYS  59   3.292  -6.071  -0.350
  462    HA   LYS  59           HA       LYS  59   3.705  -8.794   0.491
  463    HB2  LYS  59           HB2      LYS  59   1.659  -7.568  -1.349
  464    HB3  LYS  59           HB1      LYS  59   1.599  -9.217  -0.751
  465    HG2  LYS  59           HG2      LYS  59   1.512  -6.737   0.957
  466    HG3  LYS  59           HG1      LYS  59   0.122  -7.723   0.502
  467    HD2  LYS  59           HD2      LYS  59   1.072  -9.633   1.680
  468    HD3  LYS  59           HD1      LYS  59   2.499  -8.682   2.097
  469    HE2  LYS  59           HE2      LYS  59   1.101  -7.147   3.387
  470    HE3  LYS  59           HE1      LYS  59  -0.331  -8.082   2.957
  471    HZ1  LYS  59           HZ1      LYS  59   0.468  -8.647   5.165
  472    HZ2  LYS  59           HZ2      LYS  59   1.977  -9.084   4.539
  473    HZ3  LYS  59           HZ3      LYS  59   0.601  -9.979   4.130
  474    H    LYS  60           HN       LYS  60   4.680  -7.029  -2.294
  475    HA   LYS  60           HA       LYS  60   5.893  -7.688  -4.111
  476    HB2  LYS  60           HB2      LYS  60   5.795 -10.512  -3.045
  477    HB3  LYS  60           HB1      LYS  60   6.914  -9.869  -4.239
  478    HG2  LYS  60           HG2      LYS  60   7.844  -8.366  -2.528
  479    HG3  LYS  60           HG1      LYS  60   6.757  -9.080  -1.338
  480    HD2  LYS  60           HD2      LYS  60   7.788 -11.274  -1.735
  481    HD3  LYS  60           HD1      LYS  60   8.902 -10.532  -2.885
  482    HE2  LYS  60           HE2      LYS  60   8.670  -9.705   0.002
  483    HE3  LYS  60           HE1      LYS  60   9.835 -10.890  -0.584
  484    HZ1  LYS  60           HZ1      LYS  60  10.850  -8.725  -0.427
  485    HZ2  LYS  60           HZ2      LYS  60   9.660  -8.042  -1.414
  486    HZ3  LYS  60           HZ3      LYS  60  10.744  -9.172  -2.056
  487    H    LEU  61           HN       LEU  61   3.637  -7.095  -4.888
  488    HA   LEU  61           HA       LEU  61   2.960  -8.937  -6.979
  489    HB2  LEU  61           HB2      LEU  61   0.478  -9.118  -6.153
  490    HB3  LEU  61           HB1      LEU  61   1.687 -10.261  -5.612
  491    HG   LEU  61           HG       LEU  61   1.936  -9.003  -3.506
  492   HD11  LEU  61          HD11      LEU  61  -0.367  -7.344  -4.512
  493   HD12  LEU  61          HD12      LEU  61   1.300  -6.791  -4.369
  494   HD13  LEU  61          HD13      LEU  61   0.392  -7.238  -2.925
  495   HD21  LEU  61          HD21      LEU  61  -0.221  -9.618  -2.537
  496   HD22  LEU  61          HD22      LEU  61   0.384 -10.875  -3.618
  497   HD23  LEU  61          HD23      LEU  61  -0.900  -9.791  -4.156
  498    H    TYR  62           HN       TYR  62   3.627  -6.098  -6.606
  499    HA   TYR  62           HA       TYR  62   1.348  -4.453  -6.961
  500    HB2  TYR  62           HB2      TYR  62   3.604  -3.636  -6.406
  501    HB3  TYR  62           HB1      TYR  62   4.150  -4.052  -8.025
  502    HD1  TYR  62           HD1      TYR  62   1.484  -2.032  -6.355
  503    HD2  TYR  62           HD2      TYR  62   4.209  -2.369  -9.605
  504    HE1  TYR  62           HE1      TYR  62   0.823   0.200  -7.134
  505    HE2  TYR  62           HE2      TYR  62   3.553  -0.134 -10.393
  506    HH   TYR  62           HH       TYR  62   1.687   1.420 -10.200
  507    H    ASN  63           HN       ASN  63   2.731  -6.739  -9.138
  508    HA   ASN  63           HA       ASN  63   2.037  -5.407 -11.589
  509    HB2  ASN  63           HB2      ASN  63   2.576  -8.317 -10.984
  510    HB3  ASN  63           HB1      ASN  63   2.384  -7.659 -12.606
  511   HD21  ASN  63          HD21      ASN  63   4.663  -9.002 -11.267
  512   HD22  ASN  63          HD22      ASN  63   6.030  -7.847 -11.436
  513    H    GLN  64           HN       GLN  64   0.549  -8.370 -10.144
  514    HA   GLN  64           HA       GLN  64  -1.855  -7.759 -11.742
  515    HB2  GLN  64           HB2      GLN  64  -2.568 -10.044 -11.231
  516    HB3  GLN  64           HB1      GLN  64  -0.948 -10.015 -11.911
  517    HG2  GLN  64           HG2      GLN  64  -0.014 -10.245  -9.650
  518    HG3  GLN  64           HG1      GLN  64  -1.651 -10.331  -9.001
  519   HE21  GLN  64          HE21      GLN  64   0.828 -11.952 -10.862
  520   HE22  GLN  64          HE22      GLN  64   0.062 -13.578 -10.817
  521    H    ALA  65           HN       ALA  65  -0.845  -7.061  -8.579
  522    HA   ALA  65           HA       ALA  65  -3.355  -7.683  -7.268
  523    HB1  ALA  65           HB1      ALA  65  -1.156  -5.805  -6.425
  524    HB2  ALA  65           HB2      ALA  65  -1.286  -7.512  -6.004
  525    HB3  ALA  65           HB3      ALA  65  -2.485  -6.365  -5.411
  526    H    ARG  66           HN       ARG  66  -1.941  -4.800  -8.782
  527    HA   ARG  66           HA       ARG  66  -3.998  -2.981  -7.996
  528    HB2  ARG  66           HB2      ARG  66  -1.782  -2.301  -8.831
  529    HB3  ARG  66           HB1      ARG  66  -2.200  -2.912 -10.424
  530    HG2  ARG  66           HG2      ARG  66  -4.068  -1.262 -10.488
  531    HG3  ARG  66           HG1      ARG  66  -3.450  -0.589  -8.978
  532    HD2  ARG  66           HD2      ARG  66  -2.651   0.686 -10.893
  533    HD3  ARG  66           HD1      ARG  66  -1.315  -0.110 -10.063
  534    HE   ARG  66           HE       ARG  66  -2.446  -1.585 -12.331
  535   HH11  ARG  66          HH11      ARG  66   0.019   0.707 -11.233
  536   HH12  ARG  66          HH12      ARG  66   1.082   0.387 -12.562
  537   HH21  ARG  66          HH21      ARG  66  -1.017  -1.975 -14.062
  538   HH22  ARG  66          HH22      ARG  66   0.493  -1.134 -14.168
  539    H    VAL  67           HN       VAL  67  -3.790  -5.353 -10.584
  540    HA   VAL  67           HA       VAL  67  -6.178  -4.225 -11.908
  541    HB   VAL  67           HB       VAL  67  -5.849  -6.001 -13.591
  542   HG11  VAL  67          HG11      VAL  67  -4.796  -3.826 -13.888
  543   HG12  VAL  67          HG12      VAL  67  -3.787  -5.111 -14.551
  544   HG13  VAL  67          HG13      VAL  67  -3.376  -4.381 -12.999
  545   HG21  VAL  67          HG21      VAL  67  -3.828  -7.375 -13.549
  546   HG22  VAL  67          HG22      VAL  67  -4.857  -7.713 -12.158
  547   HG23  VAL  67          HG23      VAL  67  -3.411  -6.722 -11.966
  548    H    LYS  68           HN       LYS  68  -5.200  -7.070 -10.012
  549    HA   LYS  68           HA       LYS  68  -7.674  -8.492 -10.399
  550    HB2  LYS  68           HB2      LYS  68  -5.442  -8.725  -8.397
  551    HB3  LYS  68           HB1      LYS  68  -6.874  -9.738  -8.301
  552    HG2  LYS  68           HG2      LYS  68  -6.416 -10.688 -10.460
  553    HG3  LYS  68           HG1      LYS  68  -5.079  -9.566 -10.713
  554    HD2  LYS  68           HD2      LYS  68  -4.201 -11.718 -10.069
  555    HD3  LYS  68           HD1      LYS  68  -3.925 -10.565  -8.763
  556    HE2  LYS  68           HE2      LYS  68  -5.881 -11.439  -7.579
  557    HE3  LYS  68           HE1      LYS  68  -6.162 -12.586  -8.889
  558    HZ1  LYS  68           HZ1      LYS  68  -5.014 -13.613  -7.025
  559    HZ2  LYS  68           HZ2      LYS  68  -3.745 -12.503  -7.163
  560    HZ3  LYS  68           HZ3      LYS  68  -4.035 -13.614  -8.406
  561    H    TYR  69           HN       TYR  69  -6.837  -5.784  -8.428
  562    HA   TYR  69           HA       TYR  69  -9.473  -6.055  -7.089
  563    HB2  TYR  69           HB2      TYR  69  -6.833  -5.444  -5.763
  564    HB3  TYR  69           HB1      TYR  69  -8.378  -5.048  -5.021
  565    HD1  TYR  69           HD1      TYR  69  -6.182  -7.798  -6.096
  566    HD2  TYR  69           HD2      TYR  69  -9.781  -6.754  -4.083
  567    HE1  TYR  69           HE1      TYR  69  -6.342 -10.085  -5.210
  568    HE2  TYR  69           HE2      TYR  69  -9.951  -9.035  -3.190
  569    HH   TYR  69           HH       TYR  69  -7.418 -11.239  -3.257
  570    H    SER  70           HN       SER  70 -10.369  -4.034  -6.275
  571    HA   SER  70           HA       SER  70  -9.877  -1.911  -8.209
  572    HB2  SER  70           HB2      SER  70 -12.165  -2.502  -7.489
  573    HB3  SER  70           HB1      SER  70 -11.774  -1.986  -5.849
  574    HG   SER  70           HG       SER  70 -12.563  -0.500  -7.937
  575    H    LEU  71           HN       LEU  71  -7.819  -1.125  -7.808
  576    HA   LEU  71           HA       LEU  71  -7.503   0.289  -5.197
  577    HB2  LEU  71           HB2      LEU  71  -5.467  -0.842  -7.114
  578    HB3  LEU  71           HB1      LEU  71  -5.035   0.294  -5.852
  579    HG   LEU  71           HG       LEU  71  -5.979  -1.351  -4.184
  580   HD11  LEU  71          HD11      LEU  71  -6.039  -3.098  -6.635
  581   HD12  LEU  71          HD12      LEU  71  -7.386  -2.680  -5.577
  582   HD13  LEU  71          HD13      LEU  71  -6.087  -3.711  -4.982
  583   HD21  LEU  71          HD21      LEU  71  -4.005  -2.874  -4.355
  584   HD22  LEU  71          HD22      LEU  71  -3.616  -1.155  -4.418
  585   HD23  LEU  71          HD23      LEU  71  -3.625  -2.111  -5.900
  586    H    LEU  72           HN       LEU  72  -6.205   0.583  -8.533
  587    HA   LEU  72           HA       LEU  72  -6.749   3.508  -8.336
  588    HB2  LEU  72           HB2      LEU  72  -4.608   1.920  -9.698
  589    HB3  LEU  72           HB1      LEU  72  -5.064   3.481 -10.354
  590    HG   LEU  72           HG       LEU  72  -3.105   3.663  -8.907
  591   HD11  LEU  72          HD11      LEU  72  -5.550   4.930  -7.680
  592   HD12  LEU  72          HD12      LEU  72  -4.649   5.554  -9.061
  593   HD13  LEU  72          HD13      LEU  72  -3.884   5.467  -7.474
  594   HD21  LEU  72          HD21      LEU  72  -3.595   1.771  -7.423
  595   HD22  LEU  72          HD22      LEU  72  -4.911   2.693  -6.696
  596   HD23  LEU  72          HD23      LEU  72  -3.247   3.245  -6.520
  597    H    GLU  73           HN       GLU  73  -8.803   3.661  -9.090
  598    HA   GLU  73           HA       GLU  73  -9.415   2.355 -11.679
  599    HB2  GLU  73           HB2      GLU  73 -11.308   3.880  -9.884
  600    HB3  GLU  73           HB1      GLU  73 -11.726   2.784 -11.193
  601    HG2  GLU  73           HG2      GLU  73 -10.476   2.062  -8.551
  602    HG3  GLU  73           HG1      GLU  73 -12.116   1.704  -9.088
  Start of MODEL   10
    1    H1   SER   1           HT1      SER   1   1.356  14.910  10.468
    2    H2   SER   1           HT2      SER   1  -0.104  15.704  10.776
    3    H3   SER   1           HT3      SER   1   0.950  16.303   9.597
    4    HA   SER   1           HA       SER   1  -0.464  13.702   9.489
    5    HB2  SER   1           HB2      SER   1  -0.942  16.280   7.969
    6    HB3  SER   1           HB1      SER   1  -1.737  14.744   7.622
    7    HG   SER   1           HG       SER   1  -2.832  16.352   9.068
    8    H    ASP   2           HN       ASP   2   0.780  12.258   8.526
    9    HA   ASP   2           HA       ASP   2   1.970  12.901   5.937
   10    HB2  ASP   2           HB2      ASP   2   3.675  12.301   8.350
   11    HB3  ASP   2           HB1      ASP   2   4.233  11.958   6.716
   12    H    VAL   3           HN       VAL   3   3.080  10.911   4.981
   13    HA   VAL   3           HA       VAL   3   1.276   8.711   5.185
   14    HB   VAL   3           HB       VAL   3   2.624   9.274   3.160
   15   HG11  VAL   3          HG11      VAL   3   4.914   8.496   2.975
   16   HG12  VAL   3          HG12      VAL   3   4.886   7.952   4.652
   17   HG13  VAL   3          HG13      VAL   3   4.773   9.673   4.281
   18   HG21  VAL   3          HG21      VAL   3   1.493   7.140   3.314
   19   HG22  VAL   3          HG22      VAL   3   2.858   6.450   4.191
   20   HG23  VAL   3          HG23      VAL   3   3.047   6.936   2.507
   21    H    TRP   4           HN       TRP   4   4.448   9.361   6.647
   22    HA   TRP   4           HA       TRP   4   4.589   6.671   7.746
   23    HB2  TRP   4           HB2      TRP   4   6.497   8.497   7.120
   24    HB3  TRP   4           HB1      TRP   4   6.363   8.751   8.857
   25    HD1  TRP   4           HD1      TRP   4   6.239   5.998  10.098
   26    HE1  TRP   4           HE1      TRP   4   8.117   4.225   9.837
   27    HE3  TRP   4           HE3      TRP   4   8.412   7.829   5.848
   28    HZ2  TRP   4           HZ2      TRP   4  10.231   3.729   8.022
   29    HZ3  TRP   4           HZ3      TRP   4  10.357   6.649   4.916
   30    HH2  TRP   4           HH2      TRP   4  11.248   4.642   5.981
   31    H    SER   5           HN       SER   5   3.979   9.970   8.955
   32    HA   SER   5           HA       SER   5   3.699   9.280  11.693
   33    HB2  SER   5           HB2      SER   5   3.861  11.606  10.885
   34    HB3  SER   5           HB1      SER   5   2.274  11.458  10.133
   35    HG   SER   5           HG       SER   5   1.366  11.742  12.012
   36    H    LEU   6           HN       LEU   6   1.192   9.687   9.159
   37    HA   LEU   6           HA       LEU   6  -0.737   8.282  10.911
   38    HB2  LEU   6           HB2      LEU   6  -1.152   9.650   8.248
   39    HB3  LEU   6           HB1      LEU   6  -2.416   8.987   9.267
   40    HG   LEU   6           HG       LEU   6  -0.633  11.325   9.960
   41   HD11  LEU   6          HD11      LEU   6  -2.655  12.657   9.766
   42   HD12  LEU   6          HD12      LEU   6  -3.575  11.224   9.305
   43   HD13  LEU   6          HD13      LEU   6  -2.305  11.836   8.245
   44   HD21  LEU   6          HD21      LEU   6  -1.174  10.118  11.962
   45   HD22  LEU   6          HD22      LEU   6  -2.870  10.008  11.492
   46   HD23  LEU   6          HD23      LEU   6  -2.167  11.574  11.898
   47    H    SER   7           HN       SER   7   0.199   6.214  10.789
   48    HA   SER   7           HA       SER   7  -0.131   4.901   8.124
   49    HB2  SER   7           HB2      SER   7   1.785   4.269  10.378
   50    HB3  SER   7           HB1      SER   7   1.549   3.239   8.969
   51    HG   SER   7           HG       SER   7   2.838   4.502   7.915
   52    H    LYS   8           HN       LYS   8  -1.899   5.286  10.756
   53    HA   LYS   8           HA       LYS   8  -2.550   2.403  11.046
   54    HB2  LYS   8           HB2      LYS   8  -2.949   4.814  12.771
   55    HB3  LYS   8           HB1      LYS   8  -4.028   3.440  12.958
   56    HG2  LYS   8           HG2      LYS   8  -2.196   3.340  14.548
   57    HG3  LYS   8           HG1      LYS   8  -2.125   1.989  13.420
   58    HD2  LYS   8           HD2      LYS   8   0.095   2.867  13.763
   59    HD3  LYS   8           HD1      LYS   8  -0.420   3.227  12.116
   60    HE2  LYS   8           HE2      LYS   8  -0.982   5.503  12.771
   61    HE3  LYS   8           HE1      LYS   8  -0.537   5.148  14.440
   62    HZ1  LYS   8           HZ1      LYS   8   1.331   5.021  12.136
   63    HZ2  LYS   8           HZ2      LYS   8   1.730   4.818  13.767
   64    HZ3  LYS   8           HZ3      LYS   8   1.210   6.327  13.205
   65    H    THR   9           HN       THR   9  -3.279   4.038   8.689
   66    HA   THR   9           HA       THR   9  -6.247   3.856   8.954
   67    HB   THR   9           HB       THR   9  -6.338   5.500   7.053
   68    HG1  THR   9           HG1      THR   9  -4.502   6.535   6.433
   69   HG21  THR   9          HG21      THR   9  -4.979   6.488   9.564
   70   HG22  THR   9          HG22      THR   9  -6.708   6.192   9.383
   71   HG23  THR   9          HG23      THR   9  -5.927   7.462   8.442
   72    H    SER  10           HN       SER  10  -6.999   2.093   7.995
   73    HA   SER  10           HA       SER  10  -5.507   1.012   5.670
   74    HB2  SER  10           HB2      SER  10  -6.873  -1.030   6.040
   75    HB3  SER  10           HB1      SER  10  -5.940  -0.574   7.463
   76    HG   SER  10           HG       SER  10  -7.734  -0.299   8.517
   77    H    MET  11           HN       MET  11  -6.939  -0.149   4.010
   78    HA   MET  11           HA       MET  11  -9.394   1.416   3.440
   79    HB2  MET  11           HB2      MET  11  -7.545   2.486   2.196
   80    HB3  MET  11           HB1      MET  11  -7.176   0.943   1.440
   81    HG2  MET  11           HG2      MET  11  -8.433   2.412  -0.045
   82    HG3  MET  11           HG1      MET  11  -9.323   0.937   0.326
   83    HE1  MET  11           HE1      MET  11  -8.940   4.760   1.075
   84    HE2  MET  11           HE2      MET  11  -8.876   4.074   2.699
   85    HE3  MET  11           HE3      MET  11 -10.260   5.051   2.207
   86    H    THR  12           HN       THR  12 -11.022   0.266   2.531
   87    HA   THR  12           HA       THR  12 -10.571  -2.636   2.372
   88    HB   THR  12           HB       THR  12 -13.132  -1.049   2.105
   89    HG1  THR  12           HG1      THR  12 -12.632  -0.898   4.204
   90   HG21  THR  12          HG21      THR  12 -13.235  -3.240   0.978
   91   HG22  THR  12          HG22      THR  12 -14.270  -3.182   2.404
   92   HG23  THR  12          HG23      THR  12 -12.720  -4.020   2.474
   93    H    PHE  13           HN       PHE  13  -9.990  -3.607   0.574
   94    HA   PHE  13           HA       PHE  13 -10.675  -2.342  -2.021
   95    HB2  PHE  13           HB2      PHE  13  -8.688  -4.471  -1.222
   96    HB3  PHE  13           HB1      PHE  13  -9.071  -4.132  -2.904
   97    HD1  PHE  13           HD2      PHE  13  -9.325  -1.145  -2.733
   98    HD2  PHE  13           HD1      PHE  13  -6.447  -3.833  -1.114
   99    HE1  PHE  13           HE2      PHE  13  -7.644   0.651  -2.749
  100    HE2  PHE  13           HE1      PHE  13  -4.764  -2.044  -1.129
  101    HZ   PHE  13           HZ       PHE  13  -5.359   0.202  -1.946
  102    H    GLN  14           HN       GLN  14 -11.764  -3.454  -3.663
  103    HA   GLN  14           HA       GLN  14 -13.118  -5.942  -2.732
  104    HB2  GLN  14           HB2      GLN  14 -14.666  -4.037  -2.679
  105    HB3  GLN  14           HB1      GLN  14 -14.323  -3.705  -4.370
  106    HG2  GLN  14           HG2      GLN  14 -15.305  -5.817  -5.019
  107    HG3  GLN  14           HG1      GLN  14 -15.569  -6.240  -3.328
  108   HE21  GLN  14          HE21      GLN  14 -17.187  -5.220  -2.137
  109   HE22  GLN  14          HE22      GLN  14 -18.498  -4.301  -2.957
  110    HA   PRO  15           HA       PRO  15 -11.063  -7.570  -6.382
  111    HB2  PRO  15           HB2      PRO  15 -12.834  -9.864  -5.806
  112    HB3  PRO  15           HB1      PRO  15 -11.077  -9.809  -5.988
  113    HG2  PRO  15           HG2      PRO  15 -12.200 -10.128  -3.590
  114    HG3  PRO  15           HG1      PRO  15 -10.736  -9.149  -3.798
  115    HD2  PRO  15           HD2      PRO  15 -13.570  -8.271  -3.438
  116    HD3  PRO  15           HD1      PRO  15 -12.083  -7.577  -2.764
  117    H    LYS  16           HN       LYS  16 -11.563  -7.927  -8.505
  118    HA   LYS  16           HA       LYS  16 -14.060  -6.851  -9.418
  119    HB2  LYS  16           HB2      LYS  16 -12.001  -8.464 -10.943
  120    HB3  LYS  16           HB1      LYS  16 -13.274  -7.486 -11.658
  121    HG2  LYS  16           HG2      LYS  16 -11.011  -6.450  -9.962
  122    HG3  LYS  16           HG1      LYS  16 -11.109  -6.359 -11.721
  123    HD2  LYS  16           HD2      LYS  16 -13.050  -4.932 -11.584
  124    HD3  LYS  16           HD1      LYS  16 -13.106  -5.117  -9.829
  125    HE2  LYS  16           HE2      LYS  16 -10.905  -4.031  -9.666
  126    HE3  LYS  16           HE1      LYS  16 -10.896  -3.811 -11.415
  127    HZ1  LYS  16           HZ1      LYS  16 -12.852  -2.417 -11.225
  128    HZ2  LYS  16           HZ2      LYS  16 -11.605  -1.808 -10.258
  129    HZ3  LYS  16           HZ3      LYS  16 -12.892  -2.646  -9.548
  130    H    LYS  17           HN       LYS  17 -12.855 -10.134  -8.869
  131    HA   LYS  17           HA       LYS  17 -15.456 -11.207  -9.847
  132    HB2  LYS  17           HB2      LYS  17 -12.868 -12.694  -9.361
  133    HB3  LYS  17           HB1      LYS  17 -14.336 -13.360 -10.057
  134    HG2  LYS  17           HG2      LYS  17 -13.082 -12.991 -11.934
  135    HG3  LYS  17           HG1      LYS  17 -14.002 -11.487 -11.844
  136    HD2  LYS  17           HD2      LYS  17 -12.081 -10.441 -10.673
  137    HD3  LYS  17           HD1      LYS  17 -11.168 -11.933 -10.899
  138    HE2  LYS  17           HE2      LYS  17 -11.376 -11.691 -13.323
  139    HE3  LYS  17           HE1      LYS  17 -12.299 -10.205 -13.099
  140    HZ1  LYS  17           HZ1      LYS  17  -9.471 -10.650 -12.302
  141    HZ2  LYS  17           HZ2      LYS  17 -10.350  -9.237 -12.001
  142    HZ3  LYS  17           HZ3      LYS  17 -10.011  -9.697 -13.592
  143    H    ALA  18           HN       ALA  18 -15.965 -13.414  -8.671
  144    HA   ALA  18           HA       ALA  18 -16.317 -12.682  -5.852
  145    HB1  ALA  18           HB1      ALA  18 -18.159 -13.620  -7.221
  146    HB2  ALA  18           HB2      ALA  18 -17.842 -14.534  -5.746
  147    HB3  ALA  18           HB3      ALA  18 -17.275 -15.144  -7.302
  148    H    SER  19           HN       SER  19 -14.479 -15.011  -7.774
  149    HA   SER  19           HA       SER  19 -13.747 -16.813  -5.739
  150    HB2  SER  19           HB2      SER  19 -11.780 -17.326  -7.161
  151    HB3  SER  19           HB1      SER  19 -13.274 -17.238  -8.094
  152    HG   SER  19           HG       SER  19 -12.562 -15.506  -9.094
  153    H    LEU  20           HN       LEU  20 -12.239 -13.728  -6.696
  154    HA   LEU  20           HA       LEU  20 -10.048 -13.945  -4.849
  155    HB2  LEU  20           HB2      LEU  20 -11.271 -11.492  -6.104
  156    HB3  LEU  20           HB1      LEU  20  -9.692 -11.579  -5.357
  157    HG   LEU  20           HG       LEU  20 -10.453 -13.198  -7.782
  158   HD11  LEU  20          HD11      LEU  20  -9.348 -11.558  -9.140
  159   HD12  LEU  20          HD12      LEU  20  -8.940 -10.593  -7.721
  160   HD13  LEU  20          HD13      LEU  20 -10.625 -10.763  -8.218
  161   HD21  LEU  20          HD21      LEU  20  -7.727 -12.428  -6.768
  162   HD22  LEU  20          HD22      LEU  20  -8.131 -13.612  -8.010
  163   HD23  LEU  20          HD23      LEU  20  -8.531 -13.932  -6.323
  164    H    GLN  21           HN       GLN  21  -9.651 -12.352  -3.045
  165    HA   GLN  21           HA       GLN  21 -12.180 -11.945  -1.515
  166    HB2  GLN  21           HB2      GLN  21  -9.460 -12.777  -0.494
  167    HB3  GLN  21           HB1      GLN  21 -10.813 -12.335   0.537
  168    HG2  GLN  21           HG2      GLN  21 -12.081 -14.210  -0.184
  169    HG3  GLN  21           HG1      GLN  21 -10.919 -14.582  -1.455
  170   HE21  GLN  21          HE21      GLN  21 -11.598 -14.665   1.975
  171   HE22  GLN  21          HE22      GLN  21 -10.269 -15.796   2.403
  172    HA   PRO  22           HA       PRO  22 -11.141  -7.643  -1.301
  173    HB2  PRO  22           HB2      PRO  22 -12.258  -7.085   1.165
  174    HB3  PRO  22           HB1      PRO  22 -13.150  -7.145  -0.357
  175    HG2  PRO  22           HG2      PRO  22 -12.899  -9.212   1.779
  176    HG3  PRO  22           HG1      PRO  22 -14.309  -8.773   0.800
  177    HD2  PRO  22           HD2      PRO  22 -12.857 -10.981   0.296
  178    HD3  PRO  22           HD1      PRO  22 -13.607 -10.033  -1.005
  179    H    LEU  23           HN       LEU  23  -9.725  -6.184  -0.316
  180    HA   LEU  23           HA       LEU  23  -7.991  -7.408   1.784
  181    HB2  LEU  23           HB2      LEU  23  -7.085  -7.164  -0.610
  182    HB3  LEU  23           HB1      LEU  23  -7.031  -5.447  -0.277
  183    HG   LEU  23           HG       LEU  23  -5.562  -7.530   1.344
  184   HD11  LEU  23          HD11      LEU  23  -3.550  -6.732   0.193
  185   HD12  LEU  23          HD12      LEU  23  -4.554  -5.717  -0.845
  186   HD13  LEU  23          HD13      LEU  23  -4.695  -7.473  -0.926
  187   HD21  LEU  23          HD21      LEU  23  -5.509  -4.518   1.320
  188   HD22  LEU  23          HD22      LEU  23  -4.281  -5.513   2.101
  189   HD23  LEU  23          HD23      LEU  23  -5.952  -5.580   2.656
  190    H    THR  24           HN       THR  24  -7.963  -6.356   3.649
  191    HA   THR  24           HA       THR  24  -8.350  -3.410   3.553
  192    HB   THR  24           HB       THR  24  -9.540  -5.207   5.672
  193    HG1  THR  24           HG1      THR  24 -10.934  -5.486   4.056
  194   HG21  THR  24          HG21      THR  24  -9.806  -2.240   5.157
  195   HG22  THR  24          HG22      THR  24  -8.994  -3.000   6.526
  196   HG23  THR  24          HG23      THR  24 -10.742  -3.149   6.344
  197    H    ILE  25           HN       ILE  25  -6.059  -3.198   3.660
  198    HA   ILE  25           HA       ILE  25  -4.999  -3.803   6.384
  199    HB   ILE  25           HB       ILE  25  -4.105  -5.297   4.538
  200   HG12  ILE  25          HG12      ILE  25  -1.710  -5.010   5.301
  201   HG13  ILE  25          HG11      ILE  25  -2.235  -3.583   6.181
  202   HG21  ILE  25          HG21      ILE  25  -2.576  -4.469   2.951
  203   HG22  ILE  25          HG22      ILE  25  -2.495  -2.891   3.734
  204   HG23  ILE  25          HG23      ILE  25  -3.962  -3.381   2.888
  205   HD11  ILE  25          HD11      ILE  25  -3.814  -5.004   7.444
  206   HD12  ILE  25          HD12      ILE  25  -2.123  -5.442   7.680
  207   HD13  ILE  25          HD13      ILE  25  -3.145  -6.413   6.621
  208    H    SER  26           HN       SER  26  -3.327  -2.414   7.183
  209    HA   SER  26           HA       SER  26  -3.440   0.296   5.940
  210    HB2  SER  26           HB2      SER  26  -4.502   0.136   8.172
  211    HB3  SER  26           HB1      SER  26  -2.975  -0.436   8.843
  212    HG   SER  26           HG       SER  26  -2.304   1.547   8.915
  213    H    LEU  27           HN       LEU  27  -1.529   1.708   6.620
  214    HA   LEU  27           HA       LEU  27   0.868   0.684   5.506
  215    HB2  LEU  27           HB2      LEU  27   0.630   2.973   7.436
  216    HB3  LEU  27           HB1      LEU  27   1.901   2.711   6.258
  217    HG   LEU  27           HG       LEU  27  -0.967   3.475   5.720
  218   HD11  LEU  27          HD11      LEU  27   0.540   5.282   6.405
  219   HD12  LEU  27          HD12      LEU  27   0.016   5.458   4.730
  220   HD13  LEU  27          HD13      LEU  27   1.636   4.857   5.091
  221   HD21  LEU  27          HD21      LEU  27  -0.422   3.412   3.351
  222   HD22  LEU  27          HD22      LEU  27  -0.241   1.813   4.071
  223   HD23  LEU  27          HD23      LEU  27   1.186   2.790   3.721
  224    H    ASP  28           HN       ASP  28   0.305   1.564   8.928
  225    HA   ASP  28           HA       ASP  28   2.734   0.381   9.853
  226    HB2  ASP  28           HB2      ASP  28   1.393   2.142  11.041
  227    HB3  ASP  28           HB1      ASP  28   0.216   0.899  11.446
  228    H    GLU  29           HN       GLU  29  -0.489  -0.900   9.298
  229    HA   GLU  29           HA       GLU  29   0.017  -3.326  10.837
  230    HB2  GLU  29           HB2      GLU  29  -2.227  -2.210  10.546
  231    HB3  GLU  29           HB1      GLU  29  -2.221  -2.786   8.888
  232    HG2  GLU  29           HG2      GLU  29  -2.247  -5.058   9.606
  233    HG3  GLU  29           HG1      GLU  29  -2.010  -4.585  11.287
  234    H    LEU  30           HN       LEU  30   1.217  -2.329   7.880
  235    HA   LEU  30           HA       LEU  30   1.391  -5.172   7.035
  236    HB2  LEU  30           HB2      LEU  30  -0.284  -3.870   5.687
  237    HB3  LEU  30           HB1      LEU  30   1.036  -2.871   5.115
  238    HG   LEU  30           HG       LEU  30   2.078  -4.852   4.080
  239   HD11  LEU  30          HD11      LEU  30  -0.375  -6.252   5.118
  240   HD12  LEU  30          HD12      LEU  30   1.312  -6.620   5.478
  241   HD13  LEU  30          HD13      LEU  30   0.671  -6.906   3.860
  242   HD21  LEU  30          HD21      LEU  30   0.496  -5.098   2.258
  243   HD22  LEU  30          HD22      LEU  30   0.568  -3.418   2.793
  244   HD23  LEU  30          HD23      LEU  30  -0.790  -4.437   3.266
  245    H    PHE  31           HN       PHE  31   3.208  -2.792   8.205
  246    HA   PHE  31           HA       PHE  31   5.476  -3.713   6.566
  247    HB2  PHE  31           HB2      PHE  31   5.202  -0.803   7.359
  248    HB3  PHE  31           HB1      PHE  31   6.511  -1.503   6.413
  249    HD1  PHE  31           HD1      PHE  31   5.289  -3.081   4.398
  250    HD2  PHE  31           HD2      PHE  31   3.926   0.589   6.066
  251    HE1  PHE  31           HE1      PHE  31   4.032  -2.612   2.336
  252    HE2  PHE  31           HE2      PHE  31   2.666   1.062   4.008
  253    HZ   PHE  31           HZ       PHE  31   2.717  -0.543   2.142
  254    H    SER  32           HN       SER  32   7.456  -3.993   7.593
  255    HA   SER  32           HA       SER  32   7.477  -3.369  10.495
  256    HB2  SER  32           HB2      SER  32   8.242  -5.999   9.236
  257    HB3  SER  32           HB1      SER  32   8.463  -5.590  10.937
  258    HG   SER  32           HG       SER  32   6.150  -6.222   9.544
  259    H    SER  33           HN       SER  33   8.810  -2.093   8.117
  260    HA   SER  33           HA       SER  33  11.517  -2.074   9.197
  261    HB2  SER  33           HB2      SER  33  11.764  -4.002   7.768
  262    HB3  SER  33           HB1      SER  33  10.999  -3.158   6.424
  263    HG   SER  33           HG       SER  33  13.088  -2.878   5.996
  264    H    ARG  34           HN       ARG  34  12.608  -0.205   8.831
  265    HA   ARG  34           HA       ARG  34  11.105   2.021   7.867
  266    HB2  ARG  34           HB2      ARG  34  14.072   1.725   8.375
  267    HB3  ARG  34           HB1      ARG  34  13.269   3.256   8.054
  268    HG2  ARG  34           HG2      ARG  34  11.949   3.024  10.071
  269    HG3  ARG  34           HG1      ARG  34  12.664   1.440  10.380
  270    HD2  ARG  34           HD2      ARG  34  14.196   4.034  10.235
  271    HD3  ARG  34           HD1      ARG  34  13.684   3.249  11.727
  272    HE   ARG  34           HE       ARG  34  15.086   1.263  10.536
  273   HH11  ARG  34          HH11      ARG  34  15.848   4.678  11.097
  274   HH12  ARG  34          HH12      ARG  34  17.553   4.403  11.203
  275   HH21  ARG  34          HH21      ARG  34  17.336   0.948  10.686
  276   HH22  ARG  34          HH22      ARG  34  18.399   2.286  10.971
  277    H    GLY  35           HN       GLY  35  14.012   0.417   6.471
  278    HA2  GLY  35           HA2      GLY  35  14.008   1.886   4.045
  279    HA3  GLY  35           HA1      GLY  35  14.700   0.286   4.261
  280    H    GLU  36           HN       GLU  36  12.236  -1.021   5.015
  281    HA   GLU  36           HA       GLU  36  11.260  -1.757   2.454
  282    HB2  GLU  36           HB2      GLU  36  11.080  -3.192   4.430
  283    HB3  GLU  36           HB1      GLU  36   9.978  -2.048   5.180
  284    HG2  GLU  36           HG2      GLU  36   8.367  -2.464   3.354
  285    HG3  GLU  36           HG1      GLU  36   9.463  -3.688   2.712
  286    H    PHE  37           HN       PHE  37  10.029   0.480   4.926
  287    HA   PHE  37           HA       PHE  37   7.588   1.172   3.680
  288    HB2  PHE  37           HB2      PHE  37   8.494   1.779   6.019
  289    HB3  PHE  37           HB1      PHE  37   9.299   3.123   5.220
  290    HD1  PHE  37           HD1      PHE  37   7.973   4.925   4.193
  291    HD2  PHE  37           HD2      PHE  37   6.153   1.794   6.427
  292    HE1  PHE  37           HE1      PHE  37   5.925   6.271   4.404
  293    HE2  PHE  37           HE2      PHE  37   4.101   3.134   6.640
  294    HZ   PHE  37           HZ       PHE  37   3.986   5.375   5.629
  295    H    ILE  38           HN       ILE  38  10.870   2.542   3.332
  296    HA   ILE  38           HA       ILE  38  10.287   4.646   1.591
  297    HB   ILE  38           HB       ILE  38  12.731   2.871   1.604
  298   HG12  ILE  38          HG12      ILE  38  12.345   3.909   3.765
  299   HG13  ILE  38          HG11      ILE  38  13.703   4.702   2.974
  300   HG21  ILE  38          HG21      ILE  38  13.868   4.811   0.566
  301   HG22  ILE  38          HG22      ILE  38  12.297   5.590   0.376
  302   HG23  ILE  38          HG23      ILE  38  12.644   4.084  -0.474
  303   HD11  ILE  38          HD11      ILE  38  12.251   6.306   4.079
  304   HD12  ILE  38          HD12      ILE  38  10.885   5.755   3.109
  305   HD13  ILE  38          HD13      ILE  38  12.254   6.554   2.334
  306    H    SER  39           HN       SER  39  11.237   1.276   0.680
  307    HA   SER  39           HA       SER  39  11.035   1.708  -2.113
  308    HB2  SER  39           HB2      SER  39  10.573  -0.856  -0.538
  309    HB3  SER  39           HB1      SER  39  10.813  -0.776  -2.282
  310    HG   SER  39           HG       SER  39  12.798  -1.168  -1.440
  311    H    VAL  40           HN       VAL  40   8.636  -0.135  -0.119
  312    HA   VAL  40           HA       VAL  40   6.615  -0.472  -1.785
  313    HB   VAL  40           HB       VAL  40   4.959  -0.060   0.021
  314   HG11  VAL  40          HG11      VAL  40   7.463  -1.575   0.739
  315   HG12  VAL  40          HG12      VAL  40   6.050  -2.192  -0.118
  316   HG13  VAL  40          HG13      VAL  40   5.922  -1.734   1.580
  317   HG21  VAL  40          HG21      VAL  40   5.733   0.612   2.228
  318   HG22  VAL  40          HG22      VAL  40   6.017   1.893   1.048
  319   HG23  VAL  40          HG23      VAL  40   7.354   0.878   1.590
  320    H    GLY  41           HN       GLY  41   7.294   2.839  -0.481
  321    HA2  GLY  41           HA2      GLY  41   6.718   4.471  -2.372
  322    HA3  GLY  41           HA1      GLY  41   5.104   3.788  -2.260
  323    H    GLY  42           HN       GLY  42   7.381   4.538   0.401
  324    HA2  GLY  42           HA2      GLY  42   5.331   6.486   1.370
  325    HA3  GLY  42           HA1      GLY  42   6.231   5.426   2.430
  326    H    ASP  43           HN       ASP  43   6.255   8.326   0.519
  327    HA   ASP  43           HA       ASP  43   8.987   8.980   1.428
  328    HB2  ASP  43           HB2      ASP  43   7.051  10.428  -0.385
  329    HB3  ASP  43           HB1      ASP  43   8.620  11.083   0.074
  330    H    GLY  44           HN       GLY  44   6.149  11.162   1.201
  331    HA2  GLY  44           HA2      GLY  44   6.196  11.492   4.144
  332    HA3  GLY  44           HA1      GLY  44   6.610  12.896   3.176
  333    H    ARG  45           HN       ARG  45   4.996  13.613   1.541
  334    HA   ARG  45           HA       ARG  45   2.344  13.497   2.811
  335    HB2  ARG  45           HB2      ARG  45   3.516  15.211   0.627
  336    HB3  ARG  45           HB1      ARG  45   1.809  15.258   1.045
  337    HG2  ARG  45           HG2      ARG  45   2.825  17.044   2.199
  338    HG3  ARG  45           HG1      ARG  45   2.515  15.791   3.401
  339    HD2  ARG  45           HD2      ARG  45   4.720  16.760   3.724
  340    HD3  ARG  45           HD1      ARG  45   4.846  15.068   3.251
  341    HE   ARG  45           HE       ARG  45   5.025  17.011   1.061
  342   HH11  ARG  45          HH11      ARG  45   6.780  15.032   3.420
  343   HH12  ARG  45          HH12      ARG  45   8.265  15.083   2.534
  344   HH21  ARG  45          HH21      ARG  45   7.000  17.054  -0.067
  345   HH22  ARG  45          HH22      ARG  45   8.392  16.232   0.555
  346    H    MET  46           HN       MET  46   1.400  11.582   2.354
  347    HA   MET  46           HA       MET  46   1.367  10.598  -0.410
  348    HB2  MET  46           HB2      MET  46   1.404   9.258   1.870
  349    HB3  MET  46           HB1      MET  46  -0.342   9.422   1.743
  350    HG2  MET  46           HG2      MET  46  -0.199   7.513   0.592
  351    HG3  MET  46           HG1      MET  46   0.262   8.560  -0.744
  352    HE1  MET  46           HE1      MET  46   3.159   9.508   0.067
  353    HE2  MET  46           HE2      MET  46   2.756   8.941  -1.554
  354    HE3  MET  46           HE3      MET  46   4.161   8.286  -0.714
  355    H    SER  47           HN       SER  47  -0.808   9.850  -1.343
  356    HA   SER  47           HA       SER  47  -2.565  12.209  -1.277
  357    HB2  SER  47           HB2      SER  47  -1.819  11.271  -3.440
  358    HB3  SER  47           HB1      SER  47  -2.657   9.768  -3.065
  359    HG   SER  47           HG       SER  47  -4.539  10.702  -3.432
  360    H    HIS  48           HN       HIS  48  -3.313   8.729  -1.571
  361    HA   HIS  48           HA       HIS  48  -4.945   8.411   0.735
  362    HB2  HIS  48           HB2      HIS  48  -6.433  10.085  -0.110
  363    HB3  HIS  48           HB1      HIS  48  -6.374   9.397  -1.728
  364    HD1  HIS  48           HD1      HIS  48  -7.929   8.936   1.667
  365    HD2  HIS  48           HD2      HIS  48  -8.056   7.200  -2.148
  366    HE1  HIS  48           HE1      HIS  48  -9.928   7.373   1.657
  367    HE2  HIS  48           HE2      HIS  48  -9.951   6.253  -0.625
  368    H    LYS  49           HN       LYS  49  -5.138   7.724  -2.792
  369    HA   LYS  49           HA       LYS  49  -5.646   4.898  -2.256
  370    HB2  LYS  49           HB2      LYS  49  -5.414   6.684  -4.617
  371    HB3  LYS  49           HB1      LYS  49  -5.035   4.989  -4.874
  372    HG2  LYS  49           HG2      LYS  49  -7.593   5.976  -3.640
  373    HG3  LYS  49           HG1      LYS  49  -7.395   5.604  -5.353
  374    HD2  LYS  49           HD2      LYS  49  -6.889   3.299  -4.838
  375    HD3  LYS  49           HD1      LYS  49  -6.916   3.644  -3.108
  376    HE2  LYS  49           HE2      LYS  49  -9.283   3.983  -4.946
  377    HE3  LYS  49           HE1      LYS  49  -8.981   2.543  -3.974
  378    HZ1  LYS  49           HZ1      LYS  49  -9.412   5.292  -2.928
  379    HZ2  LYS  49           HZ2      LYS  49  -9.082   3.929  -1.982
  380    HZ3  LYS  49           HZ3      LYS  49 -10.522   4.017  -2.864
  381    H    GLU  50           HN       GLU  50  -2.880   6.963  -2.802
  382    HA   GLU  50           HA       GLU  50  -1.057   4.988  -3.749
  383    HB2  GLU  50           HB2      GLU  50  -0.587   7.574  -2.260
  384    HB3  GLU  50           HB1      GLU  50   0.670   6.634  -3.048
  385    HG2  GLU  50           HG2      GLU  50  -1.690   7.914  -4.406
  386    HG3  GLU  50           HG1      GLU  50  -0.033   8.514  -4.416
  387    H    ALA  51           HN       ALA  51  -1.474   6.393  -0.461
  388    HA   ALA  51           HA       ALA  51   0.496   4.964   0.863
  389    HB1  ALA  51           HB1      ALA  51  -0.819   6.685   1.965
  390    HB2  ALA  51           HB2      ALA  51  -0.862   5.199   2.912
  391    HB3  ALA  51           HB3      ALA  51  -2.248   5.653   1.920
  392    H    ILE  52           HN       ILE  52  -2.923   3.802   0.495
  393    HA   ILE  52           HA       ILE  52  -2.320   1.361   1.799
  394    HB   ILE  52           HB       ILE  52  -4.441   1.757  -0.342
  395   HG12  ILE  52          HG12      ILE  52  -4.574   3.433   1.492
  396   HG13  ILE  52          HG11      ILE  52  -5.955   2.354   1.454
  397   HG21  ILE  52          HG21      ILE  52  -4.017  -0.588   0.196
  398   HG22  ILE  52          HG22      ILE  52  -5.608  -0.078   0.763
  399   HG23  ILE  52          HG23      ILE  52  -4.277  -0.247   1.908
  400   HD11  ILE  52          HD11      ILE  52  -5.189   2.790   3.727
  401   HD12  ILE  52          HD12      ILE  52  -3.611   2.114   3.321
  402   HD13  ILE  52          HD13      ILE  52  -5.043   1.084   3.307
  403    H    LEU  53           HN       LEU  53  -2.238   2.265  -1.663
  404    HA   LEU  53           HA       LEU  53  -1.888  -0.313  -2.721
  405    HB2  LEU  53           HB2      LEU  53  -2.175   1.921  -3.949
  406    HB3  LEU  53           HB1      LEU  53  -0.460   2.210  -3.760
  407    HG   LEU  53           HG       LEU  53  -0.016   0.131  -5.064
  408   HD11  LEU  53          HD11      LEU  53  -3.002   0.200  -5.467
  409   HD12  LEU  53          HD12      LEU  53  -2.072  -1.065  -4.665
  410   HD13  LEU  53          HD13      LEU  53  -1.879  -0.791  -6.397
  411   HD21  LEU  53          HD21      LEU  53  -1.661   2.298  -6.363
  412   HD22  LEU  53          HD22      LEU  53  -0.702   1.110  -7.244
  413   HD23  LEU  53          HD23      LEU  53   0.091   2.260  -6.168
  414    H    LEU  54           HN       LEU  54   0.535   1.702  -1.018
  415    HA   LEU  54           HA       LEU  54   2.989   0.722  -1.754
  416    HB2  LEU  54           HB2      LEU  54   1.732   1.379   0.900
  417    HB3  LEU  54           HB1      LEU  54   3.298   0.605   0.912
  418    HG   LEU  54           HG       LEU  54   4.237   2.418  -0.425
  419   HD11  LEU  54          HD11      LEU  54   2.299   3.039  -1.728
  420   HD12  LEU  54          HD12      LEU  54   2.910   4.442  -0.852
  421   HD13  LEU  54          HD13      LEU  54   1.474   3.602  -0.274
  422   HD21  LEU  54          HD21      LEU  54   2.706   3.380   1.986
  423   HD22  LEU  54          HD22      LEU  54   4.095   4.187   1.259
  424   HD23  LEU  54          HD23      LEU  54   4.286   2.600   2.002
  425    H    GLY  55           HN       GLY  55   0.491  -1.024   0.182
  426    HA2  GLY  55           HA2      GLY  55   1.928  -3.174   1.180
  427    HA3  GLY  55           HA1      GLY  55   0.258  -3.268   0.664
  428    H    LEU  56           HN       LEU  56   0.551  -2.949  -2.131
  429    HA   LEU  56           HA       LEU  56   1.008  -5.569  -2.928
  430    HB2  LEU  56           HB2      LEU  56   1.584  -3.191  -4.699
  431    HB3  LEU  56           HB1      LEU  56   1.099  -4.801  -5.201
  432    HG   LEU  56           HG       LEU  56  -0.598  -2.737  -3.803
  433   HD11  LEU  56          HD11      LEU  56  -1.989  -2.999  -5.836
  434   HD12  LEU  56          HD12      LEU  56  -0.736  -4.035  -6.515
  435   HD13  LEU  56          HD13      LEU  56  -0.384  -2.346  -6.159
  436   HD21  LEU  56          HD21      LEU  56  -2.417  -4.464  -4.058
  437   HD22  LEU  56          HD22      LEU  56  -1.217  -4.796  -2.810
  438   HD23  LEU  56          HD23      LEU  56  -1.139  -5.645  -4.354
  439    H    ARG  57           HN       ARG  57   3.401  -2.896  -2.901
  440    HA   ARG  57           HA       ARG  57   5.506  -4.435  -4.067
  441    HB2  ARG  57           HB2      ARG  57   5.460  -1.978  -2.337
  442    HB3  ARG  57           HB1      ARG  57   6.981  -2.717  -2.813
  443    HG2  ARG  57           HG2      ARG  57   5.922  -2.549  -5.218
  444    HG3  ARG  57           HG1      ARG  57   4.974  -1.270  -4.456
  445    HD2  ARG  57           HD2      ARG  57   6.962  -0.337  -5.482
  446    HD3  ARG  57           HD1      ARG  57   7.054  -0.184  -3.728
  447    HE   ARG  57           HE       ARG  57   8.332  -2.596  -4.446
  448   HH11  ARG  57          HH11      ARG  57   8.778   0.890  -4.869
  449   HH12  ARG  57          HH12      ARG  57  10.503   0.777  -4.968
  450   HH21  ARG  57          HH21      ARG  57  10.599  -2.700  -4.586
  451   HH22  ARG  57          HH22      ARG  57  11.537  -1.261  -4.810
  452    H    TYR  58           HN       TYR  58   4.352  -4.073  -0.752
  453    HA   TYR  58           HA       TYR  58   6.552  -5.322   0.561
  454    HB2  TYR  58           HB2      TYR  58   4.968  -4.059   1.841
  455    HB3  TYR  58           HB1      TYR  58   3.632  -5.056   1.289
  456    HD1  TYR  58           HD2      TYR  58   6.884  -5.457   3.098
  457    HD2  TYR  58           HD1      TYR  58   2.812  -6.628   2.752
  458    HE1  TYR  58           HE2      TYR  58   7.133  -6.887   5.084
  459    HE2  TYR  58           HE1      TYR  58   3.047  -8.060   4.735
  460    HH   TYR  58           HH       TYR  58   4.883  -9.232   5.961
  461    H    LYS  59           HN       LYS  59   3.434  -6.622  -0.570
  462    HA   LYS  59           HA       LYS  59   4.163  -9.356   0.110
  463    HB2  LYS  59           HB2      LYS  59   1.836  -8.205  -1.423
  464    HB3  LYS  59           HB1      LYS  59   1.996  -9.897  -0.981
  465    HG2  LYS  59           HG2      LYS  59   1.895  -7.622   0.986
  466    HG3  LYS  59           HG1      LYS  59   0.510  -8.611   0.519
  467    HD2  LYS  59           HD2      LYS  59   1.668 -10.610   1.349
  468    HD3  LYS  59           HD1      LYS  59   3.042  -9.612   1.826
  469    HE2  LYS  59           HE2      LYS  59   1.555  -8.355   3.346
  470    HE3  LYS  59           HE1      LYS  59   0.232  -9.436   2.910
  471    HZ1  LYS  59           HZ1      LYS  59   1.474 -11.286   3.817
  472    HZ2  LYS  59           HZ2      LYS  59   1.298 -10.082   4.992
  473    HZ3  LYS  59           HZ3      LYS  59   2.777 -10.274   4.195
  474    H    LYS  60           HN       LYS  60   4.847  -7.303  -2.517
  475    HA   LYS  60           HA       LYS  60   5.828  -7.676  -4.534
  476    HB2  LYS  60           HB2      LYS  60   6.207 -10.495  -3.506
  477    HB3  LYS  60           HB1      LYS  60   6.937  -9.861  -4.974
  478    HG2  LYS  60           HG2      LYS  60   7.412  -8.810  -2.191
  479    HG3  LYS  60           HG1      LYS  60   8.501  -9.861  -3.098
  480    HD2  LYS  60           HD2      LYS  60   8.779  -8.144  -4.798
  481    HD3  LYS  60           HD1      LYS  60   7.631  -7.100  -3.957
  482    HE2  LYS  60           HE2      LYS  60   9.126  -6.997  -2.030
  483    HE3  LYS  60           HE1      LYS  60  10.265  -8.067  -2.847
  484    HZ1  LYS  60           HZ1      LYS  60  10.875  -5.705  -3.001
  485    HZ2  LYS  60           HZ2      LYS  60   9.448  -5.394  -3.854
  486    HZ3  LYS  60           HZ3      LYS  60  10.628  -6.405  -4.522
  487    H    LEU  61           HN       LEU  61   3.549  -7.263  -5.152
  488    HA   LEU  61           HA       LEU  61   2.837  -9.108  -7.229
  489    HB2  LEU  61           HB2      LEU  61   0.447  -9.472  -6.276
  490    HB3  LEU  61           HB1      LEU  61   1.756 -10.502  -5.741
  491    HG   LEU  61           HG       LEU  61   1.966  -9.196  -3.676
  492   HD11  LEU  61          HD11      LEU  61  -0.396  -7.641  -4.716
  493   HD12  LEU  61          HD12      LEU  61   1.244  -7.027  -4.513
  494   HD13  LEU  61          HD13      LEU  61   0.302  -7.506  -3.102
  495   HD21  LEU  61          HD21      LEU  61   0.486 -11.134  -3.722
  496   HD22  LEU  61          HD22      LEU  61  -0.854 -10.106  -4.232
  497   HD23  LEU  61          HD23      LEU  61  -0.131  -9.886  -2.639
  498    H    TYR  62           HN       TYR  62   3.383  -6.238  -6.826
  499    HA   TYR  62           HA       TYR  62   1.006  -4.714  -7.018
  500    HB2  TYR  62           HB2      TYR  62   3.208  -3.740  -6.575
  501    HB3  TYR  62           HB1      TYR  62   3.735  -4.162  -8.201
  502    HD1  TYR  62           HD2      TYR  62   2.772  -2.970 -10.157
  503    HD2  TYR  62           HD1      TYR  62   1.888  -1.796  -6.164
  504    HE1  TYR  62           HE2      TYR  62   1.965  -0.800 -10.981
  505    HE2  TYR  62           HE1      TYR  62   1.081   0.377  -6.977
  506    HH   TYR  62           HH       TYR  62   1.429   1.845  -8.986
  507    H    ASN  63           HN       ASN  63   2.732  -6.602  -9.429
  508    HA   ASN  63           HA       ASN  63   1.737  -5.382 -11.761
  509    HB2  ASN  63           HB2      ASN  63   2.171  -7.605 -12.852
  510    HB3  ASN  63           HB1      ASN  63   3.524  -6.936 -11.949
  511   HD21  ASN  63          HD21      ASN  63   1.305  -9.537 -12.306
  512   HD22  ASN  63          HD22      ASN  63   1.940 -10.544 -10.959
  513    H    GLN  64           HN       GLN  64   0.354  -8.329 -10.157
  514    HA   GLN  64           HA       GLN  64  -2.046  -7.888 -11.817
  515    HB2  GLN  64           HB2      GLN  64  -2.738 -10.156 -11.097
  516    HB3  GLN  64           HB1      GLN  64  -1.194 -10.125 -11.929
  517    HG2  GLN  64           HG2      GLN  64  -0.915 -11.622 -10.158
  518    HG3  GLN  64           HG1      GLN  64  -0.112 -10.143  -9.638
  519   HE21  GLN  64          HE21      GLN  64  -0.783  -9.091  -7.837
  520   HE22  GLN  64          HE22      GLN  64  -2.136  -9.676  -6.806
  521    H    ALA  65           HN       ALA  65  -1.048  -6.949  -8.745
  522    HA   ALA  65           HA       ALA  65  -3.564  -7.524  -7.399
  523    HB1  ALA  65           HB1      ALA  65  -1.578  -7.401  -6.078
  524    HB2  ALA  65           HB2      ALA  65  -2.640  -6.074  -5.610
  525    HB3  ALA  65           HB3      ALA  65  -1.245  -5.765  -6.642
  526    H    ARG  66           HN       ARG  66  -2.074  -4.663  -8.913
  527    HA   ARG  66           HA       ARG  66  -4.257  -2.920  -8.172
  528    HB2  ARG  66           HB2      ARG  66  -1.844  -2.285  -8.741
  529    HB3  ARG  66           HB1      ARG  66  -2.322  -2.444 -10.427
  530    HG2  ARG  66           HG2      ARG  66  -4.076  -0.752 -10.056
  531    HG3  ARG  66           HG1      ARG  66  -3.496  -0.551  -8.402
  532    HD2  ARG  66           HD2      ARG  66  -2.500   1.186  -9.645
  533    HD3  ARG  66           HD1      ARG  66  -1.235  -0.015  -9.405
  534    HE   ARG  66           HE       ARG  66  -2.276  -0.742 -11.817
  535   HH11  ARG  66          HH11      ARG  66  -1.111   2.340 -10.521
  536   HH12  ARG  66          HH12      ARG  66  -0.600   2.932 -12.065
  537   HH21  ARG  66          HH21      ARG  66  -1.589   0.075 -13.826
  538   HH22  ARG  66          HH22      ARG  66  -0.872   1.648 -13.941
  539    H    VAL  67           HN       VAL  67  -3.631  -5.053 -10.905
  540    HA   VAL  67           HA       VAL  67  -5.815  -3.803 -12.446
  541    HB   VAL  67           HB       VAL  67  -5.244  -5.406 -14.225
  542   HG11  VAL  67          HG11      VAL  67  -3.035  -4.489 -14.764
  543   HG12  VAL  67          HG12      VAL  67  -2.881  -3.901 -13.108
  544   HG13  VAL  67          HG13      VAL  67  -4.134  -3.248 -14.163
  545   HG21  VAL  67          HG21      VAL  67  -3.145  -6.369 -12.282
  546   HG22  VAL  67          HG22      VAL  67  -3.192  -6.779 -13.996
  547   HG23  VAL  67          HG23      VAL  67  -4.498  -7.297 -12.930
  548    H    LYS  68           HN       LYS  68  -5.085  -6.907 -10.834
  549    HA   LYS  68           HA       LYS  68  -7.566  -8.132 -11.666
  550    HB2  LYS  68           HB2      LYS  68  -5.434  -9.314 -10.949
  551    HB3  LYS  68           HB1      LYS  68  -5.888  -8.934  -9.294
  552    HG2  LYS  68           HG2      LYS  68  -7.882 -10.244  -9.478
  553    HG3  LYS  68           HG1      LYS  68  -7.602 -10.509 -11.201
  554    HD2  LYS  68           HD2      LYS  68  -5.399 -11.588 -10.506
  555    HD3  LYS  68           HD1      LYS  68  -6.045 -11.585  -8.863
  556    HE2  LYS  68           HE2      LYS  68  -7.993 -12.871  -9.662
  557    HE3  LYS  68           HE1      LYS  68  -7.277 -12.920 -11.272
  558    HZ1  LYS  68           HZ1      LYS  68  -6.070 -14.074  -8.815
  559    HZ2  LYS  68           HZ2      LYS  68  -5.399 -14.135 -10.367
  560    HZ3  LYS  68           HZ3      LYS  68  -6.843 -14.953 -10.038
  561    H    TYR  69           HN       TYR  69  -6.521  -6.308  -8.809
  562    HA   TYR  69           HA       TYR  69  -9.268  -6.611  -7.695
  563    HB2  TYR  69           HB2      TYR  69  -6.655  -5.803  -6.409
  564    HB3  TYR  69           HB1      TYR  69  -8.210  -5.671  -5.597
  565    HD1  TYR  69           HD1      TYR  69  -5.869  -8.095  -7.157
  566    HD2  TYR  69           HD2      TYR  69  -9.180  -7.539  -4.542
  567    HE1  TYR  69           HE1      TYR  69  -5.684 -10.438  -6.432
  568    HE2  TYR  69           HE2      TYR  69  -8.999  -9.878  -3.811
  569    HH   TYR  69           HH       TYR  69  -6.334 -11.789  -4.376
  570    H    SER  70           HN       SER  70 -10.170  -4.662  -6.564
  571    HA   SER  70           HA       SER  70  -9.987  -2.407  -8.426
  572    HB2  SER  70           HB2      SER  70 -12.177  -3.208  -7.594
  573    HB3  SER  70           HB1      SER  70 -11.709  -2.745  -5.958
  574    HG   SER  70           HG       SER  70 -12.038  -0.705  -6.432
  575    H    LEU  71           HN       LEU  71  -7.988  -1.464  -8.117
  576    HA   LEU  71           HA       LEU  71  -7.705  -0.056  -5.500
  577    HB2  LEU  71           HB2      LEU  71  -5.560  -1.333  -7.193
  578    HB3  LEU  71           HB1      LEU  71  -5.207  -0.162  -5.940
  579    HG   LEU  71           HG       LEU  71  -6.395  -1.750  -4.328
  580   HD11  LEU  71          HD11      LEU  71  -7.571  -3.187  -5.788
  581   HD12  LEU  71          HD12      LEU  71  -6.274  -4.153  -5.087
  582   HD13  LEU  71          HD13      LEU  71  -6.123  -3.535  -6.732
  583   HD21  LEU  71          HD21      LEU  71  -4.016  -1.484  -4.264
  584   HD22  LEU  71          HD22      LEU  71  -3.814  -2.524  -5.673
  585   HD23  LEU  71          HD23      LEU  71  -4.383  -3.205  -4.150
  586    H    LEU  72           HN       LEU  72  -5.948   0.064  -8.624
  587    HA   LEU  72           HA       LEU  72  -6.867   2.887  -8.901
  588    HB2  LEU  72           HB2      LEU  72  -4.083   1.782  -9.174
  589    HB3  LEU  72           HB1      LEU  72  -4.556   3.260  -9.982
  590    HG   LEU  72           HG       LEU  72  -3.435   3.881  -7.988
  591   HD11  LEU  72          HD11      LEU  72  -6.384   4.135  -7.433
  592   HD12  LEU  72          HD12      LEU  72  -5.471   5.160  -8.540
  593   HD13  LEU  72          HD13      LEU  72  -5.093   5.168  -6.819
  594   HD21  LEU  72          HD21      LEU  72  -3.743   1.654  -6.872
  595   HD22  LEU  72          HD22      LEU  72  -5.346   2.201  -6.382
  596   HD23  LEU  72          HD23      LEU  72  -3.912   3.056  -5.816
  597    H    GLU  73           HN       GLU  73  -4.713   0.856 -10.898
  598    HA   GLU  73           HA       GLU  73  -6.787   0.962 -13.039
  599    HB2  GLU  73           HB2      GLU  73  -3.799   1.326 -13.249
  600    HB3  GLU  73           HB1      GLU  73  -4.799   0.935 -14.639
  601    HG2  GLU  73           HG2      GLU  73  -4.473   3.269 -14.669
  602    HG3  GLU  73           HG1      GLU  73  -6.131   3.000 -14.140
  Start of MODEL   11
    1    H1   SER   1           HT1      SER   1   0.150  16.998   8.450
    2    H2   SER   1           HT2      SER   1  -1.194  16.759   9.448
    3    H3   SER   1           HT3      SER   1  -1.256  16.295   7.823
    4    HA   SER   1           HA       SER   1   0.493  15.117   9.905
    5    HB2  SER   1           HB2      SER   1  -1.958  14.010   8.507
    6    HB3  SER   1           HB1      SER   1  -0.911  13.092   9.589
    7    HG   SER   1           HG       SER   1  -2.155  13.834  11.103
    8    H    ASP   2           HN       ASP   2   1.535  13.095   9.214
    9    HA   ASP   2           HA       ASP   2   2.287  13.270   6.329
   10    HB2  ASP   2           HB2      ASP   2   4.050  13.793   8.105
   11    HB3  ASP   2           HB1      ASP   2   3.982  12.087   8.530
   12    H    VAL   3           HN       VAL   3   2.954  11.238   5.294
   13    HA   VAL   3           HA       VAL   3   0.964   9.227   5.631
   14    HB   VAL   3           HB       VAL   3   2.222   9.663   3.517
   15   HG11  VAL   3          HG11      VAL   3   4.416   8.012   4.758
   16   HG12  VAL   3          HG12      VAL   3   4.476   9.764   4.588
   17   HG13  VAL   3          HG13      VAL   3   4.397   8.742   3.154
   18   HG21  VAL   3          HG21      VAL   3   2.389   7.262   2.866
   19   HG22  VAL   3          HG22      VAL   3   0.879   7.690   3.668
   20   HG23  VAL   3          HG23      VAL   3   2.140   6.837   4.559
   21    H    TRP   4           HN       TRP   4   4.231   9.565   6.934
   22    HA   TRP   4           HA       TRP   4   4.305   6.836   7.925
   23    HB2  TRP   4           HB2      TRP   4   6.243   8.610   7.362
   24    HB3  TRP   4           HB1      TRP   4   6.091   8.901   9.092
   25    HD1  TRP   4           HD1      TRP   4   5.854   6.126  10.336
   26    HE1  TRP   4           HE1      TRP   4   7.720   4.332  10.151
   27    HE3  TRP   4           HE3      TRP   4   8.242   7.949   6.196
   28    HZ2  TRP   4           HZ2      TRP   4   9.907   3.816   8.433
   29    HZ3  TRP   4           HZ3      TRP   4  10.215   6.747   5.348
   30    HH2  TRP   4           HH2      TRP   4  11.028   4.723   6.445
   31    H    SER   5           HN       SER   5   3.539  10.050   9.234
   32    HA   SER   5           HA       SER   5   3.356   9.254  11.969
   33    HB2  SER   5           HB2      SER   5   1.942  11.472  10.464
   34    HB3  SER   5           HB1      SER   5   1.930  11.299  12.219
   35    HG   SER   5           HG       SER   5   3.955  12.143  10.526
   36    H    LEU   6           HN       LEU   6   0.861   9.555   9.412
   37    HA   LEU   6           HA       LEU   6  -1.020   8.072  11.166
   38    HB2  LEU   6           HB2      LEU   6  -1.487   9.501   8.543
   39    HB3  LEU   6           HB1      LEU   6  -2.725   8.705   9.493
   40    HG   LEU   6           HG       LEU   6  -1.136  11.134  10.322
   41   HD11  LEU   6          HD11      LEU   6  -3.289  12.283  10.180
   42   HD12  LEU   6          HD12      LEU   6  -4.042  10.801   9.594
   43   HD13  LEU   6          HD13      LEU   6  -2.811  11.609   8.622
   44   HD21  LEU   6          HD21      LEU   6  -3.315   9.637  11.776
   45   HD22  LEU   6          HD22      LEU   6  -2.632  11.186  12.272
   46   HD23  LEU   6          HD23      LEU   6  -1.620   9.742  12.252
   47    H    SER   7           HN       SER   7  -0.161   6.005  11.034
   48    HA   SER   7           HA       SER   7  -0.428   4.755   8.334
   49    HB2  SER   7           HB2      SER   7   1.603   4.180  10.499
   50    HB3  SER   7           HB1      SER   7   1.371   3.170   9.074
   51    HG   SER   7           HG       SER   7   3.042   4.682   8.753
   52    H    LYS   8           HN       LYS   8  -2.084   4.984  11.067
   53    HA   LYS   8           HA       LYS   8  -2.506   2.105  11.510
   54    HB2  LYS   8           HB2      LYS   8  -3.723   4.540  12.820
   55    HB3  LYS   8           HB1      LYS   8  -4.066   2.881  13.284
   56    HG2  LYS   8           HG2      LYS   8  -1.333   4.137  13.358
   57    HG3  LYS   8           HG1      LYS   8  -2.418   4.010  14.743
   58    HD2  LYS   8           HD2      LYS   8  -2.381   1.581  14.570
   59    HD3  LYS   8           HD1      LYS   8  -1.352   1.684  13.139
   60    HE2  LYS   8           HE2      LYS   8   0.421   2.687  14.446
   61    HE3  LYS   8           HE1      LYS   8  -0.610   2.711  15.876
   62    HZ1  LYS   8           HZ1      LYS   8   0.281   0.257  14.458
   63    HZ2  LYS   8           HZ2      LYS   8  -0.647   0.311  15.872
   64    HZ3  LYS   8           HZ3      LYS   8   0.955   0.853  15.890
   65    H    THR   9           HN       THR   9  -4.128   4.876  10.030
   66    HA   THR   9           HA       THR   9  -6.715   3.715   9.786
   67    HB   THR   9           HB       THR   9  -7.023   5.340   7.890
   68    HG1  THR   9           HG1      THR   9  -5.276   6.122   7.003
   69   HG21  THR   9          HG21      THR   9  -5.811   6.496  10.404
   70   HG22  THR   9          HG22      THR   9  -7.480   5.949  10.235
   71   HG23  THR   9          HG23      THR   9  -6.903   7.324   9.292
   72    H    SER  10           HN       SER  10  -7.060   1.758   8.943
   73    HA   SER  10           HA       SER  10  -5.506   0.849   6.628
   74    HB2  SER  10           HB2      SER  10  -6.846  -1.236   6.883
   75    HB3  SER  10           HB1      SER  10  -6.015  -0.770   8.364
   76    HG   SER  10           HG       SER  10  -7.878  -0.536   9.309
   77    H    MET  11           HN       MET  11  -6.693  -0.285   4.817
   78    HA   MET  11           HA       MET  11  -9.130   1.245   4.050
   79    HB2  MET  11           HB2      MET  11  -7.086   2.142   2.903
   80    HB3  MET  11           HB1      MET  11  -6.865   0.559   2.169
   81    HG2  MET  11           HG2      MET  11  -7.923   2.040   0.603
   82    HG3  MET  11           HG1      MET  11  -9.056   0.776   1.082
   83    HE1  MET  11           HE1      MET  11 -11.419   3.837   0.519
   84    HE2  MET  11           HE2      MET  11 -11.123   2.140   0.143
   85    HE3  MET  11           HE3      MET  11  -9.997   3.377  -0.416
   86    H    THR  12           HN       THR  12 -10.624   0.153   2.730
   87    HA   THR  12           HA       THR  12 -10.354  -2.779   2.963
   88    HB   THR  12           HB       THR  12 -12.760  -1.144   2.140
   89    HG1  THR  12           HG1      THR  12 -13.144  -0.942   4.213
   90   HG21  THR  12          HG21      THR  12 -14.010  -3.219   2.661
   91   HG22  THR  12          HG22      THR  12 -12.475  -4.055   2.898
   92   HG23  THR  12          HG23      THR  12 -12.897  -3.419   1.308
   93    H    PHE  13           HN       PHE  13  -9.934  -4.100   1.362
   94    HA   PHE  13           HA       PHE  13  -9.760  -3.025  -1.387
   95    HB2  PHE  13           HB2      PHE  13  -8.742  -5.502  -0.021
   96    HB3  PHE  13           HB1      PHE  13  -8.745  -5.364  -1.772
   97    HD1  PHE  13           HD2      PHE  13  -7.313  -3.733  -2.893
   98    HD2  PHE  13           HD1      PHE  13  -7.185  -4.288   1.324
   99    HE1  PHE  13           HE2      PHE  13  -5.151  -2.562  -2.809
  100    HE2  PHE  13           HE1      PHE  13  -5.024  -3.120   1.415
  101    HZ   PHE  13           HZ       PHE  13  -4.003  -2.257  -0.652
  102    H    GLN  14           HN       GLN  14 -10.917  -3.736  -3.106
  103    HA   GLN  14           HA       GLN  14 -13.003  -5.775  -2.519
  104    HB2  GLN  14           HB2      GLN  14 -13.942  -3.460  -2.440
  105    HB3  GLN  14           HB1      GLN  14 -13.447  -3.242  -4.112
  106    HG2  GLN  14           HG2      GLN  14 -15.787  -3.767  -4.020
  107    HG3  GLN  14           HG1      GLN  14 -14.915  -5.105  -4.765
  108   HE21  GLN  14          HE21      GLN  14 -16.657  -3.982  -1.943
  109   HE22  GLN  14          HE22      GLN  14 -16.903  -5.608  -1.216
  110    HA   PRO  15           HA       PRO  15 -10.761  -7.428  -6.099
  111    HB2  PRO  15           HB2      PRO  15 -12.731  -9.593  -5.741
  112    HB3  PRO  15           HB1      PRO  15 -10.969  -9.666  -5.809
  113    HG2  PRO  15           HG2      PRO  15 -12.292 -10.007  -3.511
  114    HG3  PRO  15           HG1      PRO  15 -10.726  -9.178  -3.569
  115    HD2  PRO  15           HD2      PRO  15 -13.471  -8.035  -3.313
  116    HD3  PRO  15           HD1      PRO  15 -11.961  -7.519  -2.537
  117    H    LYS  16           HN       LYS  16 -11.153  -7.454  -8.246
  118    HA   LYS  16           HA       LYS  16 -13.589  -6.232  -9.159
  119    HB2  LYS  16           HB2      LYS  16 -11.436  -7.646 -10.752
  120    HB3  LYS  16           HB1      LYS  16 -12.662  -6.567 -11.404
  121    HG2  LYS  16           HG2      LYS  16 -11.704  -4.793  -9.861
  122    HG3  LYS  16           HG1      LYS  16 -10.346  -5.891  -9.620
  123    HD2  LYS  16           HD2      LYS  16  -9.968  -5.905 -12.060
  124    HD3  LYS  16           HD1      LYS  16 -11.281  -4.741 -12.249
  125    HE2  LYS  16           HE2      LYS  16 -10.045  -3.179 -10.773
  126    HE3  LYS  16           HE1      LYS  16  -8.710  -4.328 -10.727
  127    HZ1  LYS  16           HZ1      LYS  16  -8.489  -4.101 -13.128
  128    HZ2  LYS  16           HZ2      LYS  16  -8.322  -2.602 -12.363
  129    HZ3  LYS  16           HZ3      LYS  16  -9.762  -2.988 -13.161
  130    H    LYS  17           HN       LYS  17 -12.390  -9.553  -8.969
  131    HA   LYS  17           HA       LYS  17 -14.867 -10.526 -10.294
  132    HB2  LYS  17           HB2      LYS  17 -12.291 -11.952  -9.604
  133    HB3  LYS  17           HB1      LYS  17 -13.690 -12.727 -10.330
  134    HG2  LYS  17           HG2      LYS  17 -12.218 -12.309 -12.102
  135    HG3  LYS  17           HG1      LYS  17 -13.458 -11.060 -12.226
  136    HD2  LYS  17           HD2      LYS  17 -11.985  -9.443 -11.196
  137    HD3  LYS  17           HD1      LYS  17 -10.766 -10.685 -10.913
  138    HE2  LYS  17           HE2      LYS  17 -10.529 -10.997 -13.329
  139    HE3  LYS  17           HE1      LYS  17 -11.751  -9.757 -13.609
  140    HZ1  LYS  17           HZ1      LYS  17  -9.532  -8.859 -13.860
  141    HZ2  LYS  17           HZ2      LYS  17  -9.121  -9.339 -12.292
  142    HZ3  LYS  17           HZ3      LYS  17 -10.296  -8.145 -12.529
  143    H    ALA  18           HN       ALA  18 -15.869 -12.515  -9.380
  144    HA   ALA  18           HA       ALA  18 -16.444 -12.051  -6.569
  145    HB1  ALA  18           HB1      ALA  18 -17.360 -14.282  -8.380
  146    HB2  ALA  18           HB2      ALA  18 -18.175 -12.731  -8.173
  147    HB3  ALA  18           HB3      ALA  18 -18.055 -13.852  -6.816
  148    H    SER  19           HN       SER  19 -14.622 -14.449  -8.447
  149    HA   SER  19           HA       SER  19 -14.242 -16.388  -6.443
  150    HB2  SER  19           HB2      SER  19 -12.176 -16.997  -7.699
  151    HB3  SER  19           HB1      SER  19 -13.579 -16.785  -8.745
  152    HG   SER  19           HG       SER  19 -11.234 -15.382  -8.657
  153    H    LEU  20           HN       LEU  20 -12.451 -13.374  -7.064
  154    HA   LEU  20           HA       LEU  20 -10.418 -13.858  -5.101
  155    HB2  LEU  20           HB2      LEU  20 -11.458 -11.302  -6.310
  156    HB3  LEU  20           HB1      LEU  20 -10.033 -11.399  -5.299
  157    HG   LEU  20           HG       LEU  20 -10.324 -12.869  -7.917
  158   HD11  LEU  20          HD11      LEU  20  -8.951 -10.247  -7.339
  159   HD12  LEU  20          HD12      LEU  20 -10.405 -10.471  -8.312
  160   HD13  LEU  20          HD13      LEU  20  -8.867 -11.143  -8.858
  161   HD21  LEU  20          HD21      LEU  20  -7.894 -13.105  -7.739
  162   HD22  LEU  20          HD22      LEU  20  -8.718 -13.856  -6.371
  163   HD23  LEU  20          HD23      LEU  20  -7.929 -12.291  -6.174
  164    H    GLN  21           HN       GLN  21 -10.066 -12.545  -3.125
  165    HA   GLN  21           HA       GLN  21 -12.653 -12.067  -1.719
  166    HB2  GLN  21           HB2      GLN  21 -10.082 -13.176  -0.573
  167    HB3  GLN  21           HB1      GLN  21 -11.540 -12.829   0.346
  168    HG2  GLN  21           HG2      GLN  21 -12.747 -14.551  -0.774
  169    HG3  GLN  21           HG1      GLN  21 -11.433 -14.798  -1.924
  170   HE21  GLN  21          HE21      GLN  21  -9.539 -15.849  -1.285
  171   HE22  GLN  21          HE22      GLN  21  -9.501 -16.848   0.209
  172    HA   PRO  22           HA       PRO  22 -11.176  -7.954  -1.009
  173    HB2  PRO  22           HB2      PRO  22 -12.551  -7.364   1.277
  174    HB3  PRO  22           HB1      PRO  22 -13.275  -7.365  -0.334
  175    HG2  PRO  22           HG2      PRO  22 -13.367  -9.466   1.787
  176    HG3  PRO  22           HG1      PRO  22 -14.658  -8.901   0.712
  177    HD2  PRO  22           HD2      PRO  22 -13.310 -11.202   0.273
  178    HD3  PRO  22           HD1      PRO  22 -13.928 -10.193  -1.052
  179    H    LEU  23           HN       LEU  23 -10.267  -6.530   0.775
  180    HA   LEU  23           HA       LEU  23  -8.820  -8.076   2.845
  181    HB2  LEU  23           HB2      LEU  23  -7.492  -7.864   0.642
  182    HB3  LEU  23           HB1      LEU  23  -7.325  -6.175   1.066
  183    HG   LEU  23           HG       LEU  23  -6.256  -6.904   3.221
  184   HD11  LEU  23          HD11      LEU  23  -5.369  -9.194   3.303
  185   HD12  LEU  23          HD12      LEU  23  -6.282  -9.585   1.845
  186   HD13  LEU  23          HD13      LEU  23  -7.133  -9.160   3.329
  187   HD21  LEU  23          HD21      LEU  23  -4.945  -6.124   1.316
  188   HD22  LEU  23          HD22      LEU  23  -4.908  -7.762   0.665
  189   HD23  LEU  23          HD23      LEU  23  -4.102  -7.402   2.191
  190    H    THR  24           HN       THR  24  -7.725  -6.670   4.450
  191    HA   THR  24           HA       THR  24  -8.527  -3.846   4.426
  192    HB   THR  24           HB       THR  24  -9.459  -5.602   6.706
  193    HG1  THR  24           HG1      THR  24 -10.958  -4.395   4.594
  194   HG21  THR  24          HG21      THR  24 -10.688  -3.569   7.388
  195   HG22  THR  24          HG22      THR  24  -9.921  -2.684   6.068
  196   HG23  THR  24          HG23      THR  24  -8.941  -3.326   7.386
  197    H    ILE  25           HN       ILE  25  -6.263  -3.526   4.347
  198    HA   ILE  25           HA       ILE  25  -5.006  -3.866   7.023
  199    HB   ILE  25           HB       ILE  25  -4.218  -5.606   5.332
  200   HG12  ILE  25          HG12      ILE  25  -1.799  -5.278   5.984
  201   HG13  ILE  25          HG11      ILE  25  -2.265  -3.735   6.684
  202   HG21  ILE  25          HG21      ILE  25  -4.115  -4.032   3.417
  203   HG22  ILE  25          HG22      ILE  25  -2.631  -4.951   3.662
  204   HG23  ILE  25          HG23      ILE  25  -2.717  -3.265   4.173
  205   HD11  ILE  25          HD11      ILE  25  -3.385  -6.402   7.506
  206   HD12  ILE  25          HD12      ILE  25  -3.705  -4.841   8.263
  207   HD13  ILE  25          HD13      ILE  25  -2.089  -5.544   8.338
  208    H    SER  26           HN       SER  26  -3.295  -2.381   7.522
  209    HA   SER  26           HA       SER  26  -3.499   0.129   5.915
  210    HB2  SER  26           HB2      SER  26  -4.478   0.207   8.219
  211    HB3  SER  26           HB1      SER  26  -2.874  -0.132   8.863
  212    HG   SER  26           HG       SER  26  -2.438   1.896   8.648
  213    H    LEU  27           HN       LEU  27  -1.584   1.662   6.580
  214    HA   LEU  27           HA       LEU  27   0.796   0.695   5.417
  215    HB2  LEU  27           HB2      LEU  27   0.544   2.941   7.395
  216    HB3  LEU  27           HB1      LEU  27   1.823   2.718   6.219
  217    HG   LEU  27           HG       LEU  27  -1.059   3.412   5.654
  218   HD11  LEU  27          HD11      LEU  27   0.246   5.288   6.423
  219   HD12  LEU  27          HD12      LEU  27  -0.059   5.450   4.693
  220   HD13  LEU  27          HD13      LEU  27   1.522   4.917   5.265
  221   HD21  LEU  27          HD21      LEU  27  -0.233   1.855   3.960
  222   HD22  LEU  27          HD22      LEU  27   1.176   2.881   3.698
  223   HD23  LEU  27          HD23      LEU  27  -0.435   3.475   3.297
  224    H    ASP  28           HN       ASP  28   0.359   1.532   8.870
  225    HA   ASP  28           HA       ASP  28   2.830   0.374   9.691
  226    HB2  ASP  28           HB2      ASP  28   1.556   2.056  10.992
  227    HB3  ASP  28           HB1      ASP  28   0.337   0.837  11.345
  228    H    GLU  29           HN       GLU  29  -0.442  -0.933   9.401
  229    HA   GLU  29           HA       GLU  29   0.174  -3.387  10.800
  230    HB2  GLU  29           HB2      GLU  29  -2.116  -2.431   9.114
  231    HB3  GLU  29           HB1      GLU  29  -2.028  -4.103   9.645
  232    HG2  GLU  29           HG2      GLU  29  -3.426  -2.835  11.130
  233    HG3  GLU  29           HG1      GLU  29  -1.971  -3.354  11.975
  234    H    LEU  30           HN       LEU  30   0.922  -2.286   7.622
  235    HA   LEU  30           HA       LEU  30   1.263  -5.132   6.812
  236    HB2  LEU  30           HB2      LEU  30  -0.455  -3.846   5.522
  237    HB3  LEU  30           HB1      LEU  30   0.822  -2.786   4.962
  238    HG   LEU  30           HG       LEU  30   1.907  -4.706   3.847
  239   HD11  LEU  30          HD11      LEU  30  -0.537  -6.205   4.771
  240   HD12  LEU  30          HD12      LEU  30   1.133  -6.508   5.252
  241   HD13  LEU  30          HD13      LEU  30   0.628  -6.796   3.587
  242   HD21  LEU  30          HD21      LEU  30  -0.980  -4.363   3.061
  243   HD22  LEU  30          HD22      LEU  30   0.345  -4.889   2.022
  244   HD23  LEU  30          HD23      LEU  30   0.319  -3.243   2.655
  245    H    PHE  31           HN       PHE  31   3.094  -2.823   8.027
  246    HA   PHE  31           HA       PHE  31   5.327  -3.668   6.308
  247    HB2  PHE  31           HB2      PHE  31   5.027  -0.793   7.221
  248    HB3  PHE  31           HB1      PHE  31   6.371  -1.436   6.285
  249    HD1  PHE  31           HD1      PHE  31   5.242  -2.928   4.156
  250    HD2  PHE  31           HD2      PHE  31   3.757   0.626   5.965
  251    HE1  PHE  31           HE1      PHE  31   4.044  -2.372   2.081
  252    HE2  PHE  31           HE2      PHE  31   2.555   1.184   3.895
  253    HZ   PHE  31           HZ       PHE  31   2.696  -0.318   1.950
  254    H    SER  32           HN       SER  32   7.314  -4.017   7.307
  255    HA   SER  32           HA       SER  32   7.374  -3.491  10.230
  256    HB2  SER  32           HB2      SER  32   8.134  -6.073   8.867
  257    HB3  SER  32           HB1      SER  32   8.377  -5.724  10.579
  258    HG   SER  32           HG       SER  32   6.455  -6.648  10.650
  259    H    SER  33           HN       SER  33   8.620  -1.976   8.090
  260    HA   SER  33           HA       SER  33  11.332  -1.958   9.059
  261    HB2  SER  33           HB2      SER  33  11.635  -3.860   7.593
  262    HB3  SER  33           HB1      SER  33  10.859  -3.008   6.261
  263    HG   SER  33           HG       SER  33  13.359  -2.459   7.470
  264    H    ARG  34           HN       ARG  34  12.207   0.042   8.836
  265    HA   ARG  34           HA       ARG  34  10.593   2.110   7.703
  266    HB2  ARG  34           HB2      ARG  34  12.435   3.609   8.191
  267    HB3  ARG  34           HB1      ARG  34  12.213   2.492   9.528
  268    HG2  ARG  34           HG2      ARG  34  14.109   1.164   8.733
  269    HG3  ARG  34           HG1      ARG  34  14.334   2.296   7.397
  270    HD2  ARG  34           HD2      ARG  34  14.661   4.111   9.062
  271    HD3  ARG  34           HD1      ARG  34  14.571   2.904  10.343
  272    HE   ARG  34           HE       ARG  34  16.554   2.020   8.576
  273   HH11  ARG  34          HH11      ARG  34  15.977   4.822  10.666
  274   HH12  ARG  34          HH12      ARG  34  17.661   5.117  10.938
  275   HH21  ARG  34          HH21      ARG  34  18.760   2.444   8.964
  276   HH22  ARG  34          HH22      ARG  34  19.241   3.767   9.973
  277    H    GLY  35           HN       GLY  35  13.416   0.313   6.488
  278    HA2  GLY  35           HA2      GLY  35  13.721   1.881   4.096
  279    HA3  GLY  35           HA1      GLY  35  14.346   0.260   4.363
  280    H    GLU  36           HN       GLU  36  11.862  -1.045   4.902
  281    HA   GLU  36           HA       GLU  36  11.036  -1.731   2.293
  282    HB2  GLU  36           HB2      GLU  36  10.614  -3.194   4.176
  283    HB3  GLU  36           HB1      GLU  36   9.585  -1.988   4.935
  284    HG2  GLU  36           HG2      GLU  36   8.199  -3.678   3.987
  285    HG3  GLU  36           HG1      GLU  36   8.008  -2.208   3.035
  286    H    PHE  37           HN       PHE  37   9.696   0.590   4.631
  287    HA   PHE  37           HA       PHE  37   7.386   1.323   3.176
  288    HB2  PHE  37           HB2      PHE  37   7.992   1.956   5.555
  289    HB3  PHE  37           HB1      PHE  37   9.052   3.187   4.878
  290    HD1  PHE  37           HD2      PHE  37   5.514   2.047   4.893
  291    HD2  PHE  37           HD1      PHE  37   8.220   5.290   4.367
  292    HE1  PHE  37           HE2      PHE  37   3.615   3.607   4.779
  293    HE2  PHE  37           HE1      PHE  37   6.327   6.856   4.255
  294    HZ   PHE  37           HZ       PHE  37   4.021   6.015   4.460
  295    H    ILE  38           HN       ILE  38  10.730   2.591   3.059
  296    HA   ILE  38           HA       ILE  38  10.327   4.676   1.240
  297    HB   ILE  38           HB       ILE  38  12.722   2.841   1.424
  298   HG12  ILE  38          HG12      ILE  38  12.277   3.853   3.566
  299   HG13  ILE  38          HG11      ILE  38  13.644   4.689   2.840
  300   HG21  ILE  38          HG21      ILE  38  12.804   4.063  -0.644
  301   HG22  ILE  38          HG22      ILE  38  13.964   4.772   0.479
  302   HG23  ILE  38          HG23      ILE  38  12.420   5.572   0.184
  303   HD11  ILE  38          HD11      ILE  38  12.180   6.521   2.179
  304   HD12  ILE  38          HD12      ILE  38  12.116   6.241   3.919
  305   HD13  ILE  38          HD13      ILE  38  10.801   5.678   2.887
  306    H    SER  39           HN       SER  39  11.181   1.243   0.482
  307    HA   SER  39           HA       SER  39  11.173   1.623  -2.337
  308    HB2  SER  39           HB2      SER  39  10.537  -0.894  -0.740
  309    HB3  SER  39           HB1      SER  39  10.882  -0.856  -2.469
  310    HG   SER  39           HG       SER  39  12.954  -0.315  -2.057
  311    H    VAL  40           HN       VAL  40   8.615  -0.095  -0.423
  312    HA   VAL  40           HA       VAL  40   6.670  -0.399  -2.192
  313    HB   VAL  40           HB       VAL  40   4.951   0.053  -0.470
  314   HG11  VAL  40          HG11      VAL  40   6.103  -2.088  -0.561
  315   HG12  VAL  40          HG12      VAL  40   5.743  -1.643   1.106
  316   HG13  VAL  40          HG13      VAL  40   7.379  -1.459   0.480
  317   HG21  VAL  40          HG21      VAL  40   5.607   0.763   1.752
  318   HG22  VAL  40          HG22      VAL  40   6.013   2.010   0.573
  319   HG23  VAL  40          HG23      VAL  40   7.274   0.961   1.218
  320    H    GLY  41           HN       GLY  41   7.407   2.905  -0.906
  321    HA2  GLY  41           HA2      GLY  41   6.948   4.548  -2.799
  322    HA3  GLY  41           HA1      GLY  41   5.317   3.892  -2.784
  323    H    GLY  42           HN       GLY  42   7.463   4.600  -0.007
  324    HA2  GLY  42           HA2      GLY  42   5.376   6.537   0.892
  325    HA3  GLY  42           HA1      GLY  42   6.248   5.478   1.976
  326    H    ASP  43           HN       ASP  43   6.266   8.421   0.165
  327    HA   ASP  43           HA       ASP  43   8.992   9.092   1.069
  328    HB2  ASP  43           HB2      ASP  43   6.957  10.636  -0.555
  329    HB3  ASP  43           HB1      ASP  43   8.552  11.255  -0.136
  330    H    GLY  44           HN       GLY  44   6.074  11.181   1.090
  331    HA2  GLY  44           HA2      GLY  44   6.149  11.289   4.034
  332    HA3  GLY  44           HA1      GLY  44   6.612  12.766   3.208
  333    H    ARG  45           HN       ARG  45   5.029  13.583   1.532
  334    HA   ARG  45           HA       ARG  45   2.362  13.489   2.782
  335    HB2  ARG  45           HB2      ARG  45   3.556  15.250   0.638
  336    HB3  ARG  45           HB1      ARG  45   1.871  15.343   1.131
  337    HG2  ARG  45           HG2      ARG  45   2.985  17.049   2.304
  338    HG3  ARG  45           HG1      ARG  45   2.708  15.760   3.475
  339    HD2  ARG  45           HD2      ARG  45   4.955  16.691   3.691
  340    HD3  ARG  45           HD1      ARG  45   5.006  15.000   3.201
  341    HE   ARG  45           HE       ARG  45   5.116  16.938   1.008
  342   HH11  ARG  45          HH11      ARG  45   6.956  14.944   3.285
  343   HH12  ARG  45          HH12      ARG  45   8.398  14.973   2.330
  344   HH21  ARG  45          HH21      ARG  45   7.037  16.949  -0.216
  345   HH22  ARG  45          HH22      ARG  45   8.447  16.113   0.344
  346    H    MET  46           HN       MET  46   1.588  11.474   2.220
  347    HA   MET  46           HA       MET  46   1.597  10.572  -0.525
  348    HB2  MET  46           HB2      MET  46   1.308   9.304   1.819
  349    HB3  MET  46           HB1      MET  46  -0.389   9.468   1.387
  350    HG2  MET  46           HG2      MET  46  -0.151   7.625   0.188
  351    HG3  MET  46           HG1      MET  46   0.812   8.575  -0.939
  352    HE1  MET  46           HE1      MET  46   4.396   7.994   0.804
  353    HE2  MET  46           HE2      MET  46   3.203   9.257   1.103
  354    HE3  MET  46           HE3      MET  46   3.622   8.814  -0.551
  355    H    SER  47           HN       SER  47  -0.529   9.859  -1.585
  356    HA   SER  47           HA       SER  47  -2.174  12.289  -1.786
  357    HB2  SER  47           HB2      SER  47  -1.298  11.163  -3.823
  358    HB3  SER  47           HB1      SER  47  -2.283   9.753  -3.438
  359    HG   SER  47           HG       SER  47  -3.349  11.107  -4.912
  360    H    HIS  48           HN       HIS  48  -3.068   8.836  -1.951
  361    HA   HIS  48           HA       HIS  48  -4.861   8.713   0.242
  362    HB2  HIS  48           HB2      HIS  48  -6.148  10.463  -0.856
  363    HB3  HIS  48           HB1      HIS  48  -6.134   9.555  -2.363
  364    HD1  HIS  48           HD1      HIS  48  -7.828   9.810   0.962
  365    HD2  HIS  48           HD2      HIS  48  -7.908   7.348  -2.433
  366    HE1  HIS  48           HE1      HIS  48  -9.925   8.394   1.151
  367    HE2  HIS  48           HE2      HIS  48  -9.967   6.890  -0.898
  368    H    LYS  49           HN       LYS  49  -4.741   7.887  -3.251
  369    HA   LYS  49           HA       LYS  49  -5.490   5.108  -2.670
  370    HB2  LYS  49           HB2      LYS  49  -4.646   6.576  -5.177
  371    HB3  LYS  49           HB1      LYS  49  -5.096   4.881  -5.135
  372    HG2  LYS  49           HG2      LYS  49  -7.316   5.558  -4.237
  373    HG3  LYS  49           HG1      LYS  49  -6.845   7.239  -4.490
  374    HD2  LYS  49           HD2      LYS  49  -6.506   6.741  -6.892
  375    HD3  LYS  49           HD1      LYS  49  -7.094   5.101  -6.605
  376    HE2  LYS  49           HE2      LYS  49  -9.236   6.011  -5.837
  377    HE3  LYS  49           HE1      LYS  49  -8.647   7.645  -6.136
  378    HZ1  LYS  49           HZ1      LYS  49 -10.019   6.881  -7.956
  379    HZ2  LYS  49           HZ2      LYS  49  -9.028   5.531  -8.188
  380    HZ3  LYS  49           HZ3      LYS  49  -8.424   7.082  -8.487
  381    H    GLU  50           HN       GLU  50  -2.588   7.012  -3.272
  382    HA   GLU  50           HA       GLU  50  -0.827   4.930  -4.038
  383    HB2  GLU  50           HB2      GLU  50  -0.343   7.320  -4.290
  384    HB3  GLU  50           HB1      GLU  50  -0.234   7.488  -2.544
  385    HG2  GLU  50           HG2      GLU  50   1.702   6.046  -2.487
  386    HG3  GLU  50           HG1      GLU  50   1.560   5.745  -4.218
  387    H    ALA  51           HN       ALA  51  -1.272   6.422  -0.788
  388    HA   ALA  51           HA       ALA  51   0.580   4.946   0.632
  389    HB1  ALA  51           HB1      ALA  51  -2.181   5.695   1.603
  390    HB2  ALA  51           HB2      ALA  51  -0.758   6.736   1.624
  391    HB3  ALA  51           HB3      ALA  51  -0.803   5.286   2.624
  392    H    ILE  52           HN       ILE  52  -2.858   3.884   0.149
  393    HA   ILE  52           HA       ILE  52  -2.350   1.428   1.480
  394    HB   ILE  52           HB       ILE  52  -4.445   2.048  -0.635
  395   HG12  ILE  52          HG12      ILE  52  -4.603   3.448   1.372
  396   HG13  ILE  52          HG11      ILE  52  -5.949   2.324   1.291
  397   HG21  ILE  52          HG21      ILE  52  -4.131  -0.348  -0.497
  398   HG22  ILE  52          HG22      ILE  52  -5.668   0.103   0.242
  399   HG23  ILE  52          HG23      ILE  52  -4.282  -0.292   1.260
  400   HD11  ILE  52          HD11      ILE  52  -3.501   2.054   3.017
  401   HD12  ILE  52          HD12      ILE  52  -4.813   0.879   2.918
  402   HD13  ILE  52          HD13      ILE  52  -5.123   2.495   3.549
  403    H    LEU  53           HN       LEU  53  -2.221   2.332  -1.982
  404    HA   LEU  53           HA       LEU  53  -1.864  -0.241  -3.042
  405    HB2  LEU  53           HB2      LEU  53  -2.179   1.811  -4.384
  406    HB3  LEU  53           HB1      LEU  53  -0.592   2.412  -3.961
  407    HG   LEU  53           HG       LEU  53   0.393   0.441  -5.164
  408   HD11  LEU  53          HD11      LEU  53  -1.511  -1.048  -5.106
  409   HD12  LEU  53          HD12      LEU  53  -1.053  -0.719  -6.777
  410   HD13  LEU  53          HD13      LEU  53  -2.457   0.082  -6.074
  411   HD21  LEU  53          HD21      LEU  53   0.406   2.551  -6.254
  412   HD22  LEU  53          HD22      LEU  53  -1.309   2.433  -6.643
  413   HD23  LEU  53          HD23      LEU  53  -0.152   1.370  -7.439
  414    H    LEU  54           HN       LEU  54   0.560   1.785  -1.337
  415    HA   LEU  54           HA       LEU  54   3.006   0.750  -2.063
  416    HB2  LEU  54           HB2      LEU  54   1.767   1.559   0.558
  417    HB3  LEU  54           HB1      LEU  54   3.304   0.732   0.625
  418    HG   LEU  54           HG       LEU  54   4.299   2.449  -0.825
  419   HD11  LEU  54          HD11      LEU  54   3.069   4.494  -1.318
  420   HD12  LEU  54          HD12      LEU  54   1.618   3.800  -0.602
  421   HD13  LEU  54          HD13      LEU  54   2.301   3.094  -2.066
  422   HD21  LEU  54          HD21      LEU  54   4.252   4.279   0.814
  423   HD22  LEU  54          HD22      LEU  54   4.445   2.705   1.583
  424   HD23  LEU  54          HD23      LEU  54   2.879   3.515   1.613
  425    H    GLY  55           HN       GLY  55   0.490  -0.883  -0.047
  426    HA2  GLY  55           HA2      GLY  55   1.866  -3.008   1.052
  427    HA3  GLY  55           HA1      GLY  55   0.214  -3.112   0.484
  428    H    LEU  56           HN       LEU  56   0.548  -2.941  -2.291
  429    HA   LEU  56           HA       LEU  56   1.039  -5.573  -3.002
  430    HB2  LEU  56           HB2      LEU  56   1.646  -3.243  -4.811
  431    HB3  LEU  56           HB1      LEU  56   1.212  -4.875  -5.289
  432    HG   LEU  56           HG       LEU  56  -0.567  -2.790  -4.038
  433   HD11  LEU  56          HD11      LEU  56  -0.554  -4.239  -6.674
  434   HD12  LEU  56          HD12      LEU  56  -0.351  -2.511  -6.388
  435   HD13  LEU  56          HD13      LEU  56  -1.911  -3.277  -6.093
  436   HD21  LEU  56          HD21      LEU  56  -1.031  -5.739  -4.403
  437   HD22  LEU  56          HD22      LEU  56  -2.345  -4.575  -4.241
  438   HD23  LEU  56          HD23      LEU  56  -1.186  -4.783  -2.929
  439    H    ARG  57           HN       ARG  57   3.422  -2.899  -3.064
  440    HA   ARG  57           HA       ARG  57   5.555  -4.467  -4.116
  441    HB2  ARG  57           HB2      ARG  57   5.569  -1.999  -2.379
  442    HB3  ARG  57           HB1      ARG  57   7.024  -2.696  -3.076
  443    HG2  ARG  57           HG2      ARG  57   4.663  -1.619  -4.607
  444    HG3  ARG  57           HG1      ARG  57   6.229  -0.831  -4.407
  445    HD2  ARG  57           HD2      ARG  57   7.299  -2.738  -5.555
  446    HD3  ARG  57           HD1      ARG  57   5.706  -3.449  -5.810
  447    HE   ARG  57           HE       ARG  57   5.782  -0.777  -6.843
  448   HH11  ARG  57          HH11      ARG  57   6.886  -4.072  -7.530
  449   HH12  ARG  57          HH12      ARG  57   6.959  -3.820  -9.241
  450   HH21  ARG  57          HH21      ARG  57   5.893  -0.490  -9.102
  451   HH22  ARG  57          HH22      ARG  57   6.396  -1.787 -10.134
  452    H    TYR  58           HN       TYR  58   4.375  -3.972  -0.818
  453    HA   TYR  58           HA       TYR  58   6.579  -5.199   0.527
  454    HB2  TYR  58           HB2      TYR  58   4.971  -3.817   1.715
  455    HB3  TYR  58           HB1      TYR  58   3.668  -4.926   1.315
  456    HD1  TYR  58           HD2      TYR  58   6.753  -4.542   3.315
  457    HD2  TYR  58           HD1      TYR  58   3.253  -6.857   2.631
  458    HE1  TYR  58           HE2      TYR  58   7.169  -5.772   5.400
  459    HE2  TYR  58           HE1      TYR  58   3.656  -8.096   4.715
  460    HH   TYR  58           HH       TYR  58   5.800  -7.081   7.075
  461    H    LYS  59           HN       LYS  59   3.392  -6.468  -0.463
  462    HA   LYS  59           HA       LYS  59   4.005  -9.176   0.330
  463    HB2  LYS  59           HB2      LYS  59   1.802  -7.962  -1.318
  464    HB3  LYS  59           HB1      LYS  59   1.887  -9.675  -0.945
  465    HG2  LYS  59           HG2      LYS  59   1.787  -7.497   1.126
  466    HG3  LYS  59           HG1      LYS  59   0.380  -8.387   0.542
  467    HD2  LYS  59           HD2      LYS  59   1.337 -10.473   1.342
  468    HD3  LYS  59           HD1      LYS  59   2.796  -9.627   1.862
  469    HE2  LYS  59           HE2      LYS  59   1.537  -8.375   3.496
  470    HE3  LYS  59           HE1      LYS  59   0.026  -9.075   2.918
  471    HZ1  LYS  59           HZ1      LYS  59   2.255 -10.575   4.189
  472    HZ2  LYS  59           HZ2      LYS  59   0.807 -11.251   3.632
  473    HZ3  LYS  59           HZ3      LYS  59   0.789 -10.166   4.930
  474    H    LYS  60           HN       LYS  60   4.887  -7.315  -2.388
  475    HA   LYS  60           HA       LYS  60   5.985  -7.865  -4.310
  476    HB2  LYS  60           HB2      LYS  60   6.107 -10.686  -3.219
  477    HB3  LYS  60           HB1      LYS  60   7.056 -10.052  -4.553
  478    HG2  LYS  60           HG2      LYS  60   7.204  -9.099  -1.699
  479    HG3  LYS  60           HG1      LYS  60   8.350 -10.190  -2.482
  480    HD2  LYS  60           HD2      LYS  60   7.757  -7.375  -3.398
  481    HD3  LYS  60           HD1      LYS  60   9.126  -7.832  -2.385
  482    HE2  LYS  60           HE2      LYS  60   9.959  -9.295  -4.154
  483    HE3  LYS  60           HE1      LYS  60   8.576  -8.874  -5.164
  484    HZ1  LYS  60           HZ1      LYS  60  10.507  -7.601  -5.801
  485    HZ2  LYS  60           HZ2      LYS  60  10.689  -7.008  -4.228
  486    HZ3  LYS  60           HZ3      LYS  60   9.340  -6.564  -5.147
  487    H    LEU  61           HN       LEU  61   3.710  -7.374  -5.017
  488    HA   LEU  61           HA       LEU  61   3.023  -9.267  -7.056
  489    HB2  LEU  61           HB2      LEU  61   0.582  -9.521  -6.172
  490    HB3  LEU  61           HB1      LEU  61   1.842 -10.587  -5.587
  491    HG   LEU  61           HG       LEU  61   2.049  -9.241  -3.542
  492   HD11  LEU  61          HD11      LEU  61   0.482  -7.478  -3.030
  493   HD12  LEU  61          HD12      LEU  61  -0.288  -7.665  -4.605
  494   HD13  LEU  61          HD13      LEU  61   1.372  -7.078  -4.500
  495   HD21  LEU  61          HD21      LEU  61  -0.782 -10.086  -4.137
  496   HD22  LEU  61          HD22      LEU  61  -0.079  -9.863  -2.535
  497   HD23  LEU  61          HD23      LEU  61   0.519 -11.143  -3.590
  498    H    TYR  62           HN       TYR  62   3.630  -6.405  -6.741
  499    HA   TYR  62           HA       TYR  62   1.283  -4.844  -7.091
  500    HB2  TYR  62           HB2      TYR  62   3.427  -3.854  -6.530
  501    HB3  TYR  62           HB1      TYR  62   4.111  -4.388  -8.060
  502    HD1  TYR  62           HD1      TYR  62   1.617  -2.097  -6.551
  503    HD2  TYR  62           HD2      TYR  62   3.891  -3.076 -10.010
  504    HE1  TYR  62           HE1      TYR  62   0.954   0.030  -7.584
  505    HE2  TYR  62           HE2      TYR  62   3.236  -0.949 -11.051
  506    HH   TYR  62           HH       TYR  62   1.896   1.588  -9.369
  507    H    ASN  63           HN       ASN  63   2.875  -7.033  -9.257
  508    HA   ASN  63           HA       ASN  63   2.153  -5.816 -11.729
  509    HB2  ASN  63           HB2      ASN  63   3.855  -7.599 -11.463
  510    HB3  ASN  63           HB1      ASN  63   2.564  -8.752 -11.146
  511   HD21  ASN  63          HD21      ASN  63   3.184 -10.024 -12.900
  512   HD22  ASN  63          HD22      ASN  63   2.827  -9.509 -14.584
  513    H    GLN  64           HN       GLN  64   0.622  -8.723 -10.204
  514    HA   GLN  64           HA       GLN  64  -1.737  -8.176 -11.887
  515    HB2  GLN  64           HB2      GLN  64  -0.547 -10.552 -10.703
  516    HB3  GLN  64           HB1      GLN  64  -2.288 -10.489 -10.478
  517    HG2  GLN  64           HG2      GLN  64  -1.838 -11.692 -12.479
  518    HG3  GLN  64           HG1      GLN  64  -2.534 -10.135 -12.921
  519   HE21  GLN  64          HE21      GLN  64   0.294 -12.164 -12.950
  520   HE22  GLN  64          HE22      GLN  64   1.251 -11.148 -14.083
  521    H    ALA  65           HN       ALA  65  -0.795  -7.322  -8.746
  522    HA   ALA  65           HA       ALA  65  -3.327  -7.857  -7.460
  523    HB1  ALA  65           HB1      ALA  65  -2.476  -6.395  -5.669
  524    HB2  ALA  65           HB2      ALA  65  -1.095  -5.990  -6.688
  525    HB3  ALA  65           HB3      ALA  65  -1.325  -7.648  -6.134
  526    H    ARG  66           HN       ARG  66  -1.971  -5.172  -9.293
  527    HA   ARG  66           HA       ARG  66  -4.099  -3.334  -8.561
  528    HB2  ARG  66           HB2      ARG  66  -1.857  -2.547  -9.154
  529    HB3  ARG  66           HB1      ARG  66  -2.042  -3.208 -10.772
  530    HG2  ARG  66           HG2      ARG  66  -3.644  -1.601 -11.367
  531    HG3  ARG  66           HG1      ARG  66  -3.911  -1.128  -9.687
  532    HD2  ARG  66           HD2      ARG  66  -1.815  -0.050  -9.556
  533    HD3  ARG  66           HD1      ARG  66  -1.259  -0.781 -11.059
  534    HE   ARG  66           HE       ARG  66  -3.475   0.682 -11.808
  535   HH11  ARG  66          HH11      ARG  66  -0.451   1.418 -10.118
  536   HH12  ARG  66          HH12      ARG  66  -0.390   3.050 -10.690
  537   HH21  ARG  66          HH21      ARG  66  -3.353   2.836 -12.537
  538   HH22  ARG  66          HH22      ARG  66  -2.037   3.857 -12.063
  539    H    VAL  67           HN       VAL  67  -3.627  -5.765 -11.039
  540    HA   VAL  67           HA       VAL  67  -5.820  -4.674 -12.678
  541    HB   VAL  67           HB       VAL  67  -5.382  -6.513 -14.213
  542   HG11  VAL  67          HG11      VAL  67  -2.851  -5.159 -13.287
  543   HG12  VAL  67          HG12      VAL  67  -4.033  -4.503 -14.420
  544   HG13  VAL  67          HG13      VAL  67  -3.091  -5.930 -14.855
  545   HG21  VAL  67          HG21      VAL  67  -4.848  -8.293 -12.683
  546   HG22  VAL  67          HG22      VAL  67  -3.402  -7.446 -12.139
  547   HG23  VAL  67          HG23      VAL  67  -3.491  -8.065 -13.786
  548    H    LYS  68           HN       LYS  68  -5.185  -7.426 -10.517
  549    HA   LYS  68           HA       LYS  68  -7.743  -8.679 -11.036
  550    HB2  LYS  68           HB2      LYS  68  -5.712  -9.049  -8.833
  551    HB3  LYS  68           HB1      LYS  68  -7.157 -10.034  -9.001
  552    HG2  LYS  68           HG2      LYS  68  -4.993  -9.787 -11.082
  553    HG3  LYS  68           HG1      LYS  68  -5.134 -11.104  -9.915
  554    HD2  LYS  68           HD2      LYS  68  -7.327 -11.685 -10.843
  555    HD3  LYS  68           HD1      LYS  68  -7.182 -10.368 -12.008
  556    HE2  LYS  68           HE2      LYS  68  -5.181 -11.436 -12.948
  557    HE3  LYS  68           HE1      LYS  68  -5.355 -12.761 -11.797
  558    HZ1  LYS  68           HZ1      LYS  68  -7.293 -12.024 -13.925
  559    HZ2  LYS  68           HZ2      LYS  68  -7.521 -13.259 -12.792
  560    HZ3  LYS  68           HZ3      LYS  68  -6.271 -13.373 -13.927
  561    H    TYR  69           HN       TYR  69  -6.499  -6.385  -8.655
  562    HA   TYR  69           HA       TYR  69  -9.207  -6.310  -7.411
  563    HB2  TYR  69           HB2      TYR  69  -6.475  -5.645  -6.319
  564    HB3  TYR  69           HB1      TYR  69  -7.959  -5.158  -5.512
  565    HD1  TYR  69           HD1      TYR  69  -6.394  -8.242  -6.942
  566    HD2  TYR  69           HD2      TYR  69  -8.779  -6.533  -3.861
  567    HE1  TYR  69           HE1      TYR  69  -6.497 -10.426  -5.818
  568    HE2  TYR  69           HE2      TYR  69  -8.888  -8.709  -2.729
  569    HH   TYR  69           HH       TYR  69  -8.665 -11.109  -3.321
  570    H    SER  70           HN       SER  70 -10.163  -4.296  -6.908
  571    HA   SER  70           HA       SER  70  -9.480  -2.243  -8.880
  572    HB2  SER  70           HB2      SER  70 -11.715  -2.496  -6.865
  573    HB3  SER  70           HB1      SER  70 -11.520  -1.093  -7.915
  574    HG   SER  70           HG       SER  70 -12.763  -3.299  -8.496
  575    H    LEU  71           HN       LEU  71  -7.494  -1.428  -8.215
  576    HA   LEU  71           HA       LEU  71  -7.494  -0.034  -5.585
  577    HB2  LEU  71           HB2      LEU  71  -5.273  -0.881  -7.441
  578    HB3  LEU  71           HB1      LEU  71  -5.007   0.205  -6.091
  579    HG   LEU  71           HG       LEU  71  -5.912  -1.618  -4.586
  580   HD11  LEU  71          HD11      LEU  71  -5.644  -3.210  -7.127
  581   HD12  LEU  71          HD12      LEU  71  -7.098  -2.967  -6.160
  582   HD13  LEU  71          HD13      LEU  71  -5.763  -3.921  -5.518
  583   HD21  LEU  71          HD21      LEU  71  -3.810  -2.911  -4.638
  584   HD22  LEU  71          HD22      LEU  71  -3.548  -1.168  -4.706
  585   HD23  LEU  71          HD23      LEU  71  -3.404  -2.140  -6.172
  586    H    LEU  72           HN       LEU  72  -6.181   0.525  -8.888
  587    HA   LEU  72           HA       LEU  72  -6.700   3.420  -8.475
  588    HB2  LEU  72           HB2      LEU  72  -4.970   1.899 -10.415
  589    HB3  LEU  72           HB1      LEU  72  -5.339   3.598 -10.638
  590    HG   LEU  72           HG       LEU  72  -3.167   3.368  -9.612
  591   HD11  LEU  72          HD11      LEU  72  -5.195   4.331  -7.602
  592   HD12  LEU  72          HD12      LEU  72  -4.531   5.275  -8.935
  593   HD13  LEU  72          HD13      LEU  72  -3.479   4.737  -7.625
  594   HD21  LEU  72          HD21      LEU  72  -2.816   2.302  -7.486
  595   HD22  LEU  72          HD22      LEU  72  -3.562   1.147  -8.590
  596   HD23  LEU  72          HD23      LEU  72  -4.532   1.929  -7.343
  597    H    GLU  73           HN       GLU  73  -8.931   3.436  -8.765
  598    HA   GLU  73           HA       GLU  73  -9.908   2.544 -11.420
  599    HB2  GLU  73           HB2      GLU  73 -11.531   3.522  -9.065
  600    HB3  GLU  73           HB1      GLU  73 -12.130   2.698 -10.498
  601    HG2  GLU  73           HG2      GLU  73 -10.401   1.535  -8.327
  602    HG3  GLU  73           HG1      GLU  73 -12.094   1.166  -8.655
  Start of MODEL   12
    1    H1   SER   1           HT1      SER   1   1.216  17.164   9.070
    2    H2   SER   1           HT2      SER   1   1.392  15.919  10.201
    3    H3   SER   1           HT3      SER   1  -0.045  16.808  10.143
    4    HA   SER   1           HA       SER   1  -0.338  14.643   9.141
    5    HB2  SER   1           HB2      SER   1  -1.621  16.589   8.288
    6    HB3  SER   1           HB1      SER   1  -0.357  16.876   7.092
    7    HG   SER   1           HG       SER   1  -1.741  15.645   5.997
    8    H    ASP   2           HN       ASP   2   0.702  12.940   8.347
    9    HA   ASP   2           HA       ASP   2   2.458  13.228   6.037
   10    HB2  ASP   2           HB2      ASP   2   3.882  13.845   8.075
   11    HB3  ASP   2           HB1      ASP   2   3.729  12.162   8.565
   12    H    VAL   3           HN       VAL   3   3.118  11.203   5.122
   13    HA   VAL   3           HA       VAL   3   1.116   9.197   5.308
   14    HB   VAL   3           HB       VAL   3   2.604   9.612   3.335
   15   HG11  VAL   3          HG11      VAL   3   4.781   8.629   3.209
   16   HG12  VAL   3          HG12      VAL   3   4.615   7.929   4.818
   17   HG13  VAL   3          HG13      VAL   3   4.735   9.678   4.626
   18   HG21  VAL   3          HG21      VAL   3   1.195   7.660   3.393
   19   HG22  VAL   3          HG22      VAL   3   2.388   6.783   4.352
   20   HG23  VAL   3          HG23      VAL   3   2.751   7.229   2.685
   21    H    TRP   4           HN       TRP   4   4.285   9.498   6.877
   22    HA   TRP   4           HA       TRP   4   4.183   6.802   7.935
   23    HB2  TRP   4           HB2      TRP   4   6.317   7.996   7.460
   24    HB3  TRP   4           HB1      TRP   4   5.944   9.111   8.768
   25    HD1  TRP   4           HD1      TRP   4   5.875   7.994  11.296
   26    HE1  TRP   4           HE1      TRP   4   7.279   6.056  12.301
   27    HE3  TRP   4           HE3      TRP   4   7.458   5.869   6.923
   28    HZ2  TRP   4           HZ2      TRP   4   8.840   3.923  11.298
   29    HZ3  TRP   4           HZ3      TRP   4   8.910   3.884   7.033
   30    HH2  TRP   4           HH2      TRP   4   9.583   2.931   9.178
   31    H    SER   5           HN       SER   5   3.432  10.063   9.122
   32    HA   SER   5           HA       SER   5   3.026   9.338  11.846
   33    HB2  SER   5           HB2      SER   5   1.743  11.539  10.204
   34    HB3  SER   5           HB1      SER   5   1.647  11.415  11.961
   35    HG   SER   5           HG       SER   5   3.511  12.601  10.596
   36    H    LEU   6           HN       LEU   6   0.723   9.616   9.118
   37    HA   LEU   6           HA       LEU   6  -1.300   8.203  10.767
   38    HB2  LEU   6           HB2      LEU   6  -1.576   9.542   8.073
   39    HB3  LEU   6           HB1      LEU   6  -2.885   8.857   9.015
   40    HG   LEU   6           HG       LEU   6  -1.197  11.220   9.848
   41   HD11  LEU   6          HD11      LEU   6  -3.268  12.510   9.465
   42   HD12  LEU   6          HD12      LEU   6  -4.005  11.070   8.762
   43   HD13  LEU   6          HD13      LEU   6  -2.605  11.814   7.987
   44   HD21  LEU   6          HD21      LEU   6  -2.926  11.484  11.601
   45   HD22  LEU   6          HD22      LEU   6  -1.979  10.005  11.776
   46   HD23  LEU   6          HD23      LEU   6  -3.613   9.933  11.114
   47    H    SER   7           HN       SER   7  -0.503   6.107  10.736
   48    HA   SER   7           HA       SER   7  -0.615   4.804   8.052
   49    HB2  SER   7           HB2      SER   7   1.312   4.270  10.320
   50    HB3  SER   7           HB1      SER   7   1.152   3.242   8.899
   51    HG   SER   7           HG       SER   7   2.808   4.684   8.526
   52    H    LYS   8           HN       LYS   8  -2.344   5.073  10.765
   53    HA   LYS   8           HA       LYS   8  -2.796   2.204  11.216
   54    HB2  LYS   8           HB2      LYS   8  -4.034   4.660  12.463
   55    HB3  LYS   8           HB1      LYS   8  -4.408   3.009  12.936
   56    HG2  LYS   8           HG2      LYS   8  -1.704   4.324  13.121
   57    HG3  LYS   8           HG1      LYS   8  -2.815   4.042  14.463
   58    HD2  LYS   8           HD2      LYS   8  -2.642   1.634  14.118
   59    HD3  LYS   8           HD1      LYS   8  -1.573   1.897  12.738
   60    HE2  LYS   8           HE2      LYS   8  -0.241   1.315  14.650
   61    HE3  LYS   8           HE1      LYS   8   0.037   3.011  14.260
   62    HZ1  LYS   8           HZ1      LYS   8  -1.828   2.066  16.368
   63    HZ2  LYS   8           HZ2      LYS   8  -1.385   3.668  16.052
   64    HZ3  LYS   8           HZ3      LYS   8  -0.242   2.579  16.658
   65    H    THR   9           HN       THR   9  -4.368   4.928   9.598
   66    HA   THR   9           HA       THR   9  -6.937   3.671   9.324
   67    HB   THR   9           HB       THR   9  -7.287   5.334   7.468
   68    HG1  THR   9           HG1      THR   9  -5.402   5.909   6.622
   69   HG21  THR   9          HG21      THR   9  -6.223   6.419  10.078
   70   HG22  THR   9          HG22      THR   9  -7.872   5.871   9.777
   71   HG23  THR   9          HG23      THR   9  -7.249   7.296   8.944
   72    H    SER  10           HN       SER  10  -7.201   1.747   8.396
   73    HA   SER  10           HA       SER  10  -5.520   0.933   6.141
   74    HB2  SER  10           HB2      SER  10  -7.879  -0.475   7.417
   75    HB3  SER  10           HB1      SER  10  -6.737  -1.192   6.284
   76    HG   SER  10           HG       SER  10  -5.885  -1.754   8.173
   77    H    MET  11           HN       MET  11  -6.802  -0.346   4.331
   78    HA   MET  11           HA       MET  11  -9.117   1.289   3.442
   79    HB2  MET  11           HB2      MET  11  -7.091   2.230   2.390
   80    HB3  MET  11           HB1      MET  11  -6.716   0.649   1.721
   81    HG2  MET  11           HG2      MET  11  -7.710   2.040   0.033
   82    HG3  MET  11           HG1      MET  11  -8.803   0.716   0.431
   83    HE1  MET  11           HE1      MET  11 -10.823   2.013  -0.779
   84    HE2  MET  11           HE2      MET  11  -9.672   3.284  -1.195
   85    HE3  MET  11           HE3      MET  11 -11.212   3.700  -0.442
   86    H    THR  12           HN       THR  12 -10.721   0.146   2.545
   87    HA   THR  12           HA       THR  12 -10.324  -2.770   2.397
   88    HB   THR  12           HB       THR  12 -12.856  -1.145   2.074
   89    HG1  THR  12           HG1      THR  12 -12.325  -0.961   4.180
   90   HG21  THR  12          HG21      THR  12 -13.096  -3.282   0.982
   91   HG22  THR  12          HG22      THR  12 -13.976  -3.331   2.511
   92   HG23  THR  12          HG23      THR  12 -12.404  -4.117   2.373
   93    H    PHE  13           HN       PHE  13  -9.989  -3.883   0.620
   94    HA   PHE  13           HA       PHE  13 -10.524  -2.560  -1.995
   95    HB2  PHE  13           HB2      PHE  13  -8.607  -4.742  -1.164
   96    HB3  PHE  13           HB1      PHE  13  -8.975  -4.416  -2.851
   97    HD1  PHE  13           HD2      PHE  13  -9.104  -1.447  -2.810
   98    HD2  PHE  13           HD1      PHE  13  -6.374  -4.149  -0.978
   99    HE1  PHE  13           HE2      PHE  13  -7.362   0.288  -2.857
  100    HE2  PHE  13           HE1      PHE  13  -4.630  -2.420  -1.025
  101    HZ   PHE  13           HZ       PHE  13  -5.119  -0.197  -1.964
  102    H    GLN  14           HN       GLN  14 -11.706  -3.612  -3.599
  103    HA   GLN  14           HA       GLN  14 -13.209  -5.980  -2.586
  104    HB2  GLN  14           HB2      GLN  14 -14.615  -3.997  -2.895
  105    HB3  GLN  14           HB1      GLN  14 -14.099  -3.879  -4.571
  106    HG2  GLN  14           HG2      GLN  14 -15.100  -6.129  -4.959
  107    HG3  GLN  14           HG1      GLN  14 -15.741  -6.069  -3.318
  108   HE21  GLN  14          HE21      GLN  14 -15.943  -4.816  -6.566
  109   HE22  GLN  14          HE22      GLN  14 -17.511  -3.962  -6.346
  110    HA   PRO  15           HA       PRO  15 -11.249  -8.225  -5.872
  111    HB2  PRO  15           HB2      PRO  15 -12.876 -10.422  -5.798
  112    HB3  PRO  15           HB1      PRO  15 -11.555 -10.137  -4.662
  113    HG2  PRO  15           HG2      PRO  15 -14.485  -9.697  -4.316
  114    HG3  PRO  15           HG1      PRO  15 -13.297 -10.315  -3.155
  115    HD2  PRO  15           HD2      PRO  15 -14.225  -7.765  -3.104
  116    HD3  PRO  15           HD1      PRO  15 -12.598  -8.207  -2.560
  117    H    LYS  16           HN       LYS  16 -11.517  -8.552  -8.047
  118    HA   LYS  16           HA       LYS  16 -13.788  -7.265  -9.270
  119    HB2  LYS  16           HB2      LYS  16 -11.559  -8.939 -10.441
  120    HB3  LYS  16           HB1      LYS  16 -12.755  -8.084 -11.404
  121    HG2  LYS  16           HG2      LYS  16 -10.837  -6.787  -9.478
  122    HG3  LYS  16           HG1      LYS  16 -10.626  -6.871 -11.228
  123    HD2  LYS  16           HD2      LYS  16 -12.673  -5.584 -11.545
  124    HD3  LYS  16           HD1      LYS  16 -12.925  -5.535  -9.799
  125    HE2  LYS  16           HE2      LYS  16 -10.803  -4.318  -9.547
  126    HE3  LYS  16           HE1      LYS  16 -10.599  -4.332 -11.298
  127    HZ1  LYS  16           HZ1      LYS  16 -12.639  -3.045 -11.504
  128    HZ2  LYS  16           HZ2      LYS  16 -11.509  -2.235 -10.541
  129    HZ3  LYS  16           HZ3      LYS  16 -12.821  -3.024  -9.822
  130    H    LYS  17           HN       LYS  17 -12.894 -10.612  -8.583
  131    HA   LYS  17           HA       LYS  17 -15.557 -11.426  -9.643
  132    HB2  LYS  17           HB2      LYS  17 -14.509 -13.664 -10.120
  133    HB3  LYS  17           HB1      LYS  17 -13.967 -12.350 -11.151
  134    HG2  LYS  17           HG2      LYS  17 -12.388 -13.039  -8.719
  135    HG3  LYS  17           HG1      LYS  17 -12.263 -14.055 -10.154
  136    HD2  LYS  17           HD2      LYS  17 -11.789 -11.073 -10.086
  137    HD3  LYS  17           HD1      LYS  17 -10.526 -12.303 -10.071
  138    HE2  LYS  17           HE2      LYS  17 -11.256 -13.100 -12.251
  139    HE3  LYS  17           HE1      LYS  17 -12.564 -11.918 -12.264
  140    HZ1  LYS  17           HZ1      LYS  17  -9.659 -11.288 -12.235
  141    HZ2  LYS  17           HZ2      LYS  17 -10.911 -10.151 -12.237
  142    HZ3  LYS  17           HZ3      LYS  17 -10.688 -11.162 -13.574
  143    H    ALA  18           HN       ALA  18 -16.351 -13.523  -8.690
  144    HA   ALA  18           HA       ALA  18 -16.556 -13.230  -5.875
  145    HB1  ALA  18           HB1      ALA  18 -17.793 -15.297  -5.909
  146    HB2  ALA  18           HB2      ALA  18 -17.139 -15.702  -7.496
  147    HB3  ALA  18           HB3      ALA  18 -18.230 -14.328  -7.317
  148    H    SER  19           HN       SER  19 -14.443 -15.294  -7.851
  149    HA   SER  19           HA       SER  19 -13.519 -17.012  -5.817
  150    HB2  SER  19           HB2      SER  19 -11.547 -17.368  -7.252
  151    HB3  SER  19           HB1      SER  19 -13.037 -17.366  -8.194
  152    HG   SER  19           HG       SER  19 -11.902 -15.986  -9.343
  153    H    LEU  20           HN       LEU  20 -12.301 -13.799  -6.800
  154    HA   LEU  20           HA       LEU  20 -10.106 -13.816  -4.942
  155    HB2  LEU  20           HB2      LEU  20 -11.532 -11.577  -6.365
  156    HB3  LEU  20           HB1      LEU  20 -10.093 -11.348  -5.401
  157    HG   LEU  20           HG       LEU  20 -10.269 -13.052  -7.886
  158   HD11  LEU  20          HD11      LEU  20 -10.463 -10.659  -8.358
  159   HD12  LEU  20          HD12      LEU  20  -8.931 -11.315  -8.936
  160   HD13  LEU  20          HD13      LEU  20  -8.979 -10.362  -7.453
  161   HD21  LEU  20          HD21      LEU  20  -7.830 -13.167  -7.713
  162   HD22  LEU  20          HD22      LEU  20  -8.612 -13.893  -6.308
  163   HD23  LEU  20          HD23      LEU  20  -7.896 -12.285  -6.188
  164    H    GLN  21           HN       GLN  21  -9.814 -12.462  -3.057
  165    HA   GLN  21           HA       GLN  21 -12.384 -12.010  -1.608
  166    HB2  GLN  21           HB2      GLN  21  -9.757 -12.900  -0.405
  167    HB3  GLN  21           HB1      GLN  21 -11.270 -12.666   0.455
  168    HG2  GLN  21           HG2      GLN  21 -10.903 -14.684  -1.743
  169    HG3  GLN  21           HG1      GLN  21 -10.669 -15.041  -0.034
  170   HE21  GLN  21          HE21      GLN  21 -12.296 -16.585  -0.003
  171   HE22  GLN  21          HE22      GLN  21 -14.029 -16.117  -0.083
  172    HA   PRO  22           HA       PRO  22 -11.297  -7.748  -1.158
  173    HB2  PRO  22           HB2      PRO  22 -12.386  -8.084   1.599
  174    HB3  PRO  22           HB1      PRO  22 -12.794  -6.887   0.366
  175    HG2  PRO  22           HG2      PRO  22 -14.438  -8.909   0.859
  176    HG3  PRO  22           HG1      PRO  22 -14.157  -8.363  -0.803
  177    HD2  PRO  22           HD2      PRO  22 -13.084 -10.767   0.612
  178    HD3  PRO  22           HD1      PRO  22 -13.605 -10.587  -1.075
  179    H    LEU  23           HN       LEU  23  -9.849  -6.342  -0.123
  180    HA   LEU  23           HA       LEU  23  -8.036  -7.642   1.859
  181    HB2  LEU  23           HB2      LEU  23  -7.096  -7.556  -0.460
  182    HB3  LEU  23           HB1      LEU  23  -7.174  -5.811  -0.376
  183    HG   LEU  23           HG       LEU  23  -5.575  -7.449   1.585
  184   HD11  LEU  23          HD11      LEU  23  -4.628  -6.182  -0.982
  185   HD12  LEU  23          HD12      LEU  23  -4.770  -7.913  -0.678
  186   HD13  LEU  23          HD13      LEU  23  -3.610  -6.949   0.237
  187   HD21  LEU  23          HD21      LEU  23  -4.328  -5.230   1.700
  188   HD22  LEU  23          HD22      LEU  23  -5.927  -5.289   2.438
  189   HD23  LEU  23          HD23      LEU  23  -5.714  -4.537   0.857
  190    H    THR  24           HN       THR  24  -7.937  -6.568   3.714
  191    HA   THR  24           HA       THR  24  -8.274  -3.614   3.586
  192    HB   THR  24           HB       THR  24  -9.481  -5.368   5.730
  193    HG1  THR  24           HG1      THR  24 -10.858  -5.638   4.082
  194   HG21  THR  24          HG21      THR  24  -8.890  -3.168   6.565
  195   HG22  THR  24          HG22      THR  24 -10.642  -3.279   6.385
  196   HG23  THR  24          HG23      THR  24  -9.685  -2.402   5.190
  197    H    ILE  25           HN       ILE  25  -6.179  -3.022   3.892
  198    HA   ILE  25           HA       ILE  25  -5.121  -3.484   6.596
  199    HB   ILE  25           HB       ILE  25  -4.271  -5.357   5.057
  200   HG12  ILE  25          HG12      ILE  25  -1.961  -5.203   6.023
  201   HG13  ILE  25          HG11      ILE  25  -2.348  -3.578   6.568
  202   HG21  ILE  25          HG21      ILE  25  -3.811  -3.852   3.132
  203   HG22  ILE  25          HG22      ILE  25  -2.447  -4.873   3.588
  204   HG23  ILE  25          HG23      ILE  25  -2.465  -3.169   4.046
  205   HD11  ILE  25          HD11      ILE  25  -3.813  -6.070   7.391
  206   HD12  ILE  25          HD12      ILE  25  -4.091  -4.438   7.999
  207   HD13  ILE  25          HD13      ILE  25  -2.566  -5.259   8.338
  208    H    SER  26           HN       SER  26  -3.299  -2.085   7.143
  209    HA   SER  26           HA       SER  26  -3.258   0.332   5.391
  210    HB2  SER  26           HB2      SER  26  -4.386   0.566   7.642
  211    HB3  SER  26           HB1      SER  26  -2.809   0.287   8.379
  212    HG   SER  26           HG       SER  26  -3.240   2.510   8.133
  213    H    LEU  27           HN       LEU  27  -1.323   1.808   6.238
  214    HA   LEU  27           HA       LEU  27   1.074   0.695   5.234
  215    HB2  LEU  27           HB2      LEU  27   0.884   2.983   7.162
  216    HB3  LEU  27           HB1      LEU  27   2.128   2.695   5.964
  217    HG   LEU  27           HG       LEU  27  -0.737   3.486   5.429
  218   HD11  LEU  27          HD11      LEU  27   0.300   5.512   4.492
  219   HD12  LEU  27          HD12      LEU  27   1.874   4.940   5.044
  220   HD13  LEU  27          HD13      LEU  27   0.614   5.325   6.217
  221   HD21  LEU  27          HD21      LEU  27   0.060   1.924   3.727
  222   HD22  LEU  27          HD22      LEU  27   1.487   2.928   3.470
  223   HD23  LEU  27          HD23      LEU  27  -0.113   3.553   3.077
  224    H    ASP  28           HN       ASP  28   0.406   1.604   8.634
  225    HA   ASP  28           HA       ASP  28   2.786   0.398   9.636
  226    HB2  ASP  28           HB2      ASP  28   1.662   2.122  10.891
  227    HB3  ASP  28           HB1      ASP  28   0.200   1.151  11.008
  228    H    GLU  29           HN       GLU  29  -0.487  -0.853   9.148
  229    HA   GLU  29           HA       GLU  29   0.079  -3.304  10.612
  230    HB2  GLU  29           HB2      GLU  29  -2.216  -2.441   8.861
  231    HB3  GLU  29           HB1      GLU  29  -2.131  -4.027   9.612
  232    HG2  GLU  29           HG2      GLU  29  -3.406  -2.901  11.121
  233    HG3  GLU  29           HG1      GLU  29  -1.800  -2.649  11.803
  234    H    LEU  30           HN       LEU  30   1.050  -2.244   7.545
  235    HA   LEU  30           HA       LEU  30   1.247  -5.091   6.694
  236    HB2  LEU  30           HB2      LEU  30  -0.403  -3.686   5.386
  237    HB3  LEU  30           HB1      LEU  30   0.963  -2.756   4.805
  238    HG   LEU  30           HG       LEU  30   1.892  -4.841   3.797
  239   HD11  LEU  30          HD11      LEU  30   0.326  -6.742   3.510
  240   HD12  LEU  30          HD12      LEU  30  -0.753  -5.981   4.678
  241   HD13  LEU  30          HD13      LEU  30   0.855  -6.507   5.176
  242   HD21  LEU  30          HD21      LEU  30   0.401  -4.867   1.907
  243   HD22  LEU  30          HD22      LEU  30   0.556  -3.216   2.507
  244   HD23  LEU  30          HD23      LEU  30  -0.889  -4.152   2.872
  245    H    PHE  31           HN       PHE  31   3.123  -2.917   7.997
  246    HA   PHE  31           HA       PHE  31   5.366  -3.755   6.285
  247    HB2  PHE  31           HB2      PHE  31   5.111  -0.922   7.330
  248    HB3  PHE  31           HB1      PHE  31   6.492  -1.553   6.443
  249    HD1  PHE  31           HD1      PHE  31   5.368  -2.967   4.219
  250    HD2  PHE  31           HD2      PHE  31   4.034   0.635   6.046
  251    HE1  PHE  31           HE1      PHE  31   4.302  -2.292   2.109
  252    HE2  PHE  31           HE2      PHE  31   2.964   1.313   3.939
  253    HZ   PHE  31           HZ       PHE  31   3.095  -0.155   1.968
  254    H    SER  32           HN       SER  32   7.281  -4.273   7.295
  255    HA   SER  32           HA       SER  32   7.308  -3.936  10.248
  256    HB2  SER  32           HB2      SER  32   8.323  -6.259  10.331
  257    HB3  SER  32           HB1      SER  32   6.607  -6.176   9.944
  258    HG   SER  32           HG       SER  32   8.762  -6.924   8.359
  259    H    SER  33           HN       SER  33   8.669  -2.194   8.581
  260    HA   SER  33           HA       SER  33  11.323  -2.330   9.502
  261    HB2  SER  33           HB2      SER  33  11.784  -4.203   8.109
  262    HB3  SER  33           HB1      SER  33  10.947  -3.479   6.738
  263    HG   SER  33           HG       SER  33  13.482  -3.366   7.198
  264    H    ARG  34           HN       ARG  34  12.395  -0.422   9.202
  265    HA   ARG  34           HA       ARG  34  10.904   1.773   8.177
  266    HB2  ARG  34           HB2      ARG  34  13.147   1.510   9.718
  267    HB3  ARG  34           HB1      ARG  34  13.832   2.109   8.214
  268    HG2  ARG  34           HG2      ARG  34  11.658   3.427   9.829
  269    HG3  ARG  34           HG1      ARG  34  13.344   3.936   9.726
  270    HD2  ARG  34           HD2      ARG  34  13.085   4.413   7.362
  271    HD3  ARG  34           HD1      ARG  34  11.428   3.812   7.400
  272    HE   ARG  34           HE       ARG  34  11.961   5.996   9.263
  273   HH11  ARG  34          HH11      ARG  34  10.960   5.125   5.979
  274   HH12  ARG  34          HH12      ARG  34  10.120   6.614   5.711
  275   HH21  ARG  34          HH21      ARG  34  10.840   7.940   8.869
  276   HH22  ARG  34          HH22      ARG  34  10.052   8.215   7.352
  277    H    GLY  35           HN       GLY  35  13.719   0.021   6.816
  278    HA2  GLY  35           HA2      GLY  35  13.833   1.501   4.385
  279    HA3  GLY  35           HA1      GLY  35  14.466  -0.120   4.631
  280    H    GLU  36           HN       GLU  36  11.866  -1.275   5.367
  281    HA   GLU  36           HA       GLU  36  10.974  -2.078   2.806
  282    HB2  GLU  36           HB2      GLU  36  10.541  -3.387   4.818
  283    HB3  GLU  36           HB1      GLU  36   9.517  -2.112   5.459
  284    HG2  GLU  36           HG2      GLU  36   8.155  -3.894   4.607
  285    HG3  GLU  36           HG1      GLU  36   7.948  -2.464   3.598
  286    H    PHE  37           HN       PHE  37   9.759   0.417   5.036
  287    HA   PHE  37           HA       PHE  37   7.481   1.171   3.508
  288    HB2  PHE  37           HB2      PHE  37   8.047   1.824   5.899
  289    HB3  PHE  37           HB1      PHE  37   9.148   3.019   5.225
  290    HD1  PHE  37           HD2      PHE  37   5.612   2.013   5.469
  291    HD2  PHE  37           HD1      PHE  37   8.349   5.077   4.369
  292    HE1  PHE  37           HE2      PHE  37   3.747   3.606   5.291
  293    HE2  PHE  37           HE1      PHE  37   6.491   6.679   4.191
  294    HZ   PHE  37           HZ       PHE  37   4.185   5.943   4.652
  295    H    ILE  38           HN       ILE  38  10.850   2.362   3.519
  296    HA   ILE  38           HA       ILE  38  10.584   4.428   1.657
  297    HB   ILE  38           HB       ILE  38  12.920   2.545   1.999
  298   HG12  ILE  38          HG12      ILE  38  12.309   3.621   4.091
  299   HG13  ILE  38          HG11      ILE  38  13.791   4.341   3.479
  300   HG21  ILE  38          HG21      ILE  38  14.256   4.437   1.104
  301   HG22  ILE  38          HG22      ILE  38  12.750   5.264   0.707
  302   HG23  ILE  38          HG23      ILE  38  13.150   3.736  -0.078
  303   HD11  ILE  38          HD11      ILE  38  11.033   5.525   3.249
  304   HD12  ILE  38          HD12      ILE  38  12.524   6.251   2.646
  305   HD13  ILE  38          HD13      ILE  38  12.292   6.024   4.380
  306    H    SER  39           HN       SER  39  11.432   0.977   0.984
  307    HA   SER  39           HA       SER  39  11.607   1.288  -1.824
  308    HB2  SER  39           HB2      SER  39  10.745  -1.164  -0.234
  309    HB3  SER  39           HB1      SER  39  11.234  -1.178  -1.929
  310    HG   SER  39           HG       SER  39  12.932  -1.721  -0.430
  311    H    VAL  40           HN       VAL  40   8.861  -0.275  -0.061
  312    HA   VAL  40           HA       VAL  40   7.037  -0.560  -1.963
  313    HB   VAL  40           HB       VAL  40   5.221  -0.029  -0.367
  314   HG11  VAL  40          HG11      VAL  40   5.919  -1.709   1.319
  315   HG12  VAL  40          HG12      VAL  40   7.551  -1.640   0.661
  316   HG13  VAL  40          HG13      VAL  40   6.221  -2.214  -0.342
  317   HG21  VAL  40          HG21      VAL  40   7.473   0.826   1.443
  318   HG22  VAL  40          HG22      VAL  40   5.777   0.666   1.896
  319   HG23  VAL  40          HG23      VAL  40   6.266   1.897   0.732
  320    H    GLY  41           HN       GLY  41   7.801   2.740  -0.698
  321    HA2  GLY  41           HA2      GLY  41   7.500   4.361  -2.631
  322    HA3  GLY  41           HA1      GLY  41   5.858   3.743  -2.721
  323    H    GLY  42           HN       GLY  42   7.862   4.505   0.153
  324    HA2  GLY  42           HA2      GLY  42   5.747   6.486   0.886
  325    HA3  GLY  42           HA1      GLY  42   6.534   5.441   2.049
  326    H    ASP  43           HN       ASP  43   6.661   8.365   0.246
  327    HA   ASP  43           HA       ASP  43   9.379   9.008   1.190
  328    HB2  ASP  43           HB2      ASP  43   7.349  10.598  -0.397
  329    HB3  ASP  43           HB1      ASP  43   8.942  11.208   0.044
  330    H    GLY  44           HN       GLY  44   6.459  11.105   1.279
  331    HA2  GLY  44           HA2      GLY  44   6.543  11.135   4.218
  332    HA3  GLY  44           HA1      GLY  44   7.058  12.622   3.449
  333    H    ARG  45           HN       ARG  45   5.497  13.556   1.802
  334    HA   ARG  45           HA       ARG  45   2.851  13.518   3.089
  335    HB2  ARG  45           HB2      ARG  45   4.166  15.320   1.072
  336    HB3  ARG  45           HB1      ARG  45   2.442  15.424   1.408
  337    HG2  ARG  45           HG2      ARG  45   3.541  17.062   2.736
  338    HG3  ARG  45           HG1      ARG  45   3.007  15.771   3.811
  339    HD2  ARG  45           HD2      ARG  45   5.256  14.832   3.818
  340    HD3  ARG  45           HD1      ARG  45   5.799  16.098   2.720
  341    HE   ARG  45           HE       ARG  45   4.680  17.386   4.949
  342   HH11  ARG  45          HH11      ARG  45   7.407  15.242   4.238
  343   HH12  ARG  45          HH12      ARG  45   8.373  15.840   5.544
  344   HH21  ARG  45          HH21      ARG  45   5.982  18.138   6.660
  345   HH22  ARG  45          HH22      ARG  45   7.562  17.480   6.923
  346    H    MET  46           HN       MET  46   1.849  11.660   2.507
  347    HA   MET  46           HA       MET  46   1.664  10.990  -0.355
  348    HB2  MET  46           HB2      MET  46   1.932   9.363   1.690
  349    HB3  MET  46           HB1      MET  46   0.185   9.526   1.795
  350    HG2  MET  46           HG2      MET  46  -0.061   8.015   0.211
  351    HG3  MET  46           HG1      MET  46   0.849   9.022  -0.911
  352    HE1  MET  46           HE1      MET  46   3.698   9.130   0.494
  353    HE2  MET  46           HE2      MET  46   3.499   8.860  -1.237
  354    HE3  MET  46           HE3      MET  46   4.524   7.783  -0.289
  355    H    SER  47           HN       SER  47  -0.568  10.298  -1.182
  356    HA   SER  47           HA       SER  47  -2.349  12.586  -0.666
  357    HB2  SER  47           HB2      SER  47  -2.213  10.509  -2.837
  358    HB3  SER  47           HB1      SER  47  -3.578  11.613  -2.688
  359    HG   SER  47           HG       SER  47  -0.871  12.206  -3.227
  360    H    HIS  48           HN       HIS  48  -3.212   9.232  -1.514
  361    HA   HIS  48           HA       HIS  48  -4.687   8.628   0.899
  362    HB2  HIS  48           HB2      HIS  48  -6.224  10.328   0.186
  363    HB3  HIS  48           HB1      HIS  48  -6.209   9.718  -1.462
  364    HD1  HIS  48           HD1      HIS  48  -7.909   9.384   1.794
  365    HD2  HIS  48           HD2      HIS  48  -7.599   7.189  -1.770
  366    HE1  HIS  48           HE1      HIS  48  -9.802   7.696   1.823
  367    HE2  HIS  48           HE2      HIS  48  -9.654   6.409  -0.363
  368    H    LYS  49           HN       LYS  49  -5.332   8.122  -2.606
  369    HA   LYS  49           HA       LYS  49  -5.570   5.274  -2.221
  370    HB2  LYS  49           HB2      LYS  49  -6.624   6.661  -4.052
  371    HB3  LYS  49           HB1      LYS  49  -5.036   6.763  -4.800
  372    HG2  LYS  49           HG2      LYS  49  -4.977   4.418  -5.182
  373    HG3  LYS  49           HG1      LYS  49  -6.422   4.162  -4.204
  374    HD2  LYS  49           HD2      LYS  49  -6.334   5.765  -6.759
  375    HD3  LYS  49           HD1      LYS  49  -6.854   4.086  -6.646
  376    HE2  LYS  49           HE2      LYS  49  -8.132   6.406  -5.204
  377    HE3  LYS  49           HE1      LYS  49  -8.746   5.665  -6.680
  378    HZ1  LYS  49           HZ1      LYS  49  -8.465   4.348  -4.032
  379    HZ2  LYS  49           HZ2      LYS  49  -8.954   3.563  -5.448
  380    HZ3  LYS  49           HZ3      LYS  49  -9.911   4.791  -4.789
  381    H    GLU  50           HN       GLU  50  -2.901   7.440  -2.676
  382    HA   GLU  50           HA       GLU  50  -1.065   5.590  -3.879
  383    HB2  GLU  50           HB2      GLU  50  -0.464   8.025  -2.197
  384    HB3  GLU  50           HB1      GLU  50   0.618   7.247  -3.337
  385    HG2  GLU  50           HG2      GLU  50  -1.933   8.698  -3.995
  386    HG3  GLU  50           HG1      GLU  50  -0.291   9.268  -4.282
  387    H    ALA  51           HN       ALA  51  -1.423   6.788  -0.513
  388    HA   ALA  51           HA       ALA  51   0.651   5.375   0.678
  389    HB1  ALA  51           HB1      ALA  51  -2.071   5.869   1.886
  390    HB2  ALA  51           HB2      ALA  51  -0.745   7.030   1.834
  391    HB3  ALA  51           HB3      ALA  51  -0.580   5.545   2.771
  392    H    ILE  52           HN       ILE  52  -2.757   4.169   0.493
  393    HA   ILE  52           HA       ILE  52  -2.158   1.691   1.658
  394    HB   ILE  52           HB       ILE  52  -4.248   2.214  -0.480
  395   HG12  ILE  52          HG12      ILE  52  -4.397   3.736   1.470
  396   HG13  ILE  52          HG11      ILE  52  -5.774   2.657   1.357
  397   HG21  ILE  52          HG21      ILE  52  -3.884  -0.157  -0.181
  398   HG22  ILE  52          HG22      ILE  52  -5.435   0.303   0.522
  399   HG23  ILE  52          HG23      ILE  52  -4.045   0.010   1.568
  400   HD11  ILE  52          HD11      ILE  52  -5.035   2.904   3.652
  401   HD12  ILE  52          HD12      ILE  52  -3.428   2.331   3.209
  402   HD13  ILE  52          HD13      ILE  52  -4.812   1.244   3.101
  403    H    LEU  53           HN       LEU  53  -2.064   2.640  -1.790
  404    HA   LEU  53           HA       LEU  53  -1.757   0.079  -2.885
  405    HB2  LEU  53           HB2      LEU  53  -2.044   2.292  -4.098
  406    HB3  LEU  53           HB1      LEU  53  -0.335   2.611  -3.886
  407    HG   LEU  53           HG       LEU  53   0.188   0.596  -5.219
  408   HD11  LEU  53          HD11      LEU  53  -1.631  -0.447  -6.526
  409   HD12  LEU  53          HD12      LEU  53  -2.802   0.471  -5.579
  410   HD13  LEU  53          HD13      LEU  53  -1.779  -0.731  -4.793
  411   HD21  LEU  53          HD21      LEU  53  -0.570   1.522  -7.390
  412   HD22  LEU  53          HD22      LEU  53   0.140   2.733  -6.321
  413   HD23  LEU  53          HD23      LEU  53  -1.613   2.640  -6.510
  414    H    LEU  54           HN       LEU  54   0.701   1.961  -1.109
  415    HA   LEU  54           HA       LEU  54   3.097   0.861  -2.034
  416    HB2  LEU  54           HB2      LEU  54   2.065   1.722   0.673
  417    HB3  LEU  54           HB1      LEU  54   3.595   0.879   0.611
  418    HG   LEU  54           HG       LEU  54   4.503   2.585  -0.889
  419   HD11  LEU  54          HD11      LEU  54   1.813   3.904  -0.569
  420   HD12  LEU  54          HD12      LEU  54   2.486   3.239  -2.057
  421   HD13  LEU  54          HD13      LEU  54   3.232   4.649  -1.303
  422   HD21  LEU  54          HD21      LEU  54   4.791   2.886   1.494
  423   HD22  LEU  54          HD22      LEU  54   3.220   3.676   1.613
  424   HD23  LEU  54          HD23      LEU  54   4.530   4.451   0.725
  425    H    GLY  55           HN       GLY  55   0.527  -0.726  -0.103
  426    HA2  GLY  55           HA2      GLY  55   1.882  -2.882   1.021
  427    HA3  GLY  55           HA1      GLY  55   0.229  -2.948   0.444
  428    H    LEU  56           HN       LEU  56   0.605  -2.694  -2.329
  429    HA   LEU  56           HA       LEU  56   1.056  -5.326  -3.097
  430    HB2  LEU  56           HB2      LEU  56   1.685  -2.951  -4.847
  431    HB3  LEU  56           HB1      LEU  56   1.235  -4.563  -5.370
  432    HG   LEU  56           HG       LEU  56  -0.532  -2.519  -4.032
  433   HD11  LEU  56          HD11      LEU  56  -1.858  -2.838  -6.119
  434   HD12  LEU  56          HD12      LEU  56  -0.529  -3.808  -6.753
  435   HD13  LEU  56          HD13      LEU  56  -0.273  -2.106  -6.367
  436   HD21  LEU  56          HD21      LEU  56  -1.004  -5.437  -4.576
  437   HD22  LEU  56          HD22      LEU  56  -2.319  -4.279  -4.372
  438   HD23  LEU  56          HD23      LEU  56  -1.183  -4.564  -3.054
  439    H    ARG  57           HN       ARG  57   3.449  -2.670  -3.025
  440    HA   ARG  57           HA       ARG  57   5.603  -4.153  -4.138
  441    HB2  ARG  57           HB2      ARG  57   5.429  -1.769  -2.325
  442    HB3  ARG  57           HB1      ARG  57   6.992  -2.492  -2.666
  443    HG2  ARG  57           HG2      ARG  57   6.618  -0.640  -4.149
  444    HG3  ARG  57           HG1      ARG  57   6.602  -2.143  -5.073
  445    HD2  ARG  57           HD2      ARG  57   4.264  -2.083  -5.326
  446    HD3  ARG  57           HD1      ARG  57   4.076  -0.870  -4.060
  447    HE   ARG  57           HE       ARG  57   4.429   0.783  -5.613
  448   HH11  ARG  57          HH11      ARG  57   5.659  -2.279  -6.907
  449   HH12  ARG  57          HH12      ARG  57   6.012  -1.613  -8.466
  450   HH21  ARG  57          HH21      ARG  57   4.905   1.610  -7.679
  451   HH22  ARG  57          HH22      ARG  57   5.583   0.591  -8.905
  452    H    TYR  58           HN       TYR  58   4.388  -3.859  -0.825
  453    HA   TYR  58           HA       TYR  58   6.518  -5.195   0.498
  454    HB2  TYR  58           HB2      TYR  58   4.795  -3.879   1.654
  455    HB3  TYR  58           HB1      TYR  58   3.580  -5.070   1.219
  456    HD1  TYR  58           HD2      TYR  58   6.661  -4.566   3.214
  457    HD2  TYR  58           HD1      TYR  58   3.219  -6.976   2.560
  458    HE1  TYR  58           HE2      TYR  58   7.131  -5.787   5.295
  459    HE2  TYR  58           HE1      TYR  58   3.674  -8.203   4.642
  460    HH   TYR  58           HH       TYR  58   5.808  -7.132   6.983
  461    H    LYS  59           HN       LYS  59   3.428  -6.411  -0.796
  462    HA   LYS  59           HA       LYS  59   4.086  -9.172  -0.129
  463    HB2  LYS  59           HB2      LYS  59   1.820  -7.968  -1.711
  464    HB3  LYS  59           HB1      LYS  59   1.940  -9.662  -1.266
  465    HG2  LYS  59           HG2      LYS  59   1.838  -7.392   0.707
  466    HG3  LYS  59           HG1      LYS  59   0.441  -8.340   0.198
  467    HD2  LYS  59           HD2      LYS  59   1.511 -10.372   1.054
  468    HD3  LYS  59           HD1      LYS  59   2.911  -9.424   1.555
  469    HE2  LYS  59           HE2      LYS  59   1.468  -8.126   3.065
  470    HE3  LYS  59           HE1      LYS  59   0.091  -9.119   2.586
  471    HZ1  LYS  59           HZ1      LYS  59   0.988  -9.913   4.653
  472    HZ2  LYS  59           HZ2      LYS  59   2.537 -10.054   3.989
  473    HZ3  LYS  59           HZ3      LYS  59   1.292 -11.065   3.452
  474    H    LYS  60           HN       LYS  60   4.920  -7.099  -2.691
  475    HA   LYS  60           HA       LYS  60   5.951  -7.478  -4.689
  476    HB2  LYS  60           HB2      LYS  60   6.177 -10.349  -3.756
  477    HB3  LYS  60           HB1      LYS  60   7.044  -9.646  -5.113
  478    HG2  LYS  60           HG2      LYS  60   7.303  -8.677  -2.278
  479    HG3  LYS  60           HG1      LYS  60   8.373  -9.869  -3.018
  480    HD2  LYS  60           HD2      LYS  60   8.981  -8.226  -4.744
  481    HD3  LYS  60           HD1      LYS  60   7.935  -7.036  -3.967
  482    HE2  LYS  60           HE2      LYS  60  10.291  -8.374  -2.645
  483    HE3  LYS  60           HE1      LYS  60  10.337  -6.781  -3.395
  484    HZ1  LYS  60           HZ1      LYS  60   8.682  -7.582  -1.061
  485    HZ2  LYS  60           HZ2      LYS  60   8.611  -6.069  -1.815
  486    HZ3  LYS  60           HZ3      LYS  60  10.031  -6.560  -1.037
  487    H    LEU  61           HN       LEU  61   3.645  -7.005  -5.305
  488    HA   LEU  61           HA       LEU  61   2.946  -8.786  -7.448
  489    HB2  LEU  61           HB2      LEU  61   0.526  -9.106  -6.526
  490    HB3  LEU  61           HB1      LEU  61   1.805 -10.191  -6.022
  491    HG   LEU  61           HG       LEU  61   2.064  -8.866  -3.932
  492   HD11  LEU  61          HD11      LEU  61   1.170  -6.744  -4.801
  493   HD12  LEU  61          HD12      LEU  61   0.391  -7.250  -3.302
  494   HD13  LEU  61          HD13      LEU  61  -0.440  -7.463  -4.843
  495   HD21  LEU  61          HD21      LEU  61   0.004  -9.670  -2.873
  496   HD22  LEU  61          HD22      LEU  61   0.712 -10.881  -3.943
  497   HD23  LEU  61          HD23      LEU  61  -0.696  -9.956  -4.467
  498    H    TYR  62           HN       TYR  62   3.544  -5.941  -6.955
  499    HA   TYR  62           HA       TYR  62   1.222  -4.348  -7.161
  500    HB2  TYR  62           HB2      TYR  62   3.461  -3.485  -6.646
  501    HB3  TYR  62           HB1      TYR  62   3.987  -3.853  -8.284
  502    HD1  TYR  62           HD1      TYR  62   1.762  -1.695  -6.270
  503    HD2  TYR  62           HD2      TYR  62   3.546  -2.352 -10.076
  504    HE1  TYR  62           HE1      TYR  62   1.057   0.545  -6.984
  505    HE2  TYR  62           HE2      TYR  62   2.844  -0.111 -10.798
  506    HH   TYR  62           HH       TYR  62   1.742   2.252  -8.664
  507    H    ASN  63           HN       ASN  63   2.614  -6.474  -9.507
  508    HA   ASN  63           HA       ASN  63   1.823  -5.062 -11.868
  509    HB2  ASN  63           HB2      ASN  63   2.390  -7.989 -11.392
  510    HB3  ASN  63           HB1      ASN  63   2.110  -7.290 -12.983
  511   HD21  ASN  63          HD21      ASN  63   4.302  -7.624 -10.307
  512   HD22  ASN  63          HD22      ASN  63   5.714  -6.861 -11.117
  513    H    GLN  64           HN       GLN  64   0.383  -8.131 -10.630
  514    HA   GLN  64           HA       GLN  64  -2.056  -7.458 -12.128
  515    HB2  GLN  64           HB2      GLN  64  -1.141  -9.947 -10.713
  516    HB3  GLN  64           HB1      GLN  64  -2.756  -9.785 -11.384
  517    HG2  GLN  64           HG2      GLN  64  -1.769  -9.387 -13.602
  518    HG3  GLN  64           HG1      GLN  64  -0.166  -9.626 -12.910
  519   HE21  GLN  64          HE21      GLN  64  -1.504 -11.083 -15.051
  520   HE22  GLN  64          HE22      GLN  64  -1.577 -12.792 -14.499
  521    H    ALA  65           HN       ALA  65  -1.017  -6.796  -8.975
  522    HA   ALA  65           HA       ALA  65  -3.409  -7.526  -7.580
  523    HB1  ALA  65           HB1      ALA  65  -1.300  -5.483  -6.923
  524    HB2  ALA  65           HB2      ALA  65  -1.397  -7.145  -6.343
  525    HB3  ALA  65           HB3      ALA  65  -2.599  -5.962  -5.828
  526    H    ARG  66           HN       ARG  66  -2.530  -4.745  -9.537
  527    HA   ARG  66           HA       ARG  66  -4.778  -3.141  -8.593
  528    HB2  ARG  66           HB2      ARG  66  -2.881  -2.778 -10.915
  529    HB3  ARG  66           HB1      ARG  66  -4.100  -1.605 -10.437
  530    HG2  ARG  66           HG2      ARG  66  -3.008  -1.157  -8.391
  531    HG3  ARG  66           HG1      ARG  66  -1.948  -2.556  -8.570
  532    HD2  ARG  66           HD2      ARG  66  -1.956  -0.153 -10.394
  533    HD3  ARG  66           HD1      ARG  66  -0.824  -0.401  -9.065
  534    HE   ARG  66           HE       ARG  66  -0.518  -2.684 -10.519
  535   HH11  ARG  66          HH11      ARG  66  -0.441   0.751 -11.388
  536   HH12  ARG  66          HH12      ARG  66   0.648   0.511 -12.712
  537   HH21  ARG  66          HH21      ARG  66   0.913  -2.950 -12.265
  538   HH22  ARG  66          HH22      ARG  66   1.414  -1.590 -13.213
  539    H    VAL  67           HN       VAL  67  -4.206  -5.474 -11.150
  540    HA   VAL  67           HA       VAL  67  -6.632  -4.628 -12.590
  541    HB   VAL  67           HB       VAL  67  -6.114  -6.415 -14.184
  542   HG11  VAL  67          HG11      VAL  67  -4.021  -5.499 -15.056
  543   HG12  VAL  67          HG12      VAL  67  -3.727  -4.700 -13.512
  544   HG13  VAL  67          HG13      VAL  67  -5.107  -4.223 -14.503
  545   HG21  VAL  67          HG21      VAL  67  -4.009  -7.688 -13.977
  546   HG22  VAL  67          HG22      VAL  67  -5.164  -8.074 -12.702
  547   HG23  VAL  67          HG23      VAL  67  -3.791  -7.023 -12.359
  548    H    LYS  68           HN       LYS  68  -5.492  -7.363 -10.614
  549    HA   LYS  68           HA       LYS  68  -7.905  -8.904 -10.943
  550    HB2  LYS  68           HB2      LYS  68  -5.723  -9.016  -8.856
  551    HB3  LYS  68           HB1      LYS  68  -7.022 -10.192  -8.985
  552    HG2  LYS  68           HG2      LYS  68  -5.008  -9.607 -11.150
  553    HG3  LYS  68           HG1      LYS  68  -4.909 -10.949 -10.009
  554    HD2  LYS  68           HD2      LYS  68  -6.968 -11.883 -10.873
  555    HD3  LYS  68           HD1      LYS  68  -7.187 -10.491 -11.936
  556    HE2  LYS  68           HE2      LYS  68  -6.313 -12.367 -13.195
  557    HE3  LYS  68           HE1      LYS  68  -5.111 -11.082 -13.112
  558    HZ1  LYS  68           HZ1      LYS  68  -3.969 -12.291 -11.373
  559    HZ2  LYS  68           HZ2      LYS  68  -4.140 -13.273 -12.738
  560    HZ3  LYS  68           HZ3      LYS  68  -5.144 -13.510 -11.397
  561    H    TYR  69           HN       TYR  69  -6.832  -6.441  -8.651
  562    HA   TYR  69           HA       TYR  69  -9.512  -6.632  -7.354
  563    HB2  TYR  69           HB2      TYR  69  -6.818  -5.999  -6.155
  564    HB3  TYR  69           HB1      TYR  69  -8.330  -5.615  -5.341
  565    HD1  TYR  69           HD2      TYR  69  -9.824  -7.424  -4.582
  566    HD2  TYR  69           HD1      TYR  69  -6.005  -8.252  -6.261
  567    HE1  TYR  69           HE2      TYR  69  -9.923  -9.699  -3.665
  568    HE2  TYR  69           HE1      TYR  69  -6.093 -10.534  -5.347
  569    HH   TYR  69           HH       TYR  69  -7.265 -11.716  -3.442
  570    H    SER  70           HN       SER  70 -10.408  -4.630  -6.514
  571    HA   SER  70           HA       SER  70  -9.991  -2.474  -8.433
  572    HB2  SER  70           HB2      SER  70 -12.252  -3.090  -7.650
  573    HB3  SER  70           HB1      SER  70 -11.809  -2.608  -6.011
  574    HG   SER  70           HG       SER  70 -12.380  -1.047  -8.240
  575    H    LEU  71           HN       LEU  71  -7.997  -1.547  -8.134
  576    HA   LEU  71           HA       LEU  71  -7.603  -0.228  -5.484
  577    HB2  LEU  71           HB2      LEU  71  -5.603  -1.342  -7.439
  578    HB3  LEU  71           HB1      LEU  71  -5.145  -0.189  -6.199
  579    HG   LEU  71           HG       LEU  71  -6.029  -1.819  -4.490
  580   HD11  LEU  71          HD11      LEU  71  -7.481  -3.174  -5.793
  581   HD12  LEU  71          HD12      LEU  71  -6.144  -4.195  -5.268
  582   HD13  LEU  71          HD13      LEU  71  -6.189  -3.582  -6.921
  583   HD21  LEU  71          HD21      LEU  71  -3.757  -2.706  -6.259
  584   HD22  LEU  71          HD22      LEU  71  -4.057  -3.278  -4.618
  585   HD23  LEU  71          HD23      LEU  71  -3.657  -1.585  -4.901
  586    H    LEU  72           HN       LEU  72  -6.237   0.169  -8.785
  587    HA   LEU  72           HA       LEU  72  -6.679   3.088  -8.481
  588    HB2  LEU  72           HB2      LEU  72  -4.969   1.490 -10.386
  589    HB3  LEU  72           HB1      LEU  72  -5.201   3.222 -10.523
  590    HG   LEU  72           HG       LEU  72  -3.093   2.809  -9.457
  591   HD11  LEU  72          HD11      LEU  72  -4.369   4.721  -8.638
  592   HD12  LEU  72          HD12      LEU  72  -3.375   4.017  -7.362
  593   HD13  LEU  72          HD13      LEU  72  -5.108   3.702  -7.404
  594   HD21  LEU  72          HD21      LEU  72  -3.765   0.516  -8.627
  595   HD22  LEU  72          HD22      LEU  72  -4.502   1.336  -7.250
  596   HD23  LEU  72          HD23      LEU  72  -2.770   1.482  -7.540
  597    H    GLU  73           HN       GLU  73  -8.809   3.398  -8.954
  598    HA   GLU  73           HA       GLU  73  -9.685   2.464 -11.647
  599    HB2  GLU  73           HB2      GLU  73 -11.444   3.322  -9.344
  600    HB3  GLU  73           HB1      GLU  73 -11.957   2.568 -10.846
  601    HG2  GLU  73           HG2      GLU  73 -10.383   1.312  -8.614
  602    HG3  GLU  73           HG1      GLU  73 -12.026   0.931  -9.118
  Start of MODEL   13
    1    H1   SER   1           HT1      SER   1   1.499  16.590   9.852
    2    H2   SER   1           HT2      SER   1   1.823  15.173  10.719
    3    H3   SER   1           HT3      SER   1   0.424  16.064  11.050
    4    HA   SER   1           HA       SER   1  -0.084  14.087   9.771
    5    HB2  SER   1           HB2      SER   1  -1.469  16.120   9.499
    6    HB3  SER   1           HB1      SER   1  -0.422  16.645   8.181
    7    HG   SER   1           HG       SER   1  -2.236  14.497   8.268
    8    H    ASP   2           HN       ASP   2   0.984  12.564   8.736
    9    HA   ASP   2           HA       ASP   2   2.201  13.146   6.147
   10    HB2  ASP   2           HB2      ASP   2   3.872  12.374   8.532
   11    HB3  ASP   2           HB1      ASP   2   4.375  11.974   6.894
   12    H    VAL   3           HN       VAL   3   3.199  11.049   5.210
   13    HA   VAL   3           HA       VAL   3   1.182   9.020   5.382
   14    HB   VAL   3           HB       VAL   3   2.622   9.500   3.374
   15   HG11  VAL   3          HG11      VAL   3   4.795   8.457   3.195
   16   HG12  VAL   3          HG12      VAL   3   4.668   7.845   4.844
   17   HG13  VAL   3          HG13      VAL   3   4.782   9.580   4.554
   18   HG21  VAL   3          HG21      VAL   3   2.766   7.124   2.683
   19   HG22  VAL   3          HG22      VAL   3   1.221   7.543   3.424
   20   HG23  VAL   3          HG23      VAL   3   2.430   6.654   4.350
   21    H    TRP   4           HN       TRP   4   4.355   9.440   6.891
   22    HA   TRP   4           HA       TRP   4   4.347   6.739   7.974
   23    HB2  TRP   4           HB2      TRP   4   6.447   7.947   7.380
   24    HB3  TRP   4           HB1      TRP   4   6.122   9.079   8.687
   25    HD1  TRP   4           HD1      TRP   4   5.943   7.799  11.232
   26    HE1  TRP   4           HE1      TRP   4   7.512   5.973  12.199
   27    HE3  TRP   4           HE3      TRP   4   7.926   6.107   6.830
   28    HZ2  TRP   4           HZ2      TRP   4   9.340   4.083  11.161
   29    HZ3  TRP   4           HZ3      TRP   4   9.582   4.288   6.906
   30    HH2  TRP   4           HH2      TRP   4  10.272   3.299   9.028
   31    H    SER   5           HN       SER   5   3.780  10.045   9.179
   32    HA   SER   5           HA       SER   5   3.403   9.366  11.909
   33    HB2  SER   5           HB2      SER   5   3.628  11.687  11.131
   34    HB3  SER   5           HB1      SER   5   2.084  11.566  10.288
   35    HG   SER   5           HG       SER   5   1.203  12.137  12.096
   36    H    LEU   6           HN       LEU   6   1.027   9.714   9.253
   37    HA   LEU   6           HA       LEU   6  -0.976   8.331  10.952
   38    HB2  LEU   6           HB2      LEU   6  -1.326   9.756   8.310
   39    HB3  LEU   6           HB1      LEU   6  -2.614   9.094   9.299
   40    HG   LEU   6           HG       LEU   6  -0.813  11.401  10.049
   41   HD11  LEU   6          HD11      LEU   6  -2.472  11.933   8.317
   42   HD12  LEU   6          HD12      LEU   6  -2.803  12.762   9.837
   43   HD13  LEU   6          HD13      LEU   6  -3.752  11.348   9.379
   44   HD21  LEU   6          HD21      LEU   6  -3.140  10.189  11.540
   45   HD22  LEU   6          HD22      LEU   6  -2.251  11.639  12.006
   46   HD23  LEU   6          HD23      LEU   6  -1.441  10.073  12.001
   47    H    SER   7           HN       SER   7  -0.422   6.199  10.841
   48    HA   SER   7           HA       SER   7  -0.612   4.990   8.118
   49    HB2  SER   7           HB2      SER   7   1.322   4.248  10.323
   50    HB3  SER   7           HB1      SER   7   1.088   3.319   8.845
   51    HG   SER   7           HG       SER   7   2.100   4.825   7.713
   52    H    LYS   8           HN       LYS   8  -2.376   5.306  10.732
   53    HA   LYS   8           HA       LYS   8  -2.973   2.424  11.081
   54    HB2  LYS   8           HB2      LYS   8  -3.913   4.858  12.603
   55    HB3  LYS   8           HB1      LYS   8  -4.396   3.207  12.964
   56    HG2  LYS   8           HG2      LYS   8  -1.560   4.217  13.031
   57    HG3  LYS   8           HG1      LYS   8  -2.610   4.051  14.439
   58    HD2  LYS   8           HD2      LYS   8  -2.769   1.656  14.069
   59    HD3  LYS   8           HD1      LYS   8  -1.795   1.797  12.603
   60    HE2  LYS   8           HE2      LYS   8   0.119   2.489  13.872
   61    HE3  LYS   8           HE1      LYS   8  -0.837   2.585  15.350
   62    HZ1  LYS   8           HZ1      LYS   8   0.486   0.562  15.266
   63    HZ2  LYS   8           HZ2      LYS   8  -0.270   0.098  13.825
   64    HZ3  LYS   8           HZ3      LYS   8  -1.166   0.197  15.256
   65    H    THR   9           HN       THR   9  -3.792   4.411   8.751
   66    HA   THR   9           HA       THR   9  -6.725   3.978   8.944
   67    HB   THR   9           HB       THR   9  -6.815   5.452   6.902
   68    HG1  THR   9           HG1      THR   9  -4.999   6.363   6.152
   69   HG21  THR   9          HG21      THR   9  -6.420   7.529   8.144
   70   HG22  THR   9          HG22      THR   9  -5.527   6.627   9.369
   71   HG23  THR   9          HG23      THR   9  -7.250   6.335   9.141
   72    H    SER  10           HN       SER  10  -7.180   1.931   8.362
   73    HA   SER  10           HA       SER  10  -5.771   0.647   6.163
   74    HB2  SER  10           HB2      SER  10  -7.349  -1.227   6.575
   75    HB3  SER  10           HB1      SER  10  -6.527  -0.698   8.041
   76    HG   SER  10           HG       SER  10  -9.100  -0.915   7.684
   77    H    MET  11           HN       MET  11  -6.908  -0.402   4.352
   78    HA   MET  11           HA       MET  11  -9.202   1.230   3.380
   79    HB2  MET  11           HB2      MET  11  -7.093   2.017   2.334
   80    HB3  MET  11           HB1      MET  11  -6.812   0.393   1.725
   81    HG2  MET  11           HG2      MET  11  -7.697   1.645  -0.062
   82    HG3  MET  11           HG1      MET  11  -8.989   0.584   0.494
   83    HE1  MET  11           HE1      MET  11  -7.671   3.951   2.117
   84    HE2  MET  11           HE2      MET  11  -8.762   5.113   1.362
   85    HE3  MET  11           HE3      MET  11  -7.595   4.229   0.377
   86    H    THR  12           HN       THR  12 -10.781   0.130   2.274
   87    HA   THR  12           HA       THR  12 -10.579  -2.796   2.468
   88    HB   THR  12           HB       THR  12 -12.922  -1.110   1.569
   89    HG1  THR  12           HG1      THR  12 -12.783  -0.627   3.668
   90   HG21  THR  12          HG21      THR  12 -12.715  -4.015   2.378
   91   HG22  THR  12          HG22      THR  12 -13.119  -3.388   0.779
   92   HG23  THR  12          HG23      THR  12 -14.231  -3.148   2.126
   93    H    PHE  13           HN       PHE  13 -10.083  -4.119   0.894
   94    HA   PHE  13           HA       PHE  13  -9.905  -3.074  -1.867
   95    HB2  PHE  13           HB2      PHE  13  -8.924  -5.620  -0.569
   96    HB3  PHE  13           HB1      PHE  13  -8.734  -5.261  -2.278
   97    HD1  PHE  13           HD1      PHE  13  -7.740  -4.261   1.121
   98    HD2  PHE  13           HD2      PHE  13  -7.043  -3.784  -3.050
   99    HE1  PHE  13           HE1      PHE  13  -5.642  -3.080   1.611
  100    HE2  PHE  13           HE2      PHE  13  -4.942  -2.600  -2.565
  101    HZ   PHE  13           HZ       PHE  13  -4.238  -2.247  -0.232
  102    H    GLN  14           HN       GLN  14 -11.099  -3.793  -3.571
  103    HA   GLN  14           HA       GLN  14 -13.253  -5.734  -2.867
  104    HB2  GLN  14           HB2      GLN  14 -13.385  -3.396  -4.775
  105    HB3  GLN  14           HB1      GLN  14 -14.676  -4.558  -4.506
  106    HG2  GLN  14           HG2      GLN  14 -14.773  -3.852  -2.145
  107    HG3  GLN  14           HG1      GLN  14 -13.547  -2.633  -2.485
  108   HE21  GLN  14          HE21      GLN  14 -16.301  -2.350  -1.504
  109   HE22  GLN  14          HE22      GLN  14 -17.114  -1.275  -2.694
  110    HA   PRO  15           HA       PRO  15 -11.086  -8.099  -6.001
  111    HB2  PRO  15           HB2      PRO  15 -13.303 -10.001  -5.585
  112    HB3  PRO  15           HB1      PRO  15 -11.568 -10.233  -5.384
  113    HG2  PRO  15           HG2      PRO  15 -13.232 -10.084  -3.282
  114    HG3  PRO  15           HG1      PRO  15 -11.574  -9.464  -3.220
  115    HD2  PRO  15           HD2      PRO  15 -14.145  -7.976  -3.538
  116    HD3  PRO  15           HD1      PRO  15 -12.698  -7.538  -2.609
  117    H    LYS  16           HN       LYS  16 -11.346  -8.448  -8.178
  118    HA   LYS  16           HA       LYS  16 -13.645  -7.166  -9.411
  119    HB2  LYS  16           HB2      LYS  16 -11.395  -8.760 -10.670
  120    HB3  LYS  16           HB1      LYS  16 -12.547  -7.754 -11.534
  121    HG2  LYS  16           HG2      LYS  16 -10.436  -6.856  -9.593
  122    HG3  LYS  16           HG1      LYS  16 -10.506  -6.549 -11.327
  123    HD2  LYS  16           HD2      LYS  16 -12.414  -5.127 -11.065
  124    HD3  LYS  16           HD1      LYS  16 -12.575  -5.571  -9.365
  125    HE2  LYS  16           HE2      LYS  16 -11.561  -3.420  -9.441
  126    HE3  LYS  16           HE1      LYS  16 -10.313  -4.574  -8.981
  127    HZ1  LYS  16           HZ1      LYS  16  -9.522  -2.985 -10.630
  128    HZ2  LYS  16           HZ2      LYS  16 -10.718  -3.487 -11.716
  129    HZ3  LYS  16           HZ3      LYS  16  -9.498  -4.560 -11.247
  130    H    LYS  17           HN       LYS  17 -12.453 -10.495  -8.994
  131    HA   LYS  17           HA       LYS  17 -14.988 -11.498 -10.200
  132    HB2  LYS  17           HB2      LYS  17 -12.327 -12.871  -9.787
  133    HB3  LYS  17           HB1      LYS  17 -13.765 -13.659 -10.417
  134    HG2  LYS  17           HG2      LYS  17 -13.435 -12.860 -12.468
  135    HG3  LYS  17           HG1      LYS  17 -13.091 -11.235 -11.873
  136    HD2  LYS  17           HD2      LYS  17 -11.098 -13.485 -11.694
  137    HD3  LYS  17           HD1      LYS  17 -11.207 -12.420 -13.098
  138    HE2  LYS  17           HE2      LYS  17 -10.799 -10.484 -11.662
  139    HE3  LYS  17           HE1      LYS  17 -10.707 -11.542 -10.255
  140    HZ1  LYS  17           HZ1      LYS  17  -8.886 -11.718 -12.594
  141    HZ2  LYS  17           HZ2      LYS  17  -8.755 -12.568 -11.137
  142    HZ3  LYS  17           HZ3      LYS  17  -8.520 -10.894 -11.164
  143    H    ALA  18           HN       ALA  18 -15.683 -13.688  -9.258
  144    HA   ALA  18           HA       ALA  18 -16.253 -13.261  -6.463
  145    HB1  ALA  18           HB1      ALA  18 -16.733 -15.699  -8.172
  146    HB2  ALA  18           HB2      ALA  18 -17.838 -14.338  -7.983
  147    HB3  ALA  18           HB3      ALA  18 -17.467 -15.369  -6.603
  148    H    SER  19           HN       SER  19 -14.021 -15.353  -8.261
  149    HA   SER  19           HA       SER  19 -13.241 -17.094  -6.204
  150    HB2  SER  19           HB2      SER  19 -11.526 -15.913  -8.404
  151    HB3  SER  19           HB1      SER  19 -11.123 -17.344  -7.455
  152    HG   SER  19           HG       SER  19 -12.305 -17.479  -9.645
  153    H    LEU  20           HN       LEU  20 -12.020 -13.826  -6.966
  154    HA   LEU  20           HA       LEU  20 -10.022 -13.875  -4.881
  155    HB2  LEU  20           HB2      LEU  20 -11.266 -11.569  -6.371
  156    HB3  LEU  20           HB1      LEU  20  -9.856 -11.451  -5.345
  157    HG   LEU  20           HG       LEU  20  -9.967 -13.169  -7.820
  158   HD11  LEU  20          HD11      LEU  20  -8.857 -10.385  -7.494
  159   HD12  LEU  20          HD12      LEU  20 -10.289 -10.827  -8.423
  160   HD13  LEU  20          HD13      LEU  20  -8.700 -11.403  -8.927
  161   HD21  LEU  20          HD21      LEU  20  -8.287 -13.820  -6.162
  162   HD22  LEU  20          HD22      LEU  20  -7.651 -12.174  -6.163
  163   HD23  LEU  20          HD23      LEU  20  -7.540 -13.164  -7.618
  164    H    GLN  21           HN       GLN  21  -9.990 -12.869  -2.882
  165    HA   GLN  21           HA       GLN  21 -12.695 -12.222  -1.795
  166    HB2  GLN  21           HB2      GLN  21 -10.272 -13.351  -0.385
  167    HB3  GLN  21           HB1      GLN  21 -11.772 -12.897   0.411
  168    HG2  GLN  21           HG2      GLN  21 -12.972 -14.575  -0.910
  169    HG3  GLN  21           HG1      GLN  21 -11.456 -15.037  -1.682
  170   HE21  GLN  21          HE21      GLN  21  -9.879 -16.152  -0.523
  171   HE22  GLN  21          HE22      GLN  21 -10.280 -16.976   1.025
  172    HA   PRO  22           HA       PRO  22 -11.461  -8.032  -1.118
  173    HB2  PRO  22           HB2      PRO  22 -13.024  -8.251   1.401
  174    HB3  PRO  22           HB1      PRO  22 -13.173  -7.090   0.079
  175    HG2  PRO  22           HG2      PRO  22 -14.956  -9.042   0.367
  176    HG3  PRO  22           HG1      PRO  22 -14.402  -8.549  -1.243
  177    HD2  PRO  22           HD2      PRO  22 -13.634 -10.943   0.376
  178    HD3  PRO  22           HD1      PRO  22 -13.910 -10.803  -1.373
  179    H    LEU  23           HN       LEU  23 -10.357  -6.616   0.371
  180    HA   LEU  23           HA       LEU  23  -8.937  -8.030   2.569
  181    HB2  LEU  23           HB2      LEU  23  -7.569  -7.981   0.459
  182    HB3  LEU  23           HB1      LEU  23  -7.570  -6.235   0.572
  183    HG   LEU  23           HG       LEU  23  -6.419  -6.417   2.774
  184   HD11  LEU  23          HD11      LEU  23  -6.242  -9.336   2.046
  185   HD12  LEU  23          HD12      LEU  23  -7.164  -8.652   3.384
  186   HD13  LEU  23          HD13      LEU  23  -5.402  -8.554   3.386
  187   HD21  LEU  23          HD21      LEU  23  -5.041  -7.737   0.440
  188   HD22  LEU  23          HD22      LEU  23  -4.239  -7.031   1.843
  189   HD23  LEU  23          HD23      LEU  23  -5.153  -6.004   0.739
  190    H    THR  24           HN       THR  24  -7.892  -6.571   4.131
  191    HA   THR  24           HA       THR  24  -8.694  -3.749   4.026
  192    HB   THR  24           HB       THR  24  -9.705  -5.438   6.327
  193    HG1  THR  24           HG1      THR  24 -11.153  -4.313   4.136
  194   HG21  THR  24          HG21      THR  24  -9.225  -3.135   6.937
  195   HG22  THR  24          HG22      THR  24 -10.970  -3.387   6.881
  196   HG23  THR  24          HG23      THR  24 -10.157  -2.551   5.557
  197    H    ILE  25           HN       ILE  25  -6.405  -3.514   3.995
  198    HA   ILE  25           HA       ILE  25  -5.242  -3.810   6.723
  199    HB   ILE  25           HB       ILE  25  -4.375  -5.520   5.051
  200   HG12  ILE  25          HG12      ILE  25  -1.996  -5.182   5.774
  201   HG13  ILE  25          HG11      ILE  25  -2.461  -3.610   6.408
  202   HG21  ILE  25          HG21      ILE  25  -2.927  -3.135   3.912
  203   HG22  ILE  25          HG22      ILE  25  -4.265  -3.975   3.128
  204   HG23  ILE  25          HG23      ILE  25  -2.747  -4.821   3.424
  205   HD11  ILE  25          HD11      ILE  25  -3.611  -6.241   7.300
  206   HD12  ILE  25          HD12      ILE  25  -3.956  -4.653   7.986
  207   HD13  ILE  25          HD13      ILE  25  -2.342  -5.346   8.134
  208    H    SER  26           HN       SER  26  -3.535  -2.318   7.267
  209    HA   SER  26           HA       SER  26  -3.756   0.215   5.701
  210    HB2  SER  26           HB2      SER  26  -4.784   0.292   7.956
  211    HB3  SER  26           HB1      SER  26  -3.227  -0.131   8.661
  212    HG   SER  26           HG       SER  26  -2.766   1.901   8.592
  213    H    LEU  27           HN       LEU  27  -1.879   1.763   6.338
  214    HA   LEU  27           HA       LEU  27   0.523   0.847   5.204
  215    HB2  LEU  27           HB2      LEU  27   0.165   3.074   7.192
  216    HB3  LEU  27           HB1      LEU  27   1.523   2.873   6.104
  217    HG   LEU  27           HG       LEU  27  -1.327   3.451   5.292
  218   HD11  LEU  27          HD11      LEU  27  -0.265   5.373   6.293
  219   HD12  LEU  27          HD12      LEU  27  -0.392   5.606   4.550
  220   HD13  LEU  27          HD13      LEU  27   1.155   5.160   5.270
  221   HD21  LEU  27          HD21      LEU  27  -0.170   2.042   3.654
  222   HD22  LEU  27          HD22      LEU  27   1.155   3.205   3.594
  223   HD23  LEU  27          HD23      LEU  27  -0.453   3.668   3.035
  224    H    ASP  28           HN       ASP  28   0.109   1.672   8.659
  225    HA   ASP  28           HA       ASP  28   2.588   0.534   9.465
  226    HB2  ASP  28           HB2      ASP  28   1.228   2.217  10.732
  227    HB3  ASP  28           HB1      ASP  28   0.126   0.917  11.177
  228    H    GLU  29           HN       GLU  29  -0.644  -0.839   9.126
  229    HA   GLU  29           HA       GLU  29   0.018  -3.270  10.569
  230    HB2  GLU  29           HB2      GLU  29  -2.310  -2.372   8.898
  231    HB3  GLU  29           HB1      GLU  29  -2.188  -4.027   9.469
  232    HG2  GLU  29           HG2      GLU  29  -3.593  -2.669  10.913
  233    HG3  GLU  29           HG1      GLU  29  -2.172  -3.266  11.766
  234    H    LEU  30           HN       LEU  30   1.097  -2.221   7.584
  235    HA   LEU  30           HA       LEU  30   1.283  -5.053   6.703
  236    HB2  LEU  30           HB2      LEU  30  -0.409  -3.660   5.419
  237    HB3  LEU  30           HB1      LEU  30   0.951  -2.749   4.793
  238    HG   LEU  30           HG       LEU  30   1.843  -4.798   3.756
  239   HD11  LEU  30          HD11      LEU  30   0.251  -6.761   3.621
  240   HD12  LEU  30          HD12      LEU  30  -0.605  -6.036   4.981
  241   HD13  LEU  30          HD13      LEU  30   1.079  -6.529   5.161
  242   HD21  LEU  30          HD21      LEU  30   0.165  -5.006   2.007
  243   HD22  LEU  30          HD22      LEU  30   0.372  -3.321   2.486
  244   HD23  LEU  30          HD23      LEU  30  -1.029  -4.230   3.049
  245    H    PHE  31           HN       PHE  31   3.159  -2.943   8.028
  246    HA   PHE  31           HA       PHE  31   5.380  -3.725   6.271
  247    HB2  PHE  31           HB2      PHE  31   5.063  -0.884   7.272
  248    HB3  PHE  31           HB1      PHE  31   6.480  -1.499   6.429
  249    HD1  PHE  31           HD1      PHE  31   5.776  -2.775   4.126
  250    HD2  PHE  31           HD2      PHE  31   3.643   0.384   6.017
  251    HE1  PHE  31           HE1      PHE  31   4.735  -2.190   1.975
  252    HE2  PHE  31           HE2      PHE  31   2.598   0.969   3.869
  253    HZ   PHE  31           HZ       PHE  31   3.144  -0.323   1.847
  254    H    SER  32           HN       SER  32   7.340  -4.169   7.254
  255    HA   SER  32           HA       SER  32   7.401  -3.806  10.202
  256    HB2  SER  32           HB2      SER  32   8.117  -6.323   8.703
  257    HB3  SER  32           HB1      SER  32   8.331  -6.078  10.435
  258    HG   SER  32           HG       SER  32   6.397  -7.047  10.294
  259    H    SER  33           HN       SER  33   8.706  -2.186   8.190
  260    HA   SER  33           HA       SER  33  11.400  -2.267   9.157
  261    HB2  SER  33           HB2      SER  33  11.677  -4.164   7.672
  262    HB3  SER  33           HB1      SER  33  10.968  -3.262   6.335
  263    HG   SER  33           HG       SER  33  13.256  -3.277   6.250
  264    H    ARG  34           HN       ARG  34  12.403  -0.346   8.927
  265    HA   ARG  34           HA       ARG  34  10.897   1.862   7.947
  266    HB2  ARG  34           HB2      ARG  34  12.655   2.024   9.677
  267    HB3  ARG  34           HB1      ARG  34  13.874   1.682   8.461
  268    HG2  ARG  34           HG2      ARG  34  13.376   3.744   7.316
  269    HG3  ARG  34           HG1      ARG  34  12.040   4.070   8.421
  270    HD2  ARG  34           HD2      ARG  34  14.921   3.793   9.268
  271    HD3  ARG  34           HD1      ARG  34  14.133   5.333   8.930
  272    HE   ARG  34           HE       ARG  34  12.491   4.111  10.796
  273   HH11  ARG  34          HH11      ARG  34  15.909   5.035  10.663
  274   HH12  ARG  34          HH12      ARG  34  16.028   5.296  12.369
  275   HH21  ARG  34          HH21      ARG  34  12.693   4.473  13.036
  276   HH22  ARG  34          HH22      ARG  34  14.204   4.978  13.717
  277    H    GLY  35           HN       GLY  35  13.812   0.255   6.605
  278    HA2  GLY  35           HA2      GLY  35  13.936   1.807   4.229
  279    HA3  GLY  35           HA1      GLY  35  14.599   0.194   4.434
  280    H    GLU  36           HN       GLU  36  12.065  -1.098   5.032
  281    HA   GLU  36           HA       GLU  36  11.240  -1.786   2.419
  282    HB2  GLU  36           HB2      GLU  36  10.814  -3.238   4.319
  283    HB3  GLU  36           HB1      GLU  36   9.772  -2.030   5.054
  284    HG2  GLU  36           HG2      GLU  36   8.438  -3.774   4.083
  285    HG3  GLU  36           HG1      GLU  36   8.195  -2.277   3.188
  286    H    PHE  37           HN       PHE  37   9.869   0.514   4.772
  287    HA   PHE  37           HA       PHE  37   7.588   1.256   3.270
  288    HB2  PHE  37           HB2      PHE  37   8.134   1.846   5.682
  289    HB3  PHE  37           HB1      PHE  37   9.172   3.117   5.047
  290    HD1  PHE  37           HD2      PHE  37   5.671   1.866   4.898
  291    HD2  PHE  37           HD1      PHE  37   8.288   5.211   4.612
  292    HE1  PHE  37           HE2      PHE  37   3.729   3.369   4.760
  293    HE2  PHE  37           HE1      PHE  37   6.349   6.720   4.475
  294    HZ   PHE  37           HZ       PHE  37   4.066   5.799   4.548
  295    H    ILE  38           HN       ILE  38  10.913   2.583   3.282
  296    HA   ILE  38           HA       ILE  38  10.544   4.697   1.502
  297    HB   ILE  38           HB       ILE  38  12.938   2.860   1.669
  298   HG12  ILE  38          HG12      ILE  38  12.440   3.774   3.845
  299   HG13  ILE  38          HG11      ILE  38  13.819   4.648   3.189
  300   HG21  ILE  38          HG21      ILE  38  14.195   4.809   0.820
  301   HG22  ILE  38          HG22      ILE  38  12.669   5.654   0.568
  302   HG23  ILE  38          HG23      ILE  38  13.027   4.189  -0.346
  303   HD11  ILE  38          HD11      ILE  38  12.338   6.493   2.559
  304   HD12  ILE  38          HD12      ILE  38  12.281   6.157   4.290
  305   HD13  ILE  38          HD13      ILE  38  10.968   5.616   3.243
  306    H    SER  39           HN       SER  39  11.467   1.303   0.657
  307    HA   SER  39           HA       SER  39  11.474   1.730  -2.147
  308    HB2  SER  39           HB2      SER  39  10.813  -0.821  -0.633
  309    HB3  SER  39           HB1      SER  39  11.246  -0.728  -2.340
  310    HG   SER  39           HG       SER  39  12.910  -1.098  -0.467
  311    H    VAL  40           HN       VAL  40   8.924  -0.051  -0.316
  312    HA   VAL  40           HA       VAL  40   7.002  -0.348  -2.106
  313    HB   VAL  40           HB       VAL  40   5.262   0.004  -0.403
  314   HG11  VAL  40          HG11      VAL  40   6.271  -2.112  -0.378
  315   HG12  VAL  40          HG12      VAL  40   6.307  -1.577   1.301
  316   HG13  VAL  40          HG13      VAL  40   7.764  -1.487   0.316
  317   HG21  VAL  40          HG21      VAL  40   6.231   1.992   0.675
  318   HG22  VAL  40          HG22      VAL  40   7.519   0.985   1.333
  319   HG23  VAL  40          HG23      VAL  40   5.851   0.720   1.834
  320    H    GLY  41           HN       GLY  41   7.677   2.942  -0.765
  321    HA2  GLY  41           HA2      GLY  41   7.193   4.605  -2.631
  322    HA3  GLY  41           HA1      GLY  41   5.575   3.916  -2.637
  323    H    GLY  42           HN       GLY  42   7.721   4.664   0.134
  324    HA2  GLY  42           HA2      GLY  42   5.623   6.598   1.025
  325    HA3  GLY  42           HA1      GLY  42   6.389   5.470   2.122
  326    H    ASP  43           HN       ASP  43   6.734   8.390   0.251
  327    HA   ASP  43           HA       ASP  43   9.409   8.928   1.335
  328    HB2  ASP  43           HB2      ASP  43   7.500  10.600  -0.318
  329    HB3  ASP  43           HB1      ASP  43   9.090  11.161   0.195
  330    H    GLY  44           HN       GLY  44   6.484  11.037   1.375
  331    HA2  GLY  44           HA2      GLY  44   6.503  11.066   4.307
  332    HA3  GLY  44           HA1      GLY  44   7.075  12.551   3.569
  333    H    ARG  45           HN       ARG  45   5.591  13.471   1.817
  334    HA   ARG  45           HA       ARG  45   2.896  13.531   3.005
  335    HB2  ARG  45           HB2      ARG  45   4.224  15.227   0.885
  336    HB3  ARG  45           HB1      ARG  45   2.555  15.436   1.392
  337    HG2  ARG  45           HG2      ARG  45   3.803  17.048   2.567
  338    HG3  ARG  45           HG1      ARG  45   3.432  15.777   3.733
  339    HD2  ARG  45           HD2      ARG  45   5.761  16.589   3.889
  340    HD3  ARG  45           HD1      ARG  45   5.650  14.869   3.528
  341    HE   ARG  45           HE       ARG  45   5.928  16.646   1.207
  342   HH11  ARG  45          HH11      ARG  45   7.568  14.593   3.582
  343   HH12  ARG  45          HH12      ARG  45   8.972  14.367   2.594
  344   HH21  ARG  45          HH21      ARG  45   7.795  16.323  -0.057
  345   HH22  ARG  45          HH22      ARG  45   9.101  15.350   0.530
  346    H    MET  46           HN       MET  46   2.041  11.545   2.401
  347    HA   MET  46           HA       MET  46   1.978  10.798  -0.417
  348    HB2  MET  46           HB2      MET  46   1.919   9.299   1.757
  349    HB3  MET  46           HB1      MET  46   0.184   9.531   1.606
  350    HG2  MET  46           HG2      MET  46   0.149   7.851   0.170
  351    HG3  MET  46           HG1      MET  46   1.064   8.852  -0.953
  352    HE1  MET  46           HE1      MET  46   3.834   9.134   0.721
  353    HE2  MET  46           HE2      MET  46   3.724   8.914  -1.025
  354    HE3  MET  46           HE3      MET  46   4.758   7.856  -0.068
  355    H    SER  47           HN       SER  47  -0.199  10.102  -1.387
  356    HA   SER  47           HA       SER  47  -1.926  12.484  -1.276
  357    HB2  SER  47           HB2      SER  47  -1.679  10.172  -3.191
  358    HB3  SER  47           HB1      SER  47  -3.010  11.323  -3.288
  359    HG   SER  47           HG       SER  47  -0.692  11.603  -4.377
  360    H    HIS  48           HN       HIS  48  -2.843   9.101  -1.882
  361    HA   HIS  48           HA       HIS  48  -4.457   8.693   0.452
  362    HB2  HIS  48           HB2      HIS  48  -5.833  10.491  -0.458
  363    HB3  HIS  48           HB1      HIS  48  -5.898   9.671  -2.013
  364    HD1  HIS  48           HD1      HIS  48  -7.150   9.396   1.553
  365    HD2  HIS  48           HD2      HIS  48  -7.835   7.712  -2.226
  366    HE1  HIS  48           HE1      HIS  48  -9.251   7.988   1.765
  367    HE2  HIS  48           HE2      HIS  48  -9.621   6.904  -0.505
  368    H    LYS  49           HN       LYS  49  -5.054   8.096  -3.047
  369    HA   LYS  49           HA       LYS  49  -5.439   5.288  -2.614
  370    HB2  LYS  49           HB2      LYS  49  -4.977   7.029  -5.016
  371    HB3  LYS  49           HB1      LYS  49  -4.968   5.281  -5.182
  372    HG2  LYS  49           HG2      LYS  49  -7.231   5.249  -4.133
  373    HG3  LYS  49           HG1      LYS  49  -7.229   7.009  -4.211
  374    HD2  LYS  49           HD2      LYS  49  -6.850   5.227  -6.614
  375    HD3  LYS  49           HD1      LYS  49  -8.415   5.864  -6.107
  376    HE2  LYS  49           HE2      LYS  49  -6.018   7.570  -6.769
  377    HE3  LYS  49           HE1      LYS  49  -7.304   7.182  -7.909
  378    HZ1  LYS  49           HZ1      LYS  49  -7.628   8.660  -5.351
  379    HZ2  LYS  49           HZ2      LYS  49  -8.885   8.257  -6.407
  380    HZ3  LYS  49           HZ3      LYS  49  -7.677   9.332  -6.904
  381    H    GLU  50           HN       GLU  50  -2.627   7.295  -3.200
  382    HA   GLU  50           HA       GLU  50  -0.832   5.275  -4.109
  383    HB2  GLU  50           HB2      GLU  50  -0.359   7.632  -4.384
  384    HB3  GLU  50           HB1      GLU  50  -0.348   7.873  -2.644
  385    HG2  GLU  50           HG2      GLU  50   1.903   7.832  -3.600
  386    HG3  GLU  50           HG1      GLU  50   1.651   6.541  -2.429
  387    H    ALA  51           HN       ALA  51  -1.339   6.660  -0.823
  388    HA   ALA  51           HA       ALA  51   0.600   5.218   0.544
  389    HB1  ALA  51           HB1      ALA  51  -0.719   5.540   2.555
  390    HB2  ALA  51           HB2      ALA  51  -2.157   5.860   1.587
  391    HB3  ALA  51           HB3      ALA  51  -0.798   6.982   1.545
  392    H    ILE  52           HN       ILE  52  -2.837   4.117   0.147
  393    HA   ILE  52           HA       ILE  52  -2.332   1.662   1.443
  394    HB   ILE  52           HB       ILE  52  -4.376   2.227  -0.735
  395   HG12  ILE  52          HG12      ILE  52  -4.566   3.689   1.238
  396   HG13  ILE  52          HG11      ILE  52  -5.930   2.591   1.118
  397   HG21  ILE  52          HG21      ILE  52  -4.021  -0.170  -0.480
  398   HG22  ILE  52          HG22      ILE  52  -5.604   0.300   0.137
  399   HG23  ILE  52          HG23      ILE  52  -4.285  -0.035   1.258
  400   HD11  ILE  52          HD11      ILE  52  -4.878   1.152   2.818
  401   HD12  ILE  52          HD12      ILE  52  -5.217   2.779   3.406
  402   HD13  ILE  52          HD13      ILE  52  -3.570   2.326   2.965
  403    H    LEU  53           HN       LEU  53  -2.105   2.536  -2.021
  404    HA   LEU  53           HA       LEU  53  -1.771  -0.052  -3.050
  405    HB2  LEU  53           HB2      LEU  53  -1.998   2.074  -4.368
  406    HB3  LEU  53           HB1      LEU  53  -0.341   2.500  -4.007
  407    HG   LEU  53           HG       LEU  53   0.401   0.450  -5.223
  408   HD11  LEU  53          HD11      LEU  53  -2.514   0.290  -5.977
  409   HD12  LEU  53          HD12      LEU  53  -1.608  -0.885  -5.022
  410   HD13  LEU  53          HD13      LEU  53  -1.213  -0.638  -6.723
  411   HD21  LEU  53          HD21      LEU  53   0.496   2.545  -6.360
  412   HD22  LEU  53          HD22      LEU  53  -1.234   2.507  -6.693
  413   HD23  LEU  53          HD23      LEU  53  -0.159   1.358  -7.488
  414    H    LEU  54           HN       LEU  54   0.642   1.904  -1.268
  415    HA   LEU  54           HA       LEU  54   3.073   0.784  -2.004
  416    HB2  LEU  54           HB2      LEU  54   1.883   1.668   0.626
  417    HB3  LEU  54           HB1      LEU  54   3.412   0.825   0.663
  418    HG   LEU  54           HG       LEU  54   4.375   2.521  -0.848
  419   HD11  LEU  54          HD11      LEU  54   2.354   3.214  -2.002
  420   HD12  LEU  54          HD12      LEU  54   3.149   4.598  -1.252
  421   HD13  LEU  54          HD13      LEU  54   1.717   3.894  -0.504
  422   HD21  LEU  54          HD21      LEU  54   4.481   4.316   0.800
  423   HD22  LEU  54          HD22      LEU  54   4.600   2.739   1.575
  424   HD23  LEU  54          HD23      LEU  54   3.086   3.639   1.638
  425    H    GLY  55           HN       GLY  55   0.438  -0.770  -0.103
  426    HA2  GLY  55           HA2      GLY  55   1.753  -2.917   1.072
  427    HA3  GLY  55           HA1      GLY  55   0.114  -2.985   0.462
  428    H    LEU  56           HN       LEU  56   0.501  -2.812  -2.289
  429    HA   LEU  56           HA       LEU  56   1.001  -5.452  -3.011
  430    HB2  LEU  56           HB2      LEU  56   1.585  -3.107  -4.808
  431    HB3  LEU  56           HB1      LEU  56   1.137  -4.733  -5.289
  432    HG   LEU  56           HG       LEU  56  -0.613  -2.631  -4.028
  433   HD11  LEU  56          HD11      LEU  56  -0.750  -4.164  -6.619
  434   HD12  LEU  56          HD12      LEU  56  -0.360  -2.457  -6.421
  435   HD13  LEU  56          HD13      LEU  56  -1.978  -3.042  -6.036
  436   HD21  LEU  56          HD21      LEU  56  -1.084  -5.586  -4.315
  437   HD22  LEU  56          HD22      LEU  56  -2.403  -4.422  -4.186
  438   HD23  LEU  56          HD23      LEU  56  -1.240  -4.585  -2.871
  439    H    ARG  57           HN       ARG  57   3.332  -2.752  -2.967
  440    HA   ARG  57           HA       ARG  57   5.505  -4.210  -4.092
  441    HB2  ARG  57           HB2      ARG  57   5.531  -1.890  -2.152
  442    HB3  ARG  57           HB1      ARG  57   6.931  -2.465  -3.047
  443    HG2  ARG  57           HG2      ARG  57   4.412  -1.371  -4.285
  444    HG3  ARG  57           HG1      ARG  57   5.912  -0.472  -4.054
  445    HD2  ARG  57           HD2      ARG  57   7.087  -2.049  -5.500
  446    HD3  ARG  57           HD1      ARG  57   5.601  -2.973  -5.714
  447    HE   ARG  57           HE       ARG  57   4.962  -0.388  -6.500
  448   HH11  ARG  57          HH11      ARG  57   7.325  -2.840  -7.473
  449   HH12  ARG  57          HH12      ARG  57   7.382  -2.302  -9.117
  450   HH21  ARG  57          HH21      ARG  57   5.073   0.287  -8.672
  451   HH22  ARG  57          HH22      ARG  57   6.104  -0.527  -9.799
  452    H    TYR  58           HN       TYR  58   4.275  -3.948  -0.793
  453    HA   TYR  58           HA       TYR  58   6.507  -5.189   0.502
  454    HB2  TYR  58           HB2      TYR  58   4.756  -3.843   1.648
  455    HB3  TYR  58           HB1      TYR  58   3.606  -5.142   1.362
  456    HD1  TYR  58           HD2      TYR  58   6.791  -4.342   3.094
  457    HD2  TYR  58           HD1      TYR  58   3.439  -6.945   2.850
  458    HE1  TYR  58           HE2      TYR  58   7.477  -5.408   5.200
  459    HE2  TYR  58           HE1      TYR  58   4.111  -8.018   4.957
  460    HH   TYR  58           HH       TYR  58   6.262  -8.327   6.268
  461    H    LYS  59           HN       LYS  59   3.370  -6.449  -0.632
  462    HA   LYS  59           HA       LYS  59   4.022  -9.181   0.099
  463    HB2  LYS  59           HB2      LYS  59   1.768  -8.007  -1.515
  464    HB3  LYS  59           HB1      LYS  59   1.876  -9.694  -1.038
  465    HG2  LYS  59           HG2      LYS  59   1.766  -7.370   0.871
  466    HG3  LYS  59           HG1      LYS  59   0.390  -8.375   0.413
  467    HD2  LYS  59           HD2      LYS  59   1.433 -10.324   1.378
  468    HD3  LYS  59           HD1      LYS  59   2.911  -9.416   1.705
  469    HE2  LYS  59           HE2      LYS  59   1.676  -7.974   3.248
  470    HE3  LYS  59           HE1      LYS  59   0.203  -8.888   2.923
  471    HZ1  LYS  59           HZ1      LYS  59   1.262 -10.854   3.842
  472    HZ2  LYS  59           HZ2      LYS  59   1.262  -9.600   4.975
  473    HZ3  LYS  59           HZ3      LYS  59   2.682  -9.983   4.142
  474    H    LYS  60           HN       LYS  60   4.786  -7.201  -2.573
  475    HA   LYS  60           HA       LYS  60   5.891  -7.674  -4.515
  476    HB2  LYS  60           HB2      LYS  60   6.015 -10.566  -3.647
  477    HB3  LYS  60           HB1      LYS  60   7.045  -9.761  -4.821
  478    HG2  LYS  60           HG2      LYS  60   8.009  -8.388  -3.058
  479    HG3  LYS  60           HG1      LYS  60   6.954  -9.154  -1.872
  480    HD2  LYS  60           HD2      LYS  60   9.002 -10.602  -3.550
  481    HD3  LYS  60           HD1      LYS  60   9.249 -10.087  -1.881
  482    HE2  LYS  60           HE2      LYS  60   7.121 -12.006  -2.832
  483    HE3  LYS  60           HE1      LYS  60   8.628 -12.460  -2.038
  484    HZ1  LYS  60           HZ1      LYS  60   6.853 -12.441  -0.445
  485    HZ2  LYS  60           HZ2      LYS  60   6.423 -10.858  -0.856
  486    HZ3  LYS  60           HZ3      LYS  60   7.902 -11.161  -0.094
  487    H    LEU  61           HN       LEU  61   3.587  -7.175  -5.165
  488    HA   LEU  61           HA       LEU  61   2.899  -8.992  -7.276
  489    HB2  LEU  61           HB2      LEU  61   0.451  -9.250  -6.366
  490    HB3  LEU  61           HB1      LEU  61   1.707 -10.369  -5.882
  491    HG   LEU  61           HG       LEU  61   1.987  -9.181  -3.762
  492   HD11  LEU  61          HD11      LEU  61   1.360  -6.937  -4.599
  493   HD12  LEU  61          HD12      LEU  61   0.551  -7.381  -3.098
  494   HD13  LEU  61          HD13      LEU  61  -0.324  -7.457  -4.625
  495   HD21  LEU  61          HD21      LEU  61  -0.137  -9.794  -2.749
  496   HD22  LEU  61          HD22      LEU  61   0.373 -11.015  -3.915
  497   HD23  LEU  61          HD23      LEU  61  -0.892  -9.863  -4.341
  498    H    TYR  62           HN       TYR  62   3.517  -6.154  -6.839
  499    HA   TYR  62           HA       TYR  62   1.266  -4.497  -7.081
  500    HB2  TYR  62           HB2      TYR  62   3.553  -3.706  -6.693
  501    HB3  TYR  62           HB1      TYR  62   4.005  -4.183  -8.323
  502    HD1  TYR  62           HD1      TYR  62   2.156  -1.740  -6.307
  503    HD2  TYR  62           HD2      TYR  62   3.377  -2.840 -10.231
  504    HE1  TYR  62           HE1      TYR  62   1.545   0.497  -7.119
  505    HE2  TYR  62           HE2      TYR  62   2.767  -0.606 -11.055
  506    HH   TYR  62           HH       TYR  62   1.290   1.260 -10.413
  507    H    ASN  63           HN       ASN  63   2.548  -6.744  -9.399
  508    HA   ASN  63           HA       ASN  63   1.655  -5.415 -11.773
  509    HB2  ASN  63           HB2      ASN  63   3.368  -7.184 -11.757
  510    HB3  ASN  63           HB1      ASN  63   2.139  -8.363 -11.308
  511   HD21  ASN  63          HD21      ASN  63   3.394  -6.291 -13.830
  512   HD22  ASN  63          HD22      ASN  63   2.498  -7.076 -15.177
  513    H    GLN  64           HN       GLN  64   0.269  -8.413 -10.298
  514    HA   GLN  64           HA       GLN  64  -2.230  -7.801 -11.739
  515    HB2  GLN  64           HB2      GLN  64  -1.177 -10.263 -10.389
  516    HB3  GLN  64           HB1      GLN  64  -2.861 -10.136 -10.873
  517    HG2  GLN  64           HG2      GLN  64  -2.207  -9.829 -13.183
  518    HG3  GLN  64           HG1      GLN  64  -0.506  -9.851 -12.725
  519   HE21  GLN  64          HE21      GLN  64  -0.020 -11.583 -14.053
  520   HE22  GLN  64          HE22      GLN  64  -0.575 -13.248 -13.665
  521    H    ALA  65           HN       ALA  65  -1.073  -7.079  -8.642
  522    HA   ALA  65           HA       ALA  65  -3.492  -7.792  -7.203
  523    HB1  ALA  65           HB1      ALA  65  -1.341  -7.647  -6.071
  524    HB2  ALA  65           HB2      ALA  65  -2.518  -6.544  -5.358
  525    HB3  ALA  65           HB3      ALA  65  -1.262  -5.923  -6.428
  526    H    ARG  66           HN       ARG  66  -2.163  -4.805  -8.639
  527    HA   ARG  66           HA       ARG  66  -4.238  -3.095  -7.667
  528    HB2  ARG  66           HB2      ARG  66  -2.057  -2.299  -8.520
  529    HB3  ARG  66           HB1      ARG  66  -2.540  -2.765 -10.145
  530    HG2  ARG  66           HG2      ARG  66  -4.229  -1.108 -10.221
  531    HG3  ARG  66           HG1      ARG  66  -4.088  -0.790  -8.491
  532    HD2  ARG  66           HD2      ARG  66  -3.015   0.978  -9.729
  533    HD3  ARG  66           HD1      ARG  66  -1.799   0.046  -8.860
  534    HE   ARG  66           HE       ARG  66  -1.832  -1.143 -11.325
  535   HH11  ARG  66          HH11      ARG  66  -1.497   2.215 -10.243
  536   HH12  ARG  66          HH12      ARG  66  -0.499   2.671 -11.582
  537   HH21  ARG  66          HH21      ARG  66  -0.511  -0.498 -13.064
  538   HH22  ARG  66          HH22      ARG  66   0.062   1.132 -13.181
  539    H    VAL  67           HN       VAL  67  -4.077  -5.291 -10.404
  540    HA   VAL  67           HA       VAL  67  -6.475  -4.108 -11.632
  541    HB   VAL  67           HB       VAL  67  -4.656  -5.001 -13.055
  542   HG11  VAL  67          HG11      VAL  67  -4.393  -7.423 -13.316
  543   HG12  VAL  67          HG12      VAL  67  -5.515  -7.685 -11.982
  544   HG13  VAL  67          HG13      VAL  67  -3.968  -6.891 -11.690
  545   HG21  VAL  67          HG21      VAL  67  -6.925  -4.809 -13.932
  546   HG22  VAL  67          HG22      VAL  67  -7.292  -6.437 -13.361
  547   HG23  VAL  67          HG23      VAL  67  -6.090  -6.198 -14.629
  548    H    LYS  68           HN       LYS  68  -5.590  -6.864  -9.612
  549    HA   LYS  68           HA       LYS  68  -8.104  -8.246  -9.962
  550    HB2  LYS  68           HB2      LYS  68  -5.742  -8.518  -8.164
  551    HB3  LYS  68           HB1      LYS  68  -7.234  -9.327  -7.708
  552    HG2  LYS  68           HG2      LYS  68  -7.252 -10.571  -9.761
  553    HG3  LYS  68           HG1      LYS  68  -5.859  -9.672 -10.362
  554    HD2  LYS  68           HD2      LYS  68  -4.411 -10.672  -8.793
  555    HD3  LYS  68           HD1      LYS  68  -5.755 -11.289  -7.830
  556    HE2  LYS  68           HE2      LYS  68  -4.657 -13.054  -9.151
  557    HE3  LYS  68           HE1      LYS  68  -6.351 -12.840  -9.587
  558    HZ1  LYS  68           HZ1      LYS  68  -4.922 -13.095 -11.533
  559    HZ2  LYS  68           HZ2      LYS  68  -4.046 -11.718 -11.090
  560    HZ3  LYS  68           HZ3      LYS  68  -5.675 -11.580 -11.521
  561    H    TYR  69           HN       TYR  69  -7.114  -5.553  -8.002
  562    HA   TYR  69           HA       TYR  69  -9.748  -5.712  -6.627
  563    HB2  TYR  69           HB2      TYR  69  -7.089  -5.045  -5.355
  564    HB3  TYR  69           HB1      TYR  69  -8.647  -4.780  -4.580
  565    HD1  TYR  69           HD1      TYR  69  -6.284  -7.339  -5.777
  566    HD2  TYR  69           HD2      TYR  69  -9.896  -6.604  -3.652
  567    HE1  TYR  69           HE1      TYR  69  -6.259  -9.652  -4.946
  568    HE2  TYR  69           HE2      TYR  69  -9.879  -8.912  -2.813
  569    HH   TYR  69           HH       TYR  69  -8.921 -11.114  -3.487
  570    H    SER  70           HN       SER  70 -10.526  -3.653  -5.759
  571    HA   SER  70           HA       SER  70 -10.071  -1.546  -7.722
  572    HB2  SER  70           HB2      SER  70 -11.847  -1.624  -5.270
  573    HB3  SER  70           HB1      SER  70 -11.864  -0.356  -6.495
  574    HG   SER  70           HG       SER  70 -13.193  -1.589  -7.541
  575    H    LEU  71           HN       LEU  71  -7.981  -0.800  -7.452
  576    HA   LEU  71           HA       LEU  71  -7.443   0.553  -4.845
  577    HB2  LEU  71           HB2      LEU  71  -5.590  -0.557  -6.949
  578    HB3  LEU  71           HB1      LEU  71  -5.034   0.537  -5.698
  579    HG   LEU  71           HG       LEU  71  -5.844  -1.127  -3.994
  580   HD11  LEU  71          HD11      LEU  71  -6.110  -3.467  -4.830
  581   HD12  LEU  71          HD12      LEU  71  -6.231  -2.808  -6.461
  582   HD13  LEU  71          HD13      LEU  71  -7.435  -2.380  -5.244
  583   HD21  LEU  71          HD21      LEU  71  -3.711  -1.948  -5.957
  584   HD22  LEU  71          HD22      LEU  71  -3.954  -2.705  -4.384
  585   HD23  LEU  71          HD23      LEU  71  -3.509  -1.001  -4.482
  586    H    LEU  72           HN       LEU  72  -6.447   0.923  -8.281
  587    HA   LEU  72           HA       LEU  72  -6.630   3.857  -7.909
  588    HB2  LEU  72           HB2      LEU  72  -5.312   2.100  -9.962
  589    HB3  LEU  72           HB1      LEU  72  -5.562   3.809 -10.260
  590    HG   LEU  72           HG       LEU  72  -3.289   3.325  -9.462
  591   HD11  LEU  72          HD11      LEU  72  -4.949   4.896  -7.497
  592   HD12  LEU  72          HD12      LEU  72  -4.277   5.505  -9.009
  593   HD13  LEU  72          HD13      LEU  72  -3.201   5.011  -7.702
  594   HD21  LEU  72          HD21      LEU  72  -3.871   1.382  -8.051
  595   HD22  LEU  72          HD22      LEU  72  -4.610   2.481  -6.887
  596   HD23  LEU  72          HD23      LEU  72  -2.881   2.570  -7.209
  597    H    GLU  73           HN       GLU  73  -8.794   4.290  -7.992
  598    HA   GLU  73           HA       GLU  73 -10.253   3.372 -10.408
  599    HB2  GLU  73           HB2      GLU  73 -11.397   4.824  -8.020
  600    HB3  GLU  73           HB1      GLU  73 -12.273   3.931  -9.253
  601    HG2  GLU  73           HG2      GLU  73 -10.456   2.791  -7.143
  602    HG3  GLU  73           HG1      GLU  73 -12.210   2.657  -7.220
  Start of MODEL   14
    1    H1   SER   1           HT1      SER   1   1.042  16.963   8.923
    2    H2   SER   1           HT2      SER   1   2.041  16.027   9.917
    3    H3   SER   1           HT3      SER   1   0.565  16.607  10.508
    4    HA   SER   1           HA       SER   1   0.419  14.266   9.977
    5    HB2  SER   1           HB2      SER   1  -1.581  15.694   9.735
    6    HB3  SER   1           HB1      SER   1  -1.143  16.018   8.058
    7    HG   SER   1           HG       SER   1  -2.202  13.718   9.213
    8    H    ASP   2           HN       ASP   2   1.870  12.940   9.085
    9    HA   ASP   2           HA       ASP   2   2.334  13.248   6.155
   10    HB2  ASP   2           HB2      ASP   2   4.241  12.355   8.315
   11    HB3  ASP   2           HB1      ASP   2   4.561  12.149   6.596
   12    H    VAL   3           HN       VAL   3   3.282  11.114   5.219
   13    HA   VAL   3           HA       VAL   3   1.218   9.127   5.523
   14    HB   VAL   3           HB       VAL   3   2.408   9.559   3.387
   15   HG11  VAL   3          HG11      VAL   3   4.674   9.819   4.294
   16   HG12  VAL   3          HG12      VAL   3   4.615   8.630   2.994
   17   HG13  VAL   3          HG13      VAL   3   4.712   8.096   4.672
   18   HG21  VAL   3          HG21      VAL   3   2.529   6.729   4.422
   19   HG22  VAL   3          HG22      VAL   3   2.623   7.188   2.723
   20   HG23  VAL   3          HG23      VAL   3   1.155   7.514   3.644
   21    H    TRP   4           HN       TRP   4   4.480   9.518   6.810
   22    HA   TRP   4           HA       TRP   4   4.583   6.784   7.814
   23    HB2  TRP   4           HB2      TRP   4   6.478   8.706   7.263
   24    HB3  TRP   4           HB1      TRP   4   6.427   8.718   9.021
   25    HD1  TRP   4           HD1      TRP   4   6.276   5.790   9.834
   26    HE1  TRP   4           HE1      TRP   4   8.130   4.065   9.262
   27    HE3  TRP   4           HE3      TRP   4   8.387   8.242   5.873
   28    HZ2  TRP   4           HZ2      TRP   4  10.204   3.840   7.349
   29    HZ3  TRP   4           HZ3      TRP   4  10.301   7.204   4.729
   30    HH2  TRP   4           HH2      TRP   4  11.190   5.049   5.453
   31    H    SER   5           HN       SER   5   3.980  10.043   9.133
   32    HA   SER   5           HA       SER   5   3.776   9.274  11.864
   33    HB2  SER   5           HB2      SER   5   3.914  11.625  11.111
   34    HB3  SER   5           HB1      SER   5   2.299  11.491  10.417
   35    HG   SER   5           HG       SER   5   2.874  12.212  12.839
   36    H    LEU   6           HN       LEU   6   1.238   9.700   9.363
   37    HA   LEU   6           HA       LEU   6  -0.655   8.246  11.121
   38    HB2  LEU   6           HB2      LEU   6  -1.026   9.912   8.638
   39    HB3  LEU   6           HB1      LEU   6  -2.313   8.926   9.303
   40    HG   LEU   6           HG       LEU   6  -2.612  11.205  10.017
   41   HD11  LEU   6          HD11      LEU   6  -1.583   9.523  12.298
   42   HD12  LEU   6          HD12      LEU   6  -3.205   9.449  11.609
   43   HD13  LEU   6          HD13      LEU   6  -2.662  10.912  12.431
   44   HD21  LEU   6          HD21      LEU   6   0.117  11.048  11.288
   45   HD22  LEU   6          HD22      LEU   6  -0.978  12.430  11.282
   46   HD23  LEU   6          HD23      LEU   6  -0.237  11.886   9.777
   47    H    SER   7           HN       SER   7   0.017   6.142  10.945
   48    HA   SER   7           HA       SER   7  -0.319   4.962   8.222
   49    HB2  SER   7           HB2      SER   7   1.680   4.198  10.361
   50    HB3  SER   7           HB1      SER   7   1.393   3.272   8.888
   51    HG   SER   7           HG       SER   7   2.179   4.950   7.684
   52    H    LYS   8           HN       LYS   8  -2.033   5.274  10.853
   53    HA   LYS   8           HA       LYS   8  -2.669   2.380  11.124
   54    HB2  LYS   8           HB2      LYS   8  -3.434   4.722  12.877
   55    HB3  LYS   8           HB1      LYS   8  -3.892   3.052  13.164
   56    HG2  LYS   8           HG2      LYS   8  -1.145   4.261  13.281
   57    HG3  LYS   8           HG1      LYS   8  -2.065   3.516  14.589
   58    HD2  LYS   8           HD2      LYS   8  -1.003   2.082  12.152
   59    HD3  LYS   8           HD1      LYS   8  -0.273   2.049  13.757
   60    HE2  LYS   8           HE2      LYS   8  -2.228   0.962  14.669
   61    HE3  LYS   8           HE1      LYS   8  -3.065   1.101  13.123
   62    HZ1  LYS   8           HZ1      LYS   8  -1.428  -0.370  12.137
   63    HZ2  LYS   8           HZ2      LYS   8  -2.162  -1.118  13.465
   64    HZ3  LYS   8           HZ3      LYS   8  -0.600  -0.487  13.608
   65    H    THR   9           HN       THR   9  -3.444   3.853   8.774
   66    HA   THR   9           HA       THR   9  -6.405   3.742   9.121
   67    HB   THR   9           HB       THR   9  -5.943   6.037   8.746
   68    HG1  THR   9           HG1      THR   9  -7.582   5.757   7.407
   69   HG21  THR   9          HG21      THR   9  -3.629   5.865   7.999
   70   HG22  THR   9          HG22      THR   9  -4.564   6.865   6.888
   71   HG23  THR   9          HG23      THR   9  -4.160   5.205   6.453
   72    H    SER  10           HN       SER  10  -6.988   1.833   8.309
   73    HA   SER  10           HA       SER  10  -5.586   0.768   5.951
   74    HB2  SER  10           HB2      SER  10  -6.981  -1.241   6.331
   75    HB3  SER  10           HB1      SER  10  -6.098  -0.765   7.780
   76    HG   SER  10           HG       SER  10  -7.924  -0.351   8.753
   77    H    MET  11           HN       MET  11  -6.951  -0.346   4.251
   78    HA   MET  11           HA       MET  11  -9.377   1.242   3.601
   79    HB2  MET  11           HB2      MET  11  -7.420   2.194   2.381
   80    HB3  MET  11           HB1      MET  11  -7.166   0.625   1.630
   81    HG2  MET  11           HG2      MET  11  -8.310   2.069   0.096
   82    HG3  MET  11           HG1      MET  11  -9.396   0.777   0.605
   83    HE1  MET  11           HE1      MET  11  -8.344   4.059   2.557
   84    HE2  MET  11           HE2      MET  11  -9.648   5.145   2.077
   85    HE3  MET  11           HE3      MET  11  -8.494   4.567   0.875
   86    H    THR  12           HN       THR  12 -10.943   0.158   2.374
   87    HA   THR  12           HA       THR  12 -10.693  -2.763   2.571
   88    HB   THR  12           HB       THR  12 -13.059  -1.125   1.639
   89    HG1  THR  12           HG1      THR  12 -13.058  -0.614   3.713
   90   HG21  THR  12          HG21      THR  12 -12.849  -3.998   2.561
   91   HG22  THR  12          HG22      THR  12 -13.148  -3.457   0.910
   92   HG23  THR  12          HG23      THR  12 -14.347  -3.154   2.167
   93    H    PHE  13           HN       PHE  13 -10.190  -4.095   1.000
   94    HA   PHE  13           HA       PHE  13  -9.975  -3.046  -1.757
   95    HB2  PHE  13           HB2      PHE  13  -9.034  -5.601  -0.453
   96    HB3  PHE  13           HB1      PHE  13  -8.813  -5.235  -2.157
   97    HD1  PHE  13           HD2      PHE  13  -7.314  -3.406  -2.844
   98    HD2  PHE  13           HD1      PHE  13  -7.653  -4.625   1.215
   99    HE1  PHE  13           HE2      PHE  13  -5.204  -2.252  -2.324
  100    HE2  PHE  13           HE1      PHE  13  -5.548  -3.476   1.742
  101    HZ   PHE  13           HZ       PHE  13  -4.317  -2.290  -0.028
  102    H    GLN  14           HN       GLN  14 -11.074  -3.815  -3.505
  103    HA   GLN  14           HA       GLN  14 -13.200  -5.817  -2.901
  104    HB2  GLN  14           HB2      GLN  14 -14.212  -3.603  -3.023
  105    HB3  GLN  14           HB1      GLN  14 -13.451  -3.314  -4.581
  106    HG2  GLN  14           HG2      GLN  14 -14.757  -5.176  -5.532
  107    HG3  GLN  14           HG1      GLN  14 -15.557  -5.380  -3.975
  108   HE21  GLN  14          HE21      GLN  14 -17.598  -4.981  -4.797
  109   HE22  GLN  14          HE22      GLN  14 -18.098  -3.332  -5.309
  110    HA   PRO  15           HA       PRO  15 -10.894  -7.787  -6.252
  111    HB2  PRO  15           HB2      PRO  15 -12.921  -9.889  -5.815
  112    HB3  PRO  15           HB1      PRO  15 -11.161  -9.995  -5.778
  113    HG2  PRO  15           HG2      PRO  15 -12.618 -10.124  -3.534
  114    HG3  PRO  15           HG1      PRO  15 -11.028  -9.341  -3.572
  115    HD2  PRO  15           HD2      PRO  15 -13.750  -8.109  -3.569
  116    HD3  PRO  15           HD1      PRO  15 -12.272  -7.578  -2.743
  117    H    LYS  16           HN       LYS  16 -11.240  -8.039  -8.418
  118    HA   LYS  16           HA       LYS  16 -13.635  -6.840  -9.494
  119    HB2  LYS  16           HB2      LYS  16 -11.331  -8.303 -10.798
  120    HB3  LYS  16           HB1      LYS  16 -12.632  -7.541 -11.701
  121    HG2  LYS  16           HG2      LYS  16 -10.762  -6.118  -9.817
  122    HG3  LYS  16           HG1      LYS  16 -10.625  -6.140 -11.575
  123    HD2  LYS  16           HD2      LYS  16 -12.812  -5.054 -11.757
  124    HD3  LYS  16           HD1      LYS  16 -12.951  -5.037  -9.998
  125    HE2  LYS  16           HE2      LYS  16 -10.911  -3.649  -9.886
  126    HE3  LYS  16           HE1      LYS  16 -10.866  -3.614 -11.648
  127    HZ1  LYS  16           HZ1      LYS  16 -12.979  -2.481 -11.671
  128    HZ2  LYS  16           HZ2      LYS  16 -11.893  -1.623 -10.700
  129    HZ3  LYS  16           HZ3      LYS  16 -13.096  -2.572  -9.985
  130    H    LYS  17           HN       LYS  17 -12.410 -10.161  -9.162
  131    HA   LYS  17           HA       LYS  17 -14.953 -11.172 -10.342
  132    HB2  LYS  17           HB2      LYS  17 -12.494 -12.814  -9.748
  133    HB3  LYS  17           HB1      LYS  17 -13.834 -13.212 -10.813
  134    HG2  LYS  17           HG2      LYS  17 -11.803 -11.038 -11.292
  135    HG3  LYS  17           HG1      LYS  17 -11.815 -12.629 -12.055
  136    HD2  LYS  17           HD2      LYS  17 -13.905 -12.145 -13.149
  137    HD3  LYS  17           HD1      LYS  17 -14.051 -10.617 -12.277
  138    HE2  LYS  17           HE2      LYS  17 -12.078  -9.759 -13.399
  139    HE3  LYS  17           HE1      LYS  17 -11.847 -11.302 -14.219
  140    HZ1  LYS  17           HZ1      LYS  17 -14.192  -9.508 -14.561
  141    HZ2  LYS  17           HZ2      LYS  17 -13.937 -10.973 -15.370
  142    HZ3  LYS  17           HZ3      LYS  17 -12.907  -9.662 -15.651
  143    H    ALA  18           HN       ALA  18 -15.754 -13.272  -9.364
  144    HA   ALA  18           HA       ALA  18 -16.219 -12.810  -6.544
  145    HB1  ALA  18           HB1      ALA  18 -17.603 -14.820  -6.662
  146    HB2  ALA  18           HB2      ALA  18 -16.972 -15.167  -8.271
  147    HB3  ALA  18           HB3      ALA  18 -17.951 -13.725  -8.000
  148    H    SER  19           HN       SER  19 -14.134 -14.944  -8.435
  149    HA   SER  19           HA       SER  19 -13.468 -16.849  -6.485
  150    HB2  SER  19           HB2      SER  19 -11.683 -15.628  -8.606
  151    HB3  SER  19           HB1      SER  19 -11.345 -17.123  -7.733
  152    HG   SER  19           HG       SER  19 -13.040 -16.664  -9.836
  153    H    LEU  20           HN       LEU  20 -11.922 -13.679  -7.121
  154    HA   LEU  20           HA       LEU  20 -10.027 -13.946  -4.975
  155    HB2  LEU  20           HB2      LEU  20 -11.042 -11.573  -6.523
  156    HB3  LEU  20           HB1      LEU  20  -9.791 -11.450  -5.306
  157    HG   LEU  20           HG       LEU  20  -9.496 -13.291  -7.663
  158   HD11  LEU  20          HD11      LEU  20  -8.714 -10.382  -7.510
  159   HD12  LEU  20          HD12      LEU  20  -9.944 -11.078  -8.565
  160   HD13  LEU  20          HD13      LEU  20  -8.248 -11.506  -8.786
  161   HD21  LEU  20          HD21      LEU  20  -7.121 -13.022  -7.188
  162   HD22  LEU  20          HD22      LEU  20  -7.980 -13.603  -5.761
  163   HD23  LEU  20          HD23      LEU  20  -7.497 -11.909  -5.873
  164    H    GLN  21           HN       GLN  21  -9.929 -12.849  -2.978
  165    HA   GLN  21           HA       GLN  21 -12.629 -12.173  -1.898
  166    HB2  GLN  21           HB2      GLN  21 -10.492 -13.904  -0.913
  167    HB3  GLN  21           HB1      GLN  21 -11.028 -12.739   0.289
  168    HG2  GLN  21           HG2      GLN  21 -12.215 -14.881   0.439
  169    HG3  GLN  21           HG1      GLN  21 -13.293 -13.525   0.117
  170   HE21  GLN  21          HE21      GLN  21 -14.395 -13.383  -1.811
  171   HE22  GLN  21          HE22      GLN  21 -14.437 -14.746  -2.983
  172    HA   PRO  22           HA       PRO  22 -11.334  -8.018  -1.133
  173    HB2  PRO  22           HB2      PRO  22 -12.913  -8.295   1.376
  174    HB3  PRO  22           HB1      PRO  22 -13.033  -7.084   0.097
  175    HG2  PRO  22           HG2      PRO  22 -14.853  -9.002   0.285
  176    HG3  PRO  22           HG1      PRO  22 -14.249  -8.488  -1.302
  177    HD2  PRO  22           HD2      PRO  22 -13.550 -10.923   0.294
  178    HD3  PRO  22           HD1      PRO  22 -13.811 -10.758  -1.455
  179    H    LEU  23           HN       LEU  23 -10.356  -6.606   0.539
  180    HA   LEU  23           HA       LEU  23  -8.935  -8.061   2.686
  181    HB2  LEU  23           HB2      LEU  23  -7.514  -8.182   0.656
  182    HB3  LEU  23           HB1      LEU  23  -7.495  -6.434   0.595
  183    HG   LEU  23           HG       LEU  23  -6.368  -6.415   2.821
  184   HD11  LEU  23          HD11      LEU  23  -5.377  -8.481   3.649
  185   HD12  LEU  23          HD12      LEU  23  -6.181  -9.389   2.368
  186   HD13  LEU  23          HD13      LEU  23  -7.137  -8.591   3.616
  187   HD21  LEU  23          HD21      LEU  23  -4.953  -7.977   0.666
  188   HD22  LEU  23          HD22      LEU  23  -4.187  -7.076   1.974
  189   HD23  LEU  23          HD23      LEU  23  -5.105  -6.221   0.734
  190    H    THR  24           HN       THR  24  -7.882  -6.642   4.250
  191    HA   THR  24           HA       THR  24  -8.539  -3.772   4.065
  192    HB   THR  24           HB       THR  24  -9.614  -5.407   6.381
  193    HG1  THR  24           HG1      THR  24 -11.383  -5.593   5.242
  194   HG21  THR  24          HG21      THR  24  -8.972  -3.145   7.013
  195   HG22  THR  24          HG22      THR  24 -10.729  -3.291   6.988
  196   HG23  THR  24          HG23      THR  24  -9.893  -2.485   5.661
  197    H    ILE  25           HN       ILE  25  -6.288  -3.503   4.055
  198    HA   ILE  25           HA       ILE  25  -5.061  -3.924   6.742
  199    HB   ILE  25           HB       ILE  25  -4.229  -5.575   5.048
  200   HG12  ILE  25          HG12      ILE  25  -1.795  -5.141   5.547
  201   HG13  ILE  25          HG11      ILE  25  -2.277  -3.604   6.250
  202   HG21  ILE  25          HG21      ILE  25  -4.314  -4.021   3.114
  203   HG22  ILE  25          HG22      ILE  25  -2.781  -4.876   3.275
  204   HG23  ILE  25          HG23      ILE  25  -2.905  -3.189   3.773
  205   HD11  ILE  25          HD11      ILE  25  -1.937  -5.336   7.937
  206   HD12  ILE  25          HD12      ILE  25  -3.199  -6.311   7.184
  207   HD13  ILE  25          HD13      ILE  25  -3.602  -4.757   7.916
  208    H    SER  26           HN       SER  26  -3.395  -2.446   7.363
  209    HA   SER  26           HA       SER  26  -3.595   0.150   5.900
  210    HB2  SER  26           HB2      SER  26  -4.610   0.188   8.145
  211    HB3  SER  26           HB1      SER  26  -3.081  -0.340   8.844
  212    HG   SER  26           HG       SER  26  -2.455   1.652   8.815
  213    H    LEU  27           HN       LEU  27  -1.715   1.662   6.517
  214    HA   LEU  27           HA       LEU  27   0.686   0.723   5.380
  215    HB2  LEU  27           HB2      LEU  27   0.370   2.983   7.336
  216    HB3  LEU  27           HB1      LEU  27   1.681   2.768   6.193
  217    HG   LEU  27           HG       LEU  27  -1.199   3.385   5.535
  218   HD11  LEU  27          HD11      LEU  27   0.042   5.292   6.374
  219   HD12  LEU  27          HD12      LEU  27  -0.265   5.469   4.647
  220   HD13  LEU  27          HD13      LEU  27   1.333   4.987   5.213
  221   HD21  LEU  27          HD21      LEU  27  -0.266   1.870   3.870
  222   HD22  LEU  27          HD22      LEU  27   1.132   2.929   3.675
  223   HD23  LEU  27          HD23      LEU  27  -0.473   3.489   3.205
  224    H    ASP  28           HN       ASP  28   0.247   1.603   8.819
  225    HA   ASP  28           HA       ASP  28   2.722   0.472   9.660
  226    HB2  ASP  28           HB2      ASP  28   1.439   2.174  10.921
  227    HB3  ASP  28           HB1      ASP  28   0.223   0.958  11.295
  228    H    GLU  29           HN       GLU  29  -0.550  -0.859   9.410
  229    HA   GLU  29           HA       GLU  29   0.076  -3.271  10.869
  230    HB2  GLU  29           HB2      GLU  29  -2.213  -2.168  10.474
  231    HB3  GLU  29           HB1      GLU  29  -2.177  -2.950   8.902
  232    HG2  GLU  29           HG2      GLU  29  -3.445  -4.288  10.430
  233    HG3  GLU  29           HG1      GLU  29  -1.952  -5.132  10.021
  234    H    LEU  30           HN       LEU  30   0.887  -2.237   7.697
  235    HA   LEU  30           HA       LEU  30   1.242  -5.093   6.929
  236    HB2  LEU  30           HB2      LEU  30  -0.453  -3.793   5.601
  237    HB3  LEU  30           HB1      LEU  30   0.857  -2.786   5.025
  238    HG   LEU  30           HG       LEU  30   1.891  -4.715   3.932
  239   HD11  LEU  30          HD11      LEU  30  -0.421  -6.212   5.137
  240   HD12  LEU  30          HD12      LEU  30   1.302  -6.530   5.328
  241   HD13  LEU  30          HD13      LEU  30   0.517  -6.825   3.778
  242   HD21  LEU  30          HD21      LEU  30   0.242  -3.356   2.721
  243   HD22  LEU  30          HD22      LEU  30  -1.030  -4.458   3.245
  244   HD23  LEU  30          HD23      LEU  30   0.251  -5.035   2.182
  245    H    PHE  31           HN       PHE  31   3.050  -2.767   8.151
  246    HA   PHE  31           HA       PHE  31   5.292  -3.587   6.428
  247    HB2  PHE  31           HB2      PHE  31   4.953  -0.752   7.445
  248    HB3  PHE  31           HB1      PHE  31   6.359  -1.342   6.567
  249    HD1  PHE  31           HD1      PHE  31   5.298  -2.827   4.359
  250    HD2  PHE  31           HD2      PHE  31   3.814   0.742   6.137
  251    HE1  PHE  31           HE1      PHE  31   4.217  -2.221   2.235
  252    HE2  PHE  31           HE2      PHE  31   2.727   1.351   4.016
  253    HZ   PHE  31           HZ       PHE  31   2.927  -0.133   2.063
  254    H    SER  32           HN       SER  32   7.236  -4.062   7.416
  255    HA   SER  32           HA       SER  32   7.307  -3.673  10.362
  256    HB2  SER  32           HB2      SER  32   7.997  -6.196   8.861
  257    HB3  SER  32           HB1      SER  32   8.255  -5.946  10.588
  258    HG   SER  32           HG       SER  32   6.161  -6.959   9.623
  259    H    SER  33           HN       SER  33   8.607  -2.157   8.180
  260    HA   SER  33           HA       SER  33  11.300  -2.181   9.212
  261    HB2  SER  33           HB2      SER  33  11.596  -4.091   7.757
  262    HB3  SER  33           HB1      SER  33  10.860  -3.228   6.409
  263    HG   SER  33           HG       SER  33  13.359  -2.761   7.647
  264    H    ARG  34           HN       ARG  34  12.197  -0.215   9.045
  265    HA   ARG  34           HA       ARG  34  10.677   1.905   7.879
  266    HB2  ARG  34           HB2      ARG  34  12.669   3.310   8.366
  267    HB3  ARG  34           HB1      ARG  34  12.135   2.356   9.741
  268    HG2  ARG  34           HG2      ARG  34  13.924   0.722   9.256
  269    HG3  ARG  34           HG1      ARG  34  14.486   1.769   7.951
  270    HD2  ARG  34           HD2      ARG  34  15.002   3.523   9.494
  271    HD3  ARG  34           HD1      ARG  34  14.232   2.653  10.819
  272    HE   ARG  34           HE       ARG  34  16.381   1.131   9.633
  273   HH11  ARG  34          HH11      ARG  34  15.661   3.763  11.890
  274   HH12  ARG  34          HH12      ARG  34  17.108   3.530  12.811
  275   HH21  ARG  34          HH21      ARG  34  18.273   0.858  10.875
  276   HH22  ARG  34          HH22      ARG  34  18.590   1.880  12.236
  277    H    GLY  35           HN       GLY  35  13.546   0.100   6.769
  278    HA2  GLY  35           HA2      GLY  35  13.964   1.697   4.417
  279    HA3  GLY  35           HA1      GLY  35  14.561   0.066   4.684
  280    H    GLU  36           HN       GLU  36  11.986  -1.169   5.111
  281    HA   GLU  36           HA       GLU  36  11.299  -1.807   2.439
  282    HB2  GLU  36           HB2      GLU  36  10.776  -3.304   4.281
  283    HB3  GLU  36           HB1      GLU  36   9.699  -2.111   4.991
  284    HG2  GLU  36           HG2      GLU  36   8.398  -3.805   3.916
  285    HG3  GLU  36           HG1      GLU  36   8.236  -2.301   3.013
  286    H    PHE  37           HN       PHE  37   9.884   0.490   4.762
  287    HA   PHE  37           HA       PHE  37   7.654   1.291   3.227
  288    HB2  PHE  37           HB2      PHE  37   8.258   1.907   5.640
  289    HB3  PHE  37           HB1      PHE  37   9.277   3.164   4.950
  290    HD1  PHE  37           HD2      PHE  37   5.811   1.990   5.336
  291    HD2  PHE  37           HD1      PHE  37   8.343   5.166   4.071
  292    HE1  PHE  37           HE2      PHE  37   3.865   3.489   5.219
  293    HE2  PHE  37           HE1      PHE  37   6.401   6.673   3.955
  294    HZ   PHE  37           HZ       PHE  37   4.159   5.834   4.528
  295    H    ILE  38           HN       ILE  38  11.012   2.533   3.276
  296    HA   ILE  38           HA       ILE  38  10.727   4.593   1.410
  297    HB   ILE  38           HB       ILE  38  13.078   2.733   1.799
  298   HG12  ILE  38          HG12      ILE  38  12.486   3.893   3.843
  299   HG13  ILE  38          HG11      ILE  38  13.954   4.604   3.183
  300   HG21  ILE  38          HG21      ILE  38  12.922   5.398   0.398
  301   HG22  ILE  38          HG22      ILE  38  13.304   3.837  -0.329
  302   HG23  ILE  38          HG23      ILE  38  14.420   4.570   0.822
  303   HD11  ILE  38          HD11      ILE  38  12.642   6.458   2.280
  304   HD12  ILE  38          HD12      ILE  38  12.457   6.311   4.027
  305   HD13  ILE  38          HD13      ILE  38  11.176   5.745   2.954
  306    H    SER  39           HN       SER  39  11.560   1.135   0.760
  307    HA   SER  39           HA       SER  39  11.738   1.452  -2.057
  308    HB2  SER  39           HB2      SER  39  10.880  -1.022  -0.489
  309    HB3  SER  39           HB1      SER  39  11.410  -1.012  -2.170
  310    HG   SER  39           HG       SER  39  12.884  -0.816   0.155
  311    H    VAL  40           HN       VAL  40   9.000  -0.122  -0.266
  312    HA   VAL  40           HA       VAL  40   7.173  -0.415  -2.177
  313    HB   VAL  40           HB       VAL  40   5.352   0.089  -0.582
  314   HG11  VAL  40          HG11      VAL  40   5.946  -1.634   1.018
  315   HG12  VAL  40          HG12      VAL  40   7.650  -1.464   0.600
  316   HG13  VAL  40          HG13      VAL  40   6.507  -2.076  -0.594
  317   HG21  VAL  40          HG21      VAL  40   5.861   0.803   1.673
  318   HG22  VAL  40          HG22      VAL  40   6.400   2.026   0.522
  319   HG23  VAL  40          HG23      VAL  40   7.570   0.941   1.270
  320    H    GLY  41           HN       GLY  41   7.958   2.881  -0.908
  321    HA2  GLY  41           HA2      GLY  41   7.638   4.517  -2.817
  322    HA3  GLY  41           HA1      GLY  41   5.993   3.902  -2.899
  323    H    GLY  42           HN       GLY  42   8.084   4.682  -0.090
  324    HA2  GLY  42           HA2      GLY  42   5.876   6.462   0.842
  325    HA3  GLY  42           HA1      GLY  42   6.958   5.577   1.894
  326    H    ASP  43           HN       ASP  43   6.323   8.486   0.271
  327    HA   ASP  43           HA       ASP  43   9.045   9.512   0.832
  328    HB2  ASP  43           HB2      ASP  43   6.705  10.688  -0.677
  329    HB3  ASP  43           HB1      ASP  43   8.188  11.582  -0.351
  330    H    GLY  44           HN       GLY  44   6.036  11.428   0.998
  331    HA2  GLY  44           HA2      GLY  44   6.214  11.501   3.947
  332    HA3  GLY  44           HA1      GLY  44   6.561  13.003   3.110
  333    H    ARG  45           HN       ARG  45   4.860  13.757   1.532
  334    HA   ARG  45           HA       ARG  45   2.267  13.518   2.905
  335    HB2  ARG  45           HB2      ARG  45   3.264  15.351   0.722
  336    HB3  ARG  45           HB1      ARG  45   1.611  15.368   1.318
  337    HG2  ARG  45           HG2      ARG  45   2.852  17.122   2.384
  338    HG3  ARG  45           HG1      ARG  45   2.467  15.880   3.576
  339    HD2  ARG  45           HD2      ARG  45   4.666  15.081   3.627
  340    HD3  ARG  45           HD1      ARG  45   5.088  15.889   2.120
  341    HE   ARG  45           HE       ARG  45   4.342  17.827   4.083
  342   HH11  ARG  45          HH11      ARG  45   6.961  15.587   3.270
  343   HH12  ARG  45          HH12      ARG  45   8.179  16.542   4.041
  344   HH21  ARG  45          HH21      ARG  45   5.978  19.055   5.086
  345   HH22  ARG  45          HH22      ARG  45   7.623  18.512   5.074
  346    H    MET  46           HN       MET  46   1.303  11.640   2.384
  347    HA   MET  46           HA       MET  46   1.314  10.660  -0.358
  348    HB2  MET  46           HB2      MET  46   1.041   9.463   2.063
  349    HB3  MET  46           HB1      MET  46  -0.638   9.533   1.545
  350    HG2  MET  46           HG2      MET  46   0.033   7.496   0.731
  351    HG3  MET  46           HG1      MET  46   0.263   8.539  -0.667
  352    HE1  MET  46           HE1      MET  46   3.245   6.052  -1.038
  353    HE2  MET  46           HE2      MET  46   1.793   6.720  -1.777
  354    HE3  MET  46           HE3      MET  46   1.659   5.647  -0.387
  355    H    SER  47           HN       SER  47  -0.818   9.917  -1.359
  356    HA   SER  47           HA       SER  47  -2.534  12.311  -1.494
  357    HB2  SER  47           HB2      SER  47  -1.672  11.272  -3.577
  358    HB3  SER  47           HB1      SER  47  -2.571   9.806  -3.196
  359    HG   SER  47           HG       SER  47  -4.262  10.717  -4.018
  360    H    HIS  48           HN       HIS  48  -3.187   8.792  -1.578
  361    HA   HIS  48           HA       HIS  48  -4.955   8.532   0.583
  362    HB2  HIS  48           HB2      HIS  48  -6.395  10.227  -0.348
  363    HB3  HIS  48           HB1      HIS  48  -6.319   9.475  -1.936
  364    HD1  HIS  48           HD1      HIS  48  -7.832   9.030   1.504
  365    HD2  HIS  48           HD2      HIS  48  -8.118   7.409  -2.352
  366    HE1  HIS  48           HE1      HIS  48  -9.866   7.515   1.512
  367    HE2  HIS  48           HE2      HIS  48  -9.997   6.475  -0.804
  368    H    LYS  49           HN       LYS  49  -5.019   7.839  -2.947
  369    HA   LYS  49           HA       LYS  49  -5.562   5.013  -2.419
  370    HB2  LYS  49           HB2      LYS  49  -5.101   6.725  -4.844
  371    HB3  LYS  49           HB1      LYS  49  -5.054   4.976  -4.977
  372    HG2  LYS  49           HG2      LYS  49  -7.383   6.546  -3.895
  373    HG3  LYS  49           HG1      LYS  49  -7.247   5.955  -5.551
  374    HD2  LYS  49           HD2      LYS  49  -7.118   3.653  -4.710
  375    HD3  LYS  49           HD1      LYS  49  -7.276   4.253  -3.058
  376    HE2  LYS  49           HE2      LYS  49  -9.420   3.466  -3.801
  377    HE3  LYS  49           HE1      LYS  49  -9.475   5.223  -3.675
  378    HZ1  LYS  49           HZ1      LYS  49  -9.057   3.722  -6.206
  379    HZ2  LYS  49           HZ2      LYS  49  -9.233   5.397  -6.049
  380    HZ3  LYS  49           HZ3      LYS  49 -10.535   4.375  -5.704
  381    H    GLU  50           HN       GLU  50  -2.786   7.088  -2.959
  382    HA   GLU  50           HA       GLU  50  -0.953   5.106  -3.870
  383    HB2  GLU  50           HB2      GLU  50  -0.526   7.726  -2.433
  384    HB3  GLU  50           HB1      GLU  50   0.766   6.766  -3.129
  385    HG2  GLU  50           HG2      GLU  50  -0.367   6.977  -5.341
  386    HG3  GLU  50           HG1      GLU  50  -1.494   8.104  -4.586
  387    H    ALA  51           HN       ALA  51  -1.567   6.437  -0.578
  388    HA   ALA  51           HA       ALA  51   0.457   5.052   0.768
  389    HB1  ALA  51           HB1      ALA  51  -1.105   6.792   1.729
  390    HB2  ALA  51           HB2      ALA  51  -0.751   5.428   2.786
  391    HB3  ALA  51           HB3      ALA  51  -2.290   5.502   1.928
  392    H    ILE  52           HN       ILE  52  -2.960   3.899   0.448
  393    HA   ILE  52           HA       ILE  52  -2.377   1.430   1.677
  394    HB   ILE  52           HB       ILE  52  -4.483   1.980  -0.448
  395   HG12  ILE  52          HG12      ILE  52  -4.611   3.452   1.544
  396   HG13  ILE  52          HG11      ILE  52  -5.995   2.384   1.405
  397   HG21  ILE  52          HG21      ILE  52  -5.675   0.056   0.514
  398   HG22  ILE  52          HG22      ILE  52  -4.284  -0.270   1.548
  399   HG23  ILE  52          HG23      ILE  52  -4.130  -0.398  -0.204
  400   HD11  ILE  52          HD11      ILE  52  -3.646   2.022   3.247
  401   HD12  ILE  52          HD12      ILE  52  -5.006   0.910   3.097
  402   HD13  ILE  52          HD13      ILE  52  -5.268   2.545   3.701
  403    H    LEU  53           HN       LEU  53  -2.313   2.364  -1.781
  404    HA   LEU  53           HA       LEU  53  -1.968  -0.193  -2.864
  405    HB2  LEU  53           HB2      LEU  53  -2.304   1.958  -4.122
  406    HB3  LEU  53           HB1      LEU  53  -0.634   2.403  -3.847
  407    HG   LEU  53           HG       LEU  53   0.051   0.370  -5.137
  408   HD11  LEU  53          HD11      LEU  53  -1.948  -0.964  -4.873
  409   HD12  LEU  53          HD12      LEU  53  -1.644  -0.670  -6.586
  410   HD13  LEU  53          HD13      LEU  53  -2.898   0.239  -5.744
  411   HD21  LEU  53          HD21      LEU  53   0.192   2.379  -6.314
  412   HD22  LEU  53          HD22      LEU  53  -1.558   2.577  -6.373
  413   HD23  LEU  53          HD23      LEU  53  -0.776   1.346  -7.364
  414    H    LEU  54           HN       LEU  54   0.478   1.731  -1.104
  415    HA   LEU  54           HA       LEU  54   2.853   0.565  -2.093
  416    HB2  LEU  54           HB2      LEU  54   1.940   1.789   0.487
  417    HB3  LEU  54           HB1      LEU  54   3.342   0.754   0.623
  418    HG   LEU  54           HG       LEU  54   4.535   2.102  -1.023
  419   HD11  LEU  54          HD11      LEU  54   2.644   2.812  -2.384
  420   HD12  LEU  54          HD12      LEU  54   3.583   4.201  -1.836
  421   HD13  LEU  54          HD13      LEU  54   2.052   3.808  -1.055
  422   HD21  LEU  54          HD21      LEU  54   3.291   3.758   1.169
  423   HD22  LEU  54          HD22      LEU  54   4.794   4.118   0.322
  424   HD23  LEU  54          HD23      LEU  54   4.682   2.688   1.345
  425    H    GLY  55           HN       GLY  55   0.310  -0.893  -0.050
  426    HA2  GLY  55           HA2      GLY  55   1.683  -2.981   1.199
  427    HA3  GLY  55           HA1      GLY  55   0.034  -3.093   0.614
  428    H    LEU  56           HN       LEU  56   0.361  -2.965  -2.126
  429    HA   LEU  56           HA       LEU  56   0.887  -5.593  -2.848
  430    HB2  LEU  56           HB2      LEU  56   1.420  -3.254  -4.663
  431    HB3  LEU  56           HB1      LEU  56   0.956  -4.882  -5.125
  432    HG   LEU  56           HG       LEU  56  -0.767  -2.807  -3.772
  433   HD11  LEU  56          HD11      LEU  56  -0.631  -2.430  -6.110
  434   HD12  LEU  56          HD12      LEU  56  -2.180  -3.215  -5.800
  435   HD13  LEU  56          HD13      LEU  56  -0.836  -4.145  -6.464
  436   HD21  LEU  56          HD21      LEU  56  -1.350  -4.847  -2.721
  437   HD22  LEU  56          HD22      LEU  56  -1.268  -5.735  -4.242
  438   HD23  LEU  56          HD23      LEU  56  -2.561  -4.566  -3.973
  439    H    ARG  57           HN       ARG  57   3.190  -2.862  -2.866
  440    HA   ARG  57           HA       ARG  57   5.348  -4.335  -4.017
  441    HB2  ARG  57           HB2      ARG  57   5.411  -1.940  -2.174
  442    HB3  ARG  57           HB1      ARG  57   6.784  -2.535  -3.094
  443    HG2  ARG  57           HG2      ARG  57   4.223  -1.414  -4.211
  444    HG3  ARG  57           HG1      ARG  57   5.806  -0.637  -4.206
  445    HD2  ARG  57           HD2      ARG  57   5.077  -3.180  -5.654
  446    HD3  ARG  57           HD1      ARG  57   5.301  -1.595  -6.391
  447    HE   ARG  57           HE       ARG  57   7.691  -1.917  -5.213
  448   HH11  ARG  57          HH11      ARG  57   5.771  -4.178  -7.152
  449   HH12  ARG  57          HH12      ARG  57   7.156  -5.013  -7.764
  450   HH21  ARG  57          HH21      ARG  57   9.483  -3.047  -6.043
  451   HH22  ARG  57          HH22      ARG  57   9.262  -4.373  -7.136
  452    H    TYR  58           HN       TYR  58   4.186  -3.999  -0.704
  453    HA   TYR  58           HA       TYR  58   6.477  -5.142   0.580
  454    HB2  TYR  58           HB2      TYR  58   4.711  -3.825   1.730
  455    HB3  TYR  58           HB1      TYR  58   3.588  -5.152   1.483
  456    HD1  TYR  58           HD2      TYR  58   6.633  -4.101   3.273
  457    HD2  TYR  58           HD1      TYR  58   3.620  -7.076   2.894
  458    HE1  TYR  58           HE2      TYR  58   7.367  -5.105   5.393
  459    HE2  TYR  58           HE1      TYR  58   4.343  -8.089   5.013
  460    HH   TYR  58           HH       TYR  58   6.333  -6.549   7.205
  461    H    LYS  59           HN       LYS  59   3.398  -6.508  -0.567
  462    HA   LYS  59           HA       LYS  59   4.140  -9.220   0.194
  463    HB2  LYS  59           HB2      LYS  59   1.814  -8.127  -1.371
  464    HB3  LYS  59           HB1      LYS  59   1.989  -9.806  -0.882
  465    HG2  LYS  59           HG2      LYS  59   1.842  -7.467   1.006
  466    HG3  LYS  59           HG1      LYS  59   0.494  -8.527   0.594
  467    HD2  LYS  59           HD2      LYS  59   1.632 -10.425   1.552
  468    HD3  LYS  59           HD1      LYS  59   3.084  -9.462   1.831
  469    HE2  LYS  59           HE2      LYS  59   1.788  -8.027   3.369
  470    HE3  LYS  59           HE1      LYS  59   0.392  -9.080   3.138
  471    HZ1  LYS  59           HZ1      LYS  59   1.701 -10.917   4.041
  472    HZ2  LYS  59           HZ2      LYS  59   1.566  -9.651   5.153
  473    HZ3  LYS  59           HZ3      LYS  59   3.009  -9.874   4.300
  474    H    LYS  60           HN       LYS  60   4.888  -7.236  -2.450
  475    HA   LYS  60           HA       LYS  60   5.883  -7.670  -4.453
  476    HB2  LYS  60           HB2      LYS  60   6.185 -10.497  -3.419
  477    HB3  LYS  60           HB1      LYS  60   7.004  -9.834  -4.824
  478    HG2  LYS  60           HG2      LYS  60   7.356  -8.971  -1.961
  479    HG3  LYS  60           HG1      LYS  60   8.507  -9.874  -2.945
  480    HD2  LYS  60           HD2      LYS  60   7.567  -7.048  -3.439
  481    HD3  LYS  60           HD1      LYS  60   9.141  -7.524  -2.802
  482    HE2  LYS  60           HE2      LYS  60   9.670  -8.654  -4.884
  483    HE3  LYS  60           HE1      LYS  60   8.068  -8.283  -5.519
  484    HZ1  LYS  60           HZ1      LYS  60  10.130  -6.275  -4.784
  485    HZ2  LYS  60           HZ2      LYS  60   8.601  -5.937  -5.426
  486    HZ3  LYS  60           HZ3      LYS  60   9.747  -6.758  -6.360
  487    H    LEU  61           HN       LEU  61   3.586  -7.253  -5.081
  488    HA   LEU  61           HA       LEU  61   2.891  -9.121  -7.142
  489    HB2  LEU  61           HB2      LEU  61   0.504  -9.503  -6.194
  490    HB3  LEU  61           HB1      LEU  61   1.822 -10.515  -5.646
  491    HG   LEU  61           HG       LEU  61   2.018  -9.138  -3.602
  492   HD11  LEU  61          HD11      LEU  61   0.273  -7.534  -3.045
  493   HD12  LEU  61          HD12      LEU  61  -0.446  -7.750  -4.640
  494   HD13  LEU  61          HD13      LEU  61   1.158  -7.035  -4.487
  495   HD21  LEU  61          HD21      LEU  61  -0.748 -10.224  -4.111
  496   HD22  LEU  61          HD22      LEU  61  -0.022  -9.933  -2.530
  497   HD23  LEU  61          HD23      LEU  61   0.655 -11.162  -3.599
  498    H    TYR  62           HN       TYR  62   3.406  -6.245  -6.764
  499    HA   TYR  62           HA       TYR  62   1.006  -4.753  -6.976
  500    HB2  TYR  62           HB2      TYR  62   3.159  -3.718  -6.511
  501    HB3  TYR  62           HB1      TYR  62   3.758  -4.188  -8.098
  502    HD1  TYR  62           HD1      TYR  62   1.340  -2.008  -6.346
  503    HD2  TYR  62           HD2      TYR  62   3.323  -2.857 -10.012
  504    HE1  TYR  62           HE1      TYR  62   0.533   0.117  -7.271
  505    HE2  TYR  62           HE2      TYR  62   2.520  -0.730 -10.946
  506    HH   TYR  62           HH       TYR  62   1.194   1.726  -9.061
  507    H    ASN  63           HN       ASN  63   2.780  -6.631  -9.350
  508    HA   ASN  63           HA       ASN  63   1.856  -5.479 -11.723
  509    HB2  ASN  63           HB2      ASN  63   2.094  -7.899 -12.637
  510    HB3  ASN  63           HB1      ASN  63   3.513  -7.061 -12.026
  511   HD21  ASN  63          HD21      ASN  63   4.635  -8.944 -11.630
  512   HD22  ASN  63          HD22      ASN  63   4.190 -10.039 -10.276
  513    H    GLN  64           HN       GLN  64   0.350  -8.390 -10.173
  514    HA   GLN  64           HA       GLN  64  -2.016  -7.860 -11.852
  515    HB2  GLN  64           HB2      GLN  64  -0.962 -10.238 -10.416
  516    HB3  GLN  64           HB1      GLN  64  -2.700 -10.134 -10.654
  517    HG2  GLN  64           HG2      GLN  64  -1.680 -11.418 -12.424
  518    HG3  GLN  64           HG1      GLN  64  -2.356  -9.921 -13.064
  519   HE21  GLN  64          HE21      GLN  64  -1.009  -8.299 -13.832
  520   HE22  GLN  64          HE22      GLN  64   0.729  -8.611 -14.170
  521    H    ALA  65           HN       ALA  65  -1.029  -7.117  -8.651
  522    HA   ALA  65           HA       ALA  65  -3.584  -7.590  -7.396
  523    HB1  ALA  65           HB1      ALA  65  -1.621  -7.487  -6.034
  524    HB2  ALA  65           HB2      ALA  65  -2.679  -6.149  -5.588
  525    HB3  ALA  65           HB3      ALA  65  -1.260  -5.856  -6.593
  526    H    ARG  66           HN       ARG  66  -2.078  -4.850  -9.058
  527    HA   ARG  66           HA       ARG  66  -4.007  -2.890  -8.316
  528    HB2  ARG  66           HB2      ARG  66  -1.809  -2.369  -9.295
  529    HB3  ARG  66           HB1      ARG  66  -2.330  -3.059 -10.825
  530    HG2  ARG  66           HG2      ARG  66  -3.997  -1.334 -11.085
  531    HG3  ARG  66           HG1      ARG  66  -3.611  -0.681  -9.492
  532    HD2  ARG  66           HD2      ARG  66  -2.571   0.641 -11.255
  533    HD3  ARG  66           HD1      ARG  66  -1.355  -0.143 -10.250
  534    HE   ARG  66           HE       ARG  66  -1.938  -1.795 -12.504
  535   HH11  ARG  66          HH11      ARG  66  -0.321   1.242 -11.664
  536   HH12  ARG  66          HH12      ARG  66   0.803   1.145 -12.977
  537   HH21  ARG  66          HH21      ARG  66  -0.437  -1.883 -14.216
  538   HH22  ARG  66          HH22      ARG  66   0.738  -0.627 -14.426
  539    H    VAL  67           HN       VAL  67  -3.993  -5.356 -10.852
  540    HA   VAL  67           HA       VAL  67  -6.441  -4.213 -12.042
  541    HB   VAL  67           HB       VAL  67  -4.648  -5.075 -13.517
  542   HG11  VAL  67          HG11      VAL  67  -4.327  -7.483 -13.770
  543   HG12  VAL  67          HG12      VAL  67  -5.421  -7.776 -12.418
  544   HG13  VAL  67          HG13      VAL  67  -3.889  -6.944 -12.149
  545   HG21  VAL  67          HG21      VAL  67  -6.109  -6.295 -15.040
  546   HG22  VAL  67          HG22      VAL  67  -6.960  -4.938 -14.306
  547   HG23  VAL  67          HG23      VAL  67  -7.256  -6.578 -13.731
  548    H    LYS  68           HN       LYS  68  -5.400  -7.019 -10.130
  549    HA   LYS  68           HA       LYS  68  -7.788  -8.540 -10.369
  550    HB2  LYS  68           HB2      LYS  68  -5.620  -8.391  -8.301
  551    HB3  LYS  68           HB1      LYS  68  -7.039  -9.389  -8.021
  552    HG2  LYS  68           HG2      LYS  68  -6.566 -10.684 -10.007
  553    HG3  LYS  68           HG1      LYS  68  -5.195  -9.640 -10.389
  554    HD2  LYS  68           HD2      LYS  68  -4.080 -10.325  -8.335
  555    HD3  LYS  68           HD1      LYS  68  -5.465 -11.329  -7.903
  556    HE2  LYS  68           HE2      LYS  68  -5.091 -12.714  -9.872
  557    HE3  LYS  68           HE1      LYS  68  -3.735 -11.693 -10.348
  558    HZ1  LYS  68           HZ1      LYS  68  -2.601 -12.328  -8.300
  559    HZ2  LYS  68           HZ2      LYS  68  -2.963 -13.684  -9.243
  560    HZ3  LYS  68           HZ3      LYS  68  -3.896 -13.333  -7.876
  561    H    TYR  69           HN       TYR  69  -6.841  -6.009  -8.051
  562    HA   TYR  69           HA       TYR  69  -9.645  -6.038  -7.032
  563    HB2  TYR  69           HB2      TYR  69  -7.090  -5.093  -5.718
  564    HB3  TYR  69           HB1      TYR  69  -8.695  -4.893  -5.025
  565    HD1  TYR  69           HD1      TYR  69  -6.293  -7.482  -6.196
  566    HD2  TYR  69           HD2      TYR  69  -9.628  -6.588  -3.711
  567    HE1  TYR  69           HE1      TYR  69  -6.108  -9.704  -5.161
  568    HE2  TYR  69           HE2      TYR  69  -9.453  -8.804  -2.669
  569    HH   TYR  69           HH       TYR  69  -8.527 -11.067  -3.286
  570    H    SER  70           HN       SER  70 -10.645  -3.995  -6.508
  571    HA   SER  70           HA       SER  70 -10.107  -2.019  -8.572
  572    HB2  SER  70           HB2      SER  70 -12.408  -2.603  -7.817
  573    HB3  SER  70           HB1      SER  70 -12.052  -1.868  -6.255
  574    HG   SER  70           HG       SER  70 -12.750  -0.690  -8.601
  575    H    LEU  71           HN       LEU  71  -7.950  -1.398  -8.033
  576    HA   LEU  71           HA       LEU  71  -7.786   0.354  -5.623
  577    HB2  LEU  71           HB2      LEU  71  -5.702  -1.180  -7.161
  578    HB3  LEU  71           HB1      LEU  71  -5.259   0.146  -6.104
  579    HG   LEU  71           HG       LEU  71  -6.252  -1.045  -4.192
  580   HD11  LEU  71          HD11      LEU  71  -6.865  -3.117  -6.278
  581   HD12  LEU  71          HD12      LEU  71  -7.970  -2.339  -5.145
  582   HD13  LEU  71          HD13      LEU  71  -6.775  -3.493  -4.558
  583   HD21  LEU  71          HD21      LEU  71  -3.897  -1.342  -4.620
  584   HD22  LEU  71          HD22      LEU  71  -4.234  -2.623  -5.784
  585   HD23  LEU  71          HD23      LEU  71  -4.589  -2.869  -4.074
  586    H    LEU  72           HN       LEU  72  -6.201   0.136  -8.834
  587    HA   LEU  72           HA       LEU  72  -6.723   3.058  -9.148
  588    HB2  LEU  72           HB2      LEU  72  -4.293   1.440  -9.907
  589    HB3  LEU  72           HB1      LEU  72  -4.612   3.027 -10.574
  590    HG   LEU  72           HG       LEU  72  -3.029   3.274  -8.803
  591   HD11  LEU  72          HD11      LEU  72  -4.181   4.801  -7.305
  592   HD12  LEU  72          HD12      LEU  72  -5.739   4.148  -7.815
  593   HD13  LEU  72          HD13      LEU  72  -4.727   5.020  -8.968
  594   HD21  LEU  72          HD21      LEU  72  -3.588   1.139  -7.650
  595   HD22  LEU  72          HD22      LEU  72  -4.986   1.945  -6.938
  596   HD23  LEU  72          HD23      LEU  72  -3.360   2.508  -6.563
  597    H    GLU  73           HN       GLU  73  -8.539   1.071  -9.943
  598    HA   GLU  73           HA       GLU  73  -8.126   0.821 -12.868
  599    HB2  GLU  73           HB2      GLU  73 -10.272  -0.386 -11.109
  600    HB3  GLU  73           HB1      GLU  73  -9.994  -0.754 -12.805
  601    HG2  GLU  73           HG2      GLU  73  -8.091  -1.319 -10.540
  602    HG3  GLU  73           HG1      GLU  73  -9.119  -2.499 -11.352
  Start of MODEL   15
    1    H1   SER   1           HT1      SER   1  -0.333  16.558   6.771
    2    H2   SER   1           HT2      SER   1   0.665  16.341   8.118
    3    H3   SER   1           HT3      SER   1  -0.994  16.590   8.329
    4    HA   SER   1           HA       SER   1  -0.428  14.276   8.658
    5    HB2  SER   1           HB2      SER   1  -2.645  14.841   7.750
    6    HB3  SER   1           HB1      SER   1  -1.995  14.788   6.113
    7    HG   SER   1           HG       SER   1  -2.451  12.745   6.175
    8    H    ASP   2           HN       ASP   2   1.282  13.013   8.404
    9    HA   ASP   2           HA       ASP   2   2.526  12.906   5.694
   10    HB2  ASP   2           HB2      ASP   2   3.884  13.614   7.746
   11    HB3  ASP   2           HB1      ASP   2   3.762  11.942   8.281
   12    H    VAL   3           HN       VAL   3   3.257  10.891   4.848
   13    HA   VAL   3           HA       VAL   3   1.329   8.818   5.038
   14    HB   VAL   3           HB       VAL   3   2.819   9.227   3.085
   15   HG11  VAL   3          HG11      VAL   3   4.918   7.792   4.702
   16   HG12  VAL   3          HG12      VAL   3   4.912   9.522   4.369
   17   HG13  VAL   3          HG13      VAL   3   5.068   8.370   3.042
   18   HG21  VAL   3          HG21      VAL   3   1.558   7.165   3.224
   19   HG22  VAL   3          HG22      VAL   3   2.827   6.423   4.197
   20   HG23  VAL   3          HG23      VAL   3   3.142   6.850   2.516
   21    H    TRP   4           HN       TRP   4   4.465   9.256   6.654
   22    HA   TRP   4           HA       TRP   4   4.388   6.586   7.804
   23    HB2  TRP   4           HB2      TRP   4   6.355   8.547   7.416
   24    HB3  TRP   4           HB1      TRP   4   6.182   8.406   9.162
   25    HD1  TRP   4           HD1      TRP   4   5.894   5.391   9.645
   26    HE1  TRP   4           HE1      TRP   4   7.781   3.702   9.075
   27    HE3  TRP   4           HE3      TRP   4   8.408   8.213   6.203
   28    HZ2  TRP   4           HZ2      TRP   4  10.033   3.646   7.364
   29    HZ3  TRP   4           HZ3      TRP   4  10.419   7.270   5.148
   30    HH2  TRP   4           HH2      TRP   4  11.214   5.033   5.718
   31    H    SER   5           HN       SER   5   3.752   9.917   8.908
   32    HA   SER   5           HA       SER   5   3.299   9.299  11.636
   33    HB2  SER   5           HB2      SER   5   2.096  11.454   9.880
   34    HB3  SER   5           HB1      SER   5   1.905  11.395  11.631
   35    HG   SER   5           HG       SER   5   4.309  11.697  10.158
   36    H    LEU   6           HN       LEU   6   0.935   9.640   8.954
   37    HA   LEU   6           HA       LEU   6  -1.113   8.332  10.636
   38    HB2  LEU   6           HB2      LEU   6  -1.192   9.702   7.953
   39    HB3  LEU   6           HB1      LEU   6  -2.555   8.790   8.566
   40    HG   LEU   6           HG       LEU   6  -2.884  11.157   8.961
   41   HD11  LEU   6          HD11      LEU   6  -2.253   9.767  11.559
   42   HD12  LEU   6          HD12      LEU   6  -3.725   9.532  10.618
   43   HD13  LEU   6          HD13      LEU   6  -3.369  11.111  11.317
   44   HD21  LEU   6          HD21      LEU   6  -0.530  11.836   9.010
   45   HD22  LEU   6          HD22      LEU   6  -0.342  11.059  10.581
   46   HD23  LEU   6          HD23      LEU   6  -1.416  12.445  10.406
   47    H    SER   7           HN       SER   7  -0.254   6.236  10.759
   48    HA   SER   7           HA       SER   7  -0.397   4.748   8.173
   49    HB2  SER   7           HB2      SER   7   1.460   4.351  10.521
   50    HB3  SER   7           HB1      SER   7   1.256   3.159   9.240
   51    HG   SER   7           HG       SER   7   2.292   5.780   9.056
   52    H    LYS   8           HN       LYS   8  -2.215   5.269  10.780
   53    HA   LYS   8           HA       LYS   8  -2.891   2.406  11.195
   54    HB2  LYS   8           HB2      LYS   8  -3.694   4.877  12.742
   55    HB3  LYS   8           HB1      LYS   8  -4.189   3.238  13.135
   56    HG2  LYS   8           HG2      LYS   8  -1.322   4.148  13.044
   57    HG3  LYS   8           HG1      LYS   8  -2.307   4.121  14.507
   58    HD2  LYS   8           HD2      LYS   8  -2.619   1.714  14.270
   59    HD3  LYS   8           HD1      LYS   8  -1.677   1.727  12.777
   60    HE2  LYS   8           HE2      LYS   8   0.302   2.382  13.960
   61    HE3  LYS   8           HE1      LYS   8  -0.607   2.613  15.452
   62    HZ1  LYS   8           HZ1      LYS   8   0.606   0.522  15.450
   63    HZ2  LYS   8           HZ2      LYS   8  -0.212   0.019  14.060
   64    HZ3  LYS   8           HZ3      LYS   8  -1.062   0.245  15.504
   65    H    THR   9           HN       THR   9  -3.582   3.669   8.707
   66    HA   THR   9           HA       THR   9  -6.555   3.649   8.978
   67    HB   THR   9           HB       THR   9  -6.612   5.134   6.951
   68    HG1  THR   9           HG1      THR   9  -4.690   5.244   6.021
   69   HG21  THR   9          HG21      THR   9  -6.171   7.195   8.179
   70   HG22  THR   9          HG22      THR   9  -5.245   6.295   9.381
   71   HG23  THR   9          HG23      THR   9  -6.979   6.017   9.214
   72    H    SER  10           HN       SER  10  -7.228   1.738   8.262
   73    HA   SER  10           HA       SER  10  -5.808   0.444   6.028
   74    HB2  SER  10           HB2      SER  10  -7.370  -1.448   6.481
   75    HB3  SER  10           HB1      SER  10  -6.440  -0.968   7.899
   76    HG   SER  10           HG       SER  10  -9.029  -1.170   7.736
   77    H    MET  11           HN       MET  11  -7.018  -0.507   4.213
   78    HA   MET  11           HA       MET  11  -9.433   1.081   3.500
   79    HB2  MET  11           HB2      MET  11  -7.487   2.104   2.390
   80    HB3  MET  11           HB1      MET  11  -7.079   0.550   1.675
   81    HG2  MET  11           HG2      MET  11  -8.181   1.966   0.060
   82    HG3  MET  11           HG1      MET  11  -9.186   0.568   0.435
   83    HE1  MET  11           HE1      MET  11 -11.887   3.296  -0.224
   84    HE2  MET  11           HE2      MET  11 -11.378   1.641  -0.563
   85    HE3  MET  11           HE3      MET  11 -10.382   2.997  -1.092
   86    H    THR  12           HN       THR  12 -11.050  -0.049   2.573
   87    HA   THR  12           HA       THR  12 -10.642  -2.954   2.399
   88    HB   THR  12           HB       THR  12 -13.172  -1.337   2.027
   89    HG1  THR  12           HG1      THR  12 -12.853  -1.152   4.139
   90   HG21  THR  12          HG21      THR  12 -13.307  -3.519   0.942
   91   HG22  THR  12          HG22      THR  12 -14.320  -3.485   2.386
   92   HG23  THR  12          HG23      THR  12 -12.758  -4.305   2.422
   93    H    PHE  13           HN       PHE  13 -10.075  -3.953   0.620
   94    HA   PHE  13           HA       PHE  13 -10.563  -2.653  -1.994
   95    HB2  PHE  13           HB2      PHE  13  -8.814  -4.939  -1.108
   96    HB3  PHE  13           HB1      PHE  13  -9.095  -4.581  -2.806
   97    HD1  PHE  13           HD2      PHE  13  -9.143  -1.530  -2.473
   98    HD2  PHE  13           HD1      PHE  13  -6.482  -4.551  -1.094
   99    HE1  PHE  13           HE2      PHE  13  -7.312   0.110  -2.429
  100    HE2  PHE  13           HE1      PHE  13  -4.649  -2.916  -1.048
  101    HZ   PHE  13           HZ       PHE  13  -5.060  -0.583  -1.716
  102    H    GLN  14           HN       GLN  14 -11.577  -3.682  -3.723
  103    HA   GLN  14           HA       GLN  14 -13.250  -6.010  -2.917
  104    HB2  GLN  14           HB2      GLN  14 -14.611  -3.979  -2.894
  105    HB3  GLN  14           HB1      GLN  14 -14.120  -3.613  -4.540
  106    HG2  GLN  14           HG2      GLN  14 -16.346  -4.536  -4.513
  107    HG3  GLN  14           HG1      GLN  14 -15.241  -5.647  -5.318
  108   HE21  GLN  14          HE21      GLN  14 -14.821  -7.647  -4.456
  109   HE22  GLN  14          HE22      GLN  14 -15.725  -8.290  -3.043
  110    HA   PRO  15           HA       PRO  15 -10.832  -7.655  -6.412
  111    HB2  PRO  15           HB2      PRO  15 -12.760  -9.836  -5.805
  112    HB3  PRO  15           HB1      PRO  15 -11.019  -9.913  -6.096
  113    HG2  PRO  15           HG2      PRO  15 -12.011 -10.120  -3.630
  114    HG3  PRO  15           HG1      PRO  15 -10.492  -9.262  -3.944
  115    HD2  PRO  15           HD2      PRO  15 -13.178  -8.183  -3.290
  116    HD3  PRO  15           HD1      PRO  15 -11.577  -7.519  -2.924
  117    H    LYS  16           HN       LYS  16 -11.235  -7.950  -8.562
  118    HA   LYS  16           HA       LYS  16 -13.680  -6.830  -9.577
  119    HB2  LYS  16           HB2      LYS  16 -11.555  -8.416 -11.041
  120    HB3  LYS  16           HB1      LYS  16 -12.772  -7.390 -11.783
  121    HG2  LYS  16           HG2      LYS  16 -10.545  -6.483  -9.971
  122    HG3  LYS  16           HG1      LYS  16 -10.626  -6.271 -11.718
  123    HD2  LYS  16           HD2      LYS  16 -12.540  -4.820 -11.501
  124    HD3  LYS  16           HD1      LYS  16 -12.619  -5.126  -9.765
  125    HE2  LYS  16           HE2      LYS  16 -10.425  -4.081  -9.483
  126    HE3  LYS  16           HE1      LYS  16 -10.343  -3.779 -11.218
  127    HZ1  LYS  16           HZ1      LYS  16 -11.051  -1.819  -9.976
  128    HZ2  LYS  16           HZ2      LYS  16 -12.393  -2.658  -9.382
  129    HZ3  LYS  16           HZ3      LYS  16 -12.261  -2.339 -11.037
  130    H    LYS  17           HN       LYS  17 -12.438 -10.111  -9.119
  131    HA   LYS  17           HA       LYS  17 -14.952 -11.224 -10.252
  132    HB2  LYS  17           HB2      LYS  17 -12.435 -12.703  -9.472
  133    HB3  LYS  17           HB1      LYS  17 -13.785 -13.326 -10.409
  134    HG2  LYS  17           HG2      LYS  17 -13.193 -12.133 -12.305
  135    HG3  LYS  17           HG1      LYS  17 -12.217 -10.979 -11.394
  136    HD2  LYS  17           HD2      LYS  17 -10.613 -12.806 -10.897
  137    HD3  LYS  17           HD1      LYS  17 -11.562 -13.873 -11.934
  138    HE2  LYS  17           HE2      LYS  17 -11.119 -12.491 -13.852
  139    HE3  LYS  17           HE1      LYS  17 -10.324 -11.279 -12.847
  140    HZ1  LYS  17           HZ1      LYS  17  -9.368 -14.047 -13.349
  141    HZ2  LYS  17           HZ2      LYS  17  -8.625 -12.946 -12.303
  142    HZ3  LYS  17           HZ3      LYS  17  -8.690 -12.624 -13.962
  143    H    ALA  18           HN       ALA  18 -15.816 -13.202  -9.126
  144    HA   ALA  18           HA       ALA  18 -16.253 -12.514  -6.328
  145    HB1  ALA  18           HB1      ALA  18 -17.257 -14.849  -7.952
  146    HB2  ALA  18           HB2      ALA  18 -18.084 -13.309  -7.720
  147    HB3  ALA  18           HB3      ALA  18 -17.827 -14.386  -6.348
  148    H    SER  19           HN       SER  19 -14.389 -14.915  -8.126
  149    HA   SER  19           HA       SER  19 -13.905 -16.769  -6.059
  150    HB2  SER  19           HB2      SER  19 -13.267 -17.124  -8.419
  151    HB3  SER  19           HB1      SER  19 -12.001 -15.908  -8.253
  152    HG   SER  19           HG       SER  19 -12.099 -18.518  -7.316
  153    H    LEU  20           HN       LEU  20 -12.222 -13.728  -6.847
  154    HA   LEU  20           HA       LEU  20 -10.160 -14.036  -4.885
  155    HB2  LEU  20           HB2      LEU  20 -11.317 -11.615  -6.246
  156    HB3  LEU  20           HB1      LEU  20  -9.930 -11.544  -5.184
  157    HG   LEU  20           HG       LEU  20  -9.993 -13.243  -7.671
  158   HD11  LEU  20          HD11      LEU  20 -10.311 -10.984  -8.397
  159   HD12  LEU  20          HD12      LEU  20  -8.630 -11.430  -8.692
  160   HD13  LEU  20          HD13      LEU  20  -9.042 -10.406  -7.317
  161   HD21  LEU  20          HD21      LEU  20  -7.747 -12.236  -5.927
  162   HD22  LEU  20          HD22      LEU  20  -7.548 -13.151  -7.421
  163   HD23  LEU  20          HD23      LEU  20  -8.331 -13.898  -6.028
  164    H    GLN  21           HN       GLN  21  -9.835 -12.605  -2.987
  165    HA   GLN  21           HA       GLN  21 -12.421 -12.182  -1.561
  166    HB2  GLN  21           HB2      GLN  21 -11.226 -12.766   0.520
  167    HB3  GLN  21           HB1      GLN  21 -11.268 -14.097  -0.625
  168    HG2  GLN  21           HG2      GLN  21  -8.969 -13.586  -1.294
  169    HG3  GLN  21           HG1      GLN  21  -8.930 -12.266  -0.127
  170   HE21  GLN  21          HE21      GLN  21  -7.256 -14.672  -0.356
  171   HE22  GLN  21          HE22      GLN  21  -7.431 -15.515   1.222
  172    HA   PRO  22           HA       PRO  22 -11.362  -7.885  -1.197
  173    HB2  PRO  22           HB2      PRO  22 -12.634  -8.197   1.488
  174    HB3  PRO  22           HB1      PRO  22 -12.943  -6.995   0.229
  175    HG2  PRO  22           HG2      PRO  22 -14.645  -8.988   0.586
  176    HG3  PRO  22           HG1      PRO  22 -14.209  -8.473  -1.053
  177    HD2  PRO  22           HD2      PRO  22 -13.282 -10.860   0.497
  178    HD3  PRO  22           HD1      PRO  22 -13.673 -10.718  -1.230
  179    H    LEU  23           HN       LEU  23  -9.900  -6.509  -0.173
  180    HA   LEU  23           HA       LEU  23  -8.261  -7.794   1.965
  181    HB2  LEU  23           HB2      LEU  23  -7.294  -7.678  -0.430
  182    HB3  LEU  23           HB1      LEU  23  -7.093  -5.971  -0.110
  183    HG   LEU  23           HG       LEU  23  -5.866  -8.165   1.563
  184   HD11  LEU  23          HD11      LEU  23  -4.599  -6.441  -0.561
  185   HD12  LEU  23          HD12      LEU  23  -4.956  -8.161  -0.708
  186   HD13  LEU  23          HD13      LEU  23  -3.767  -7.606   0.470
  187   HD21  LEU  23          HD21      LEU  23  -6.074  -6.229   2.895
  188   HD22  LEU  23          HD22      LEU  23  -5.612  -5.168   1.564
  189   HD23  LEU  23          HD23      LEU  23  -4.413  -6.227   2.307
  190    H    THR  24           HN       THR  24  -8.130  -6.668   3.781
  191    HA   THR  24           HA       THR  24  -8.446  -3.705   3.589
  192    HB   THR  24           HB       THR  24  -9.519  -5.428   5.833
  193    HG1  THR  24           HG1      THR  24 -11.029  -5.737   4.339
  194   HG21  THR  24          HG21      THR  24  -8.870  -3.176   6.541
  195   HG22  THR  24          HG22      THR  24 -10.623  -3.360   6.559
  196   HG23  THR  24          HG23      THR  24  -9.841  -2.481   5.245
  197    H    ILE  25           HN       ILE  25  -6.204  -3.394   3.598
  198    HA   ILE  25           HA       ILE  25  -4.922  -4.055   6.215
  199    HB   ILE  25           HB       ILE  25  -4.048  -5.395   4.287
  200   HG12  ILE  25          HG12      ILE  25  -1.643  -4.942   4.789
  201   HG13  ILE  25          HG11      ILE  25  -2.134  -3.491   5.651
  202   HG21  ILE  25          HG21      ILE  25  -4.292  -3.502   2.640
  203   HG22  ILE  25          HG22      ILE  25  -2.784  -4.408   2.553
  204   HG23  ILE  25          HG23      ILE  25  -2.816  -2.824   3.328
  205   HD11  ILE  25          HD11      ILE  25  -1.699  -5.335   7.171
  206   HD12  ILE  25          HD12      ILE  25  -2.926  -6.305   6.355
  207   HD13  ILE  25          HD13      ILE  25  -3.391  -4.847   7.229
  208    H    SER  26           HN       SER  26  -3.318  -2.606   7.015
  209    HA   SER  26           HA       SER  26  -3.623   0.156   5.924
  210    HB2  SER  26           HB2      SER  26  -4.641  -0.178   8.162
  211    HB3  SER  26           HB1      SER  26  -3.069  -0.678   8.784
  212    HG   SER  26           HG       SER  26  -2.645   1.348   9.046
  213    H    LEU  27           HN       LEU  27  -1.768   1.629   6.691
  214    HA   LEU  27           HA       LEU  27   0.652   0.751   5.486
  215    HB2  LEU  27           HB2      LEU  27   0.252   2.999   7.445
  216    HB3  LEU  27           HB1      LEU  27   1.615   2.806   6.361
  217    HG   LEU  27           HG       LEU  27  -1.238   3.437   5.621
  218   HD11  LEU  27          HD11      LEU  27   0.125   5.312   6.413
  219   HD12  LEU  27          HD12      LEU  27  -0.277   5.468   4.705
  220   HD13  LEU  27          HD13      LEU  27   1.336   4.944   5.186
  221   HD21  LEU  27          HD21      LEU  27   1.084   2.835   3.791
  222   HD22  LEU  27          HD22      LEU  27  -0.499   3.432   3.292
  223   HD23  LEU  27          HD23      LEU  27  -0.349   1.832   4.016
  224    H    ASP  28           HN       ASP  28   0.175   1.581   8.939
  225    HA   ASP  28           HA       ASP  28   2.659   0.460   9.769
  226    HB2  ASP  28           HB2      ASP  28   1.223   2.136  11.017
  227    HB3  ASP  28           HB1      ASP  28   0.200   0.787  11.494
  228    H    GLU  29           HN       GLU  29  -0.557  -0.913   9.365
  229    HA   GLU  29           HA       GLU  29   0.071  -3.349  10.815
  230    HB2  GLU  29           HB2      GLU  29  -2.215  -2.364  10.599
  231    HB3  GLU  29           HB1      GLU  29  -2.199  -2.800   8.898
  232    HG2  GLU  29           HG2      GLU  29  -2.069  -5.141   9.467
  233    HG3  GLU  29           HG1      GLU  29  -1.964  -4.747  11.180
  234    H    LEU  30           HN       LEU  30   1.236  -2.273   7.872
  235    HA   LEU  30           HA       LEU  30   1.482  -5.096   6.983
  236    HB2  LEU  30           HB2      LEU  30  -0.237  -3.820   5.666
  237    HB3  LEU  30           HB1      LEU  30   1.052  -2.780   5.099
  238    HG   LEU  30           HG       LEU  30   2.127  -4.699   4.001
  239   HD11  LEU  30          HD11      LEU  30   1.438  -6.492   5.448
  240   HD12  LEU  30          HD12      LEU  30   0.874  -6.823   3.812
  241   HD13  LEU  30          HD13      LEU  30  -0.254  -6.232   5.030
  242   HD21  LEU  30          HD21      LEU  30   0.516  -3.322   2.773
  243   HD22  LEU  30          HD22      LEU  30  -0.783  -4.405   3.273
  244   HD23  LEU  30          HD23      LEU  30   0.505  -4.996   2.223
  245    H    PHE  31           HN       PHE  31   3.278  -2.816   8.259
  246    HA   PHE  31           HA       PHE  31   5.511  -3.563   6.492
  247    HB2  PHE  31           HB2      PHE  31   5.209  -0.757   7.597
  248    HB3  PHE  31           HB1      PHE  31   6.555  -1.330   6.619
  249    HD1  PHE  31           HD1      PHE  31   5.421  -2.684   4.403
  250    HD2  PHE  31           HD2      PHE  31   3.940   0.747   6.436
  251    HE1  PHE  31           HE1      PHE  31   4.223  -1.997   2.367
  252    HE2  PHE  31           HE2      PHE  31   2.738   1.437   4.405
  253    HZ   PHE  31           HZ       PHE  31   2.878   0.062   2.369
  254    H    SER  32           HN       SER  32   7.479  -4.022   7.436
  255    HA   SER  32           HA       SER  32   7.583  -3.709  10.391
  256    HB2  SER  32           HB2      SER  32   8.513  -5.970  10.578
  257    HB3  SER  32           HB1      SER  32   6.898  -5.992   9.873
  258    HG   SER  32           HG       SER  32   7.837  -6.263   7.839
  259    H    SER  33           HN       SER  33   8.858  -2.081   8.313
  260    HA   SER  33           HA       SER  33  11.521  -2.057   9.339
  261    HB2  SER  33           HB2      SER  33  12.667  -2.564   7.108
  262    HB3  SER  33           HB1      SER  33  12.060  -3.943   8.022
  263    HG   SER  33           HG       SER  33  10.952  -4.406   6.312
  264    H    ARG  34           HN       ARG  34  12.525  -0.131   8.987
  265    HA   ARG  34           HA       ARG  34  10.947   1.977   7.895
  266    HB2  ARG  34           HB2      ARG  34  12.899   3.398   8.265
  267    HB3  ARG  34           HB1      ARG  34  12.613   2.348   9.644
  268    HG2  ARG  34           HG2      ARG  34  14.859   2.113   9.471
  269    HG3  ARG  34           HG1      ARG  34  14.369   0.819   8.378
  270    HD2  ARG  34           HD2      ARG  34  14.544   2.495   6.503
  271    HD3  ARG  34           HD1      ARG  34  15.286   3.596   7.660
  272    HE   ARG  34           HE       ARG  34  16.859   1.431   7.954
  273   HH11  ARG  34          HH11      ARG  34  15.683   3.070   5.040
  274   HH12  ARG  34          HH12      ARG  34  17.062   2.629   4.092
  275   HH21  ARG  34          HH21      ARG  34  18.655   0.877   6.669
  276   HH22  ARG  34          HH22      ARG  34  18.750   1.384   5.016
  277    H    GLY  35           HN       GLY  35  13.649   0.087   6.538
  278    HA2  GLY  35           HA2      GLY  35  13.930   1.712   4.181
  279    HA3  GLY  35           HA1      GLY  35  14.513   0.070   4.384
  280    H    GLU  36           HN       GLU  36  11.997  -1.200   4.915
  281    HA   GLU  36           HA       GLU  36  11.122  -1.715   2.275
  282    HB2  GLU  36           HB2      GLU  36  10.704  -3.280   4.085
  283    HB3  GLU  36           HB1      GLU  36   9.681  -2.111   4.905
  284    HG2  GLU  36           HG2      GLU  36   8.312  -3.761   3.848
  285    HG3  GLU  36           HG1      GLU  36   8.094  -2.221   3.022
  286    H    PHE  37           HN       PHE  37   9.835   0.447   4.794
  287    HA   PHE  37           HA       PHE  37   7.521   1.337   3.478
  288    HB2  PHE  37           HB2      PHE  37   8.450   1.875   5.847
  289    HB3  PHE  37           HB1      PHE  37   9.272   3.211   5.051
  290    HD1  PHE  37           HD1      PHE  37   7.972   5.022   4.011
  291    HD2  PHE  37           HD2      PHE  37   6.110   1.928   6.263
  292    HE1  PHE  37           HE1      PHE  37   5.943   6.396   4.215
  293    HE2  PHE  37           HE2      PHE  37   4.077   3.296   6.469
  294    HZ   PHE  37           HZ       PHE  37   3.991   5.535   5.445
  295    H    ILE  38           HN       ILE  38  10.859   2.641   3.313
  296    HA   ILE  38           HA       ILE  38  10.418   4.721   1.513
  297    HB   ILE  38           HB       ILE  38  12.819   2.889   1.652
  298   HG12  ILE  38          HG12      ILE  38  12.399   3.911   3.797
  299   HG13  ILE  38          HG11      ILE  38  13.767   4.730   3.054
  300   HG21  ILE  38          HG21      ILE  38  12.520   5.627   0.423
  301   HG22  ILE  38          HG22      ILE  38  12.851   4.116  -0.425
  302   HG23  ILE  38          HG23      ILE  38  14.054   4.795   0.672
  303   HD11  ILE  38          HD11      ILE  38  10.934   5.745   3.148
  304   HD12  ILE  38          HD12      ILE  38  12.298   6.567   2.389
  305   HD13  ILE  38          HD13      ILE  38  12.283   6.310   4.133
  306    H    SER  39           HN       SER  39  11.273   1.307   0.717
  307    HA   SER  39           HA       SER  39  11.237   1.695  -2.098
  308    HB2  SER  39           HB2      SER  39  12.208  -0.300  -1.002
  309    HB3  SER  39           HB1      SER  39  10.595  -0.842  -0.542
  310    HG   SER  39           HG       SER  39  10.277  -1.544  -2.506
  311    H    VAL  40           HN       VAL  40   8.712  -0.041  -0.166
  312    HA   VAL  40           HA       VAL  40   6.768  -0.382  -1.931
  313    HB   VAL  40           HB       VAL  40   5.038   0.047  -0.218
  314   HG11  VAL  40          HG11      VAL  40   7.487  -1.415   0.759
  315   HG12  VAL  40          HG12      VAL  40   6.236  -2.071  -0.296
  316   HG13  VAL  40          HG13      VAL  40   5.846  -1.629   1.365
  317   HG21  VAL  40          HG21      VAL  40   5.655   0.792   1.995
  318   HG22  VAL  40          HG22      VAL  40   6.082   2.030   0.814
  319   HG23  VAL  40          HG23      VAL  40   7.332   0.989   1.492
  320    H    GLY  41           HN       GLY  41   7.482   2.939  -0.696
  321    HA2  GLY  41           HA2      GLY  41   6.976   4.548  -2.604
  322    HA3  GLY  41           HA1      GLY  41   5.354   3.874  -2.558
  323    H    GLY  42           HN       GLY  42   7.502   4.612   0.204
  324    HA2  GLY  42           HA2      GLY  42   5.484   6.657   1.028
  325    HA3  GLY  42           HA1      GLY  42   6.184   5.514   2.156
  326    H    ASP  43           HN       ASP  43   6.809   8.288   0.082
  327    HA   ASP  43           HA       ASP  43   9.437   8.757   1.272
  328    HB2  ASP  43           HB2      ASP  43   7.673  10.461  -0.505
  329    HB3  ASP  43           HB1      ASP  43   9.279  10.949   0.028
  330    H    GLY  44           HN       GLY  44   6.581  10.948   1.127
  331    HA2  GLY  44           HA2      GLY  44   6.610  11.156   4.063
  332    HA3  GLY  44           HA1      GLY  44   7.109  12.599   3.200
  333    H    ARG  45           HN       ARG  45   5.573  13.413   1.501
  334    HA   ARG  45           HA       ARG  45   2.918  13.465   2.743
  335    HB2  ARG  45           HB2      ARG  45   4.186  15.022   0.496
  336    HB3  ARG  45           HB1      ARG  45   2.489  15.194   0.920
  337    HG2  ARG  45           HG2      ARG  45   3.644  16.949   2.000
  338    HG3  ARG  45           HG1      ARG  45   3.227  15.773   3.247
  339    HD2  ARG  45           HD2      ARG  45   5.508  16.605   3.528
  340    HD3  ARG  45           HD1      ARG  45   5.487  14.876   3.185
  341    HE   ARG  45           HE       ARG  45   5.822  16.536   0.815
  342   HH11  ARG  45          HH11      ARG  45   7.481  14.912   3.491
  343   HH12  ARG  45          HH12      ARG  45   8.998  14.830   2.661
  344   HH21  ARG  45          HH21      ARG  45   7.840  16.409  -0.240
  345   HH22  ARG  45          HH22      ARG  45   9.202  15.682   0.545
  346    H    MET  46           HN       MET  46   1.696  11.724   2.342
  347    HA   MET  46           HA       MET  46   1.542  10.736  -0.454
  348    HB2  MET  46           HB2      MET  46   1.918   9.214   1.597
  349    HB3  MET  46           HB1      MET  46   0.222   9.493   1.954
  350    HG2  MET  46           HG2      MET  46  -0.048   7.624   0.743
  351    HG3  MET  46           HG1      MET  46   0.023   8.741  -0.611
  352    HE1  MET  46           HE1      MET  46   3.624   8.310  -1.960
  353    HE2  MET  46           HE2      MET  46   2.995   9.565  -0.892
  354    HE3  MET  46           HE3      MET  46   2.024   8.992  -2.248
  355    H    SER  47           HN       SER  47  -0.639  10.194  -1.331
  356    HA   SER  47           HA       SER  47  -2.431  12.444  -0.760
  357    HB2  SER  47           HB2      SER  47  -2.406  10.314  -2.892
  358    HB3  SER  47           HB1      SER  47  -3.709  11.490  -2.735
  359    HG   SER  47           HG       SER  47  -2.374  12.520  -4.057
  360    H    HIS  48           HN       HIS  48  -3.124   8.991  -1.392
  361    HA   HIS  48           HA       HIS  48  -4.554   8.409   1.010
  362    HB2  HIS  48           HB2      HIS  48  -6.119  10.138   0.299
  363    HB3  HIS  48           HB1      HIS  48  -6.252   9.384  -1.284
  364    HD1  HIS  48           HD1      HIS  48  -7.599   9.305   2.159
  365    HD2  HIS  48           HD2      HIS  48  -7.660   6.861  -1.250
  366    HE1  HIS  48           HE1      HIS  48  -9.460   7.619   2.518
  367    HE2  HIS  48           HE2      HIS  48  -9.521   6.156   0.439
  368    H    LYS  49           HN       LYS  49  -5.490   7.874  -2.419
  369    HA   LYS  49           HA       LYS  49  -5.693   5.062  -2.061
  370    HB2  LYS  49           HB2      LYS  49  -6.697   6.356  -3.931
  371    HB3  LYS  49           HB1      LYS  49  -5.091   6.564  -4.615
  372    HG2  LYS  49           HG2      LYS  49  -6.165   4.801  -5.783
  373    HG3  LYS  49           HG1      LYS  49  -4.912   4.086  -4.776
  374    HD2  LYS  49           HD2      LYS  49  -7.668   4.294  -3.668
  375    HD3  LYS  49           HD1      LYS  49  -7.354   3.068  -4.896
  376    HE2  LYS  49           HE2      LYS  49  -5.795   3.388  -2.331
  377    HE3  LYS  49           HE1      LYS  49  -7.094   2.227  -2.581
  378    HZ1  LYS  49           HZ1      LYS  49  -4.525   2.317  -4.072
  379    HZ2  LYS  49           HZ2      LYS  49  -5.780   1.221  -4.358
  380    HZ3  LYS  49           HZ3      LYS  49  -4.951   1.190  -2.886
  381    H    GLU  50           HN       GLU  50  -2.964   7.164  -2.756
  382    HA   GLU  50           HA       GLU  50  -1.152   5.219  -3.768
  383    HB2  GLU  50           HB2      GLU  50  -0.721   7.801  -2.264
  384    HB3  GLU  50           HB1      GLU  50   0.585   6.860  -2.964
  385    HG2  GLU  50           HG2      GLU  50  -0.462   7.119  -5.183
  386    HG3  GLU  50           HG1      GLU  50  -1.696   8.143  -4.447
  387    H    ALA  51           HN       ALA  51  -1.616   6.488  -0.436
  388    HA   ALA  51           HA       ALA  51   0.418   5.083   0.839
  389    HB1  ALA  51           HB1      ALA  51  -2.329   5.647   1.955
  390    HB2  ALA  51           HB2      ALA  51  -0.974   6.774   1.941
  391    HB3  ALA  51           HB3      ALA  51  -0.880   5.296   2.895
  392    H    ILE  52           HN       ILE  52  -2.989   3.886   0.475
  393    HA   ILE  52           HA       ILE  52  -2.365   1.431   1.735
  394    HB   ILE  52           HB       ILE  52  -4.493   1.888  -0.389
  395   HG12  ILE  52          HG12      ILE  52  -4.630   3.440   1.550
  396   HG13  ILE  52          HG11      ILE  52  -6.005   2.355   1.449
  397   HG21  ILE  52          HG21      ILE  52  -5.629  -0.030   0.587
  398   HG22  ILE  52          HG22      ILE  52  -4.306  -0.249   1.731
  399   HG23  ILE  52          HG23      ILE  52  -4.028  -0.484   0.006
  400   HD11  ILE  52          HD11      ILE  52  -5.245   2.634   3.741
  401   HD12  ILE  52          HD12      ILE  52  -3.648   2.038   3.291
  402   HD13  ILE  52          HD13      ILE  52  -5.045   0.966   3.204
  403    H    LEU  53           HN       LEU  53  -2.298   2.375  -1.717
  404    HA   LEU  53           HA       LEU  53  -1.915  -0.186  -2.804
  405    HB2  LEU  53           HB2      LEU  53  -2.273   1.916  -4.099
  406    HB3  LEU  53           HB1      LEU  53  -0.650   2.464  -3.747
  407    HG   LEU  53           HG       LEU  53   0.204   0.442  -4.987
  408   HD11  LEU  53          HD11      LEU  53  -1.400  -0.572  -6.598
  409   HD12  LEU  53          HD12      LEU  53  -2.708   0.223  -5.722
  410   HD13  LEU  53          HD13      LEU  53  -1.710  -0.985  -4.912
  411   HD21  LEU  53          HD21      LEU  53   0.249   2.599  -6.030
  412   HD22  LEU  53          HD22      LEU  53  -1.461   2.490  -6.440
  413   HD23  LEU  53          HD23      LEU  53  -0.298   1.419  -7.220
  414    H    LEU  54           HN       LEU  54   0.485   1.844  -1.077
  415    HA   LEU  54           HA       LEU  54   2.933   0.840  -1.868
  416    HB2  LEU  54           HB2      LEU  54   1.745   1.646   0.773
  417    HB3  LEU  54           HB1      LEU  54   3.278   0.809   0.817
  418    HG   LEU  54           HG       LEU  54   4.253   2.518  -0.663
  419   HD11  LEU  54          HD11      LEU  54   3.039   4.568  -1.136
  420   HD12  LEU  54          HD12      LEU  54   1.602   3.914  -0.353
  421   HD13  LEU  54          HD13      LEU  54   2.211   3.179  -1.837
  422   HD21  LEU  54          HD21      LEU  54   4.471   2.760   1.739
  423   HD22  LEU  54          HD22      LEU  54   2.915   3.586   1.818
  424   HD23  LEU  54          HD23      LEU  54   4.273   4.341   0.984
  425    H    GLY  55           HN       GLY  55   0.436  -0.847   0.118
  426    HA2  GLY  55           HA2      GLY  55   1.865  -2.974   1.174
  427    HA3  GLY  55           HA1      GLY  55   0.205  -3.089   0.625
  428    H    LEU  56           HN       LEU  56   0.567  -2.765  -2.161
  429    HA   LEU  56           HA       LEU  56   1.117  -5.388  -2.949
  430    HB2  LEU  56           HB2      LEU  56   1.388  -2.870  -4.597
  431    HB3  LEU  56           HB1      LEU  56   1.321  -4.495  -5.253
  432    HG   LEU  56           HG       LEU  56  -0.874  -2.980  -3.855
  433   HD11  LEU  56          HD11      LEU  56  -0.611  -2.489  -6.209
  434   HD12  LEU  56          HD12      LEU  56  -2.080  -3.428  -5.946
  435   HD13  LEU  56          HD13      LEU  56  -0.639  -4.208  -6.597
  436   HD21  LEU  56          HD21      LEU  56  -1.001  -5.178  -2.953
  437   HD22  LEU  56          HD22      LEU  56  -0.712  -5.911  -4.530
  438   HD23  LEU  56          HD23      LEU  56  -2.227  -5.063  -4.217
  439    H    ARG  57           HN       ARG  57   3.353  -2.611  -2.823
  440    HA   ARG  57           HA       ARG  57   5.537  -4.061  -4.004
  441    HB2  ARG  57           HB2      ARG  57   5.377  -1.544  -2.360
  442    HB3  ARG  57           HB1      ARG  57   6.912  -2.191  -2.920
  443    HG2  ARG  57           HG2      ARG  57   4.657  -1.592  -4.807
  444    HG3  ARG  57           HG1      ARG  57   5.827  -0.366  -4.318
  445    HD2  ARG  57           HD2      ARG  57   6.584  -1.288  -6.378
  446    HD3  ARG  57           HD1      ARG  57   7.637  -1.902  -5.107
  447    HE   ARG  57           HE       ARG  57   5.472  -3.453  -6.453
  448   HH11  ARG  57          HH11      ARG  57   8.542  -3.342  -4.668
  449   HH12  ARG  57          HH12      ARG  57   8.824  -5.041  -4.826
  450   HH21  ARG  57          HH21      ARG  57   5.890  -5.680  -6.618
  451   HH22  ARG  57          HH22      ARG  57   7.322  -6.366  -5.930
  452    H    TYR  58           HN       TYR  58   4.212  -3.872  -0.785
  453    HA   TYR  58           HA       TYR  58   6.561  -4.884   0.575
  454    HB2  TYR  58           HB2      TYR  58   4.869  -3.582   1.764
  455    HB3  TYR  58           HB1      TYR  58   3.648  -4.792   1.398
  456    HD1  TYR  58           HD2      TYR  58   6.638  -4.063   3.408
  457    HD2  TYR  58           HD1      TYR  58   3.488  -6.822   2.671
  458    HE1  TYR  58           HE2      TYR  58   7.184  -5.232   5.500
  459    HE2  TYR  58           HE1      TYR  58   4.020  -7.998   4.763
  460    HH   TYR  58           HH       TYR  58   5.886  -6.727   7.166
  461    H    LYS  59           HN       LYS  59   3.444  -6.287  -0.446
  462    HA   LYS  59           HA       LYS  59   4.245  -8.984   0.287
  463    HB2  LYS  59           HB2      LYS  59   1.868  -7.860  -1.170
  464    HB3  LYS  59           HB1      LYS  59   2.072  -9.572  -0.837
  465    HG2  LYS  59           HG2      LYS  59   1.962  -7.411   1.258
  466    HG3  LYS  59           HG1      LYS  59   0.607  -8.437   0.785
  467    HD2  LYS  59           HD2      LYS  59   1.834 -10.417   1.502
  468    HD3  LYS  59           HD1      LYS  59   3.226  -9.418   1.923
  469    HE2  LYS  59           HE2      LYS  59   1.916  -8.276   3.622
  470    HE3  LYS  59           HE1      LYS  59   0.490  -9.211   3.176
  471    HZ1  LYS  59           HZ1      LYS  59   1.580 -11.211   3.902
  472    HZ2  LYS  59           HZ2      LYS  59   1.626 -10.078   5.155
  473    HZ3  LYS  59           HZ3      LYS  59   3.012 -10.373   4.231
  474    H    LYS  60           HN       LYS  60   4.694  -6.965  -2.446
  475    HA   LYS  60           HA       LYS  60   5.749  -7.345  -4.426
  476    HB2  LYS  60           HB2      LYS  60   6.142 -10.208  -3.537
  477    HB3  LYS  60           HB1      LYS  60   6.981  -9.400  -4.851
  478    HG2  LYS  60           HG2      LYS  60   7.179  -8.670  -1.937
  479    HG3  LYS  60           HG1      LYS  60   8.371  -9.590  -2.857
  480    HD2  LYS  60           HD2      LYS  60   8.676  -7.656  -4.351
  481    HD3  LYS  60           HD1      LYS  60   7.524  -6.741  -3.378
  482    HE2  LYS  60           HE2      LYS  60  10.107  -7.914  -2.356
  483    HE3  LYS  60           HE1      LYS  60   9.879  -6.232  -2.827
  484    HZ1  LYS  60           HZ1      LYS  60   9.678  -6.448  -0.457
  485    HZ2  LYS  60           HZ2      LYS  60   8.492  -7.642  -0.611
  486    HZ3  LYS  60           HZ3      LYS  60   8.162  -6.056  -1.097
  487    H    LEU  61           HN       LEU  61   3.536  -6.944  -5.150
  488    HA   LEU  61           HA       LEU  61   2.864  -8.864  -7.160
  489    HB2  LEU  61           HB2      LEU  61   0.671  -9.566  -6.437
  490    HB3  LEU  61           HB1      LEU  61   1.841  -9.985  -5.204
  491    HG   LEU  61           HG       LEU  61   0.098  -7.530  -5.059
  492   HD11  LEU  61          HD11      LEU  61  -1.274  -8.782  -3.470
  493   HD12  LEU  61          HD12      LEU  61  -0.329 -10.233  -3.797
  494   HD13  LEU  61          HD13      LEU  61  -1.311  -9.515  -5.073
  495   HD21  LEU  61          HD21      LEU  61   2.062  -7.337  -3.705
  496   HD22  LEU  61          HD22      LEU  61   1.827  -8.957  -3.050
  497   HD23  LEU  61          HD23      LEU  61   0.689  -7.670  -2.651
  498    H    TYR  62           HN       TYR  62   3.460  -6.016  -6.891
  499    HA   TYR  62           HA       TYR  62   1.164  -4.410  -7.207
  500    HB2  TYR  62           HB2      TYR  62   3.546  -3.677  -6.839
  501    HB3  TYR  62           HB1      TYR  62   3.832  -3.974  -8.550
  502    HD1  TYR  62           HD1      TYR  62   2.118  -1.831  -6.113
  503    HD2  TYR  62           HD2      TYR  62   2.989  -2.459 -10.229
  504    HE1  TYR  62           HE1      TYR  62   1.349   0.445  -6.617
  505    HE2  TYR  62           HE2      TYR  62   2.219  -0.182 -10.745
  506    HH   TYR  62           HH       TYR  62   0.657   1.521  -9.697
  507    H    ASN  63           HN       ASN  63   2.451  -6.767  -9.380
  508    HA   ASN  63           HA       ASN  63   1.632  -5.513 -11.834
  509    HB2  ASN  63           HB2      ASN  63   2.282  -8.382 -11.159
  510    HB3  ASN  63           HB1      ASN  63   1.942  -7.814 -12.791
  511   HD21  ASN  63          HD21      ASN  63   4.188  -7.821 -10.126
  512   HD22  ASN  63          HD22      ASN  63   5.565  -7.108 -11.036
  513    H    GLN  64           HN       GLN  64   0.283  -8.546 -10.407
  514    HA   GLN  64           HA       GLN  64  -2.188  -7.999 -11.893
  515    HB2  GLN  64           HB2      GLN  64  -1.043 -10.372 -10.509
  516    HB3  GLN  64           HB1      GLN  64  -2.780 -10.309 -10.756
  517    HG2  GLN  64           HG2      GLN  64  -1.774 -11.532 -12.550
  518    HG3  GLN  64           HG1      GLN  64  -2.392 -10.003 -13.172
  519   HE21  GLN  64          HE21      GLN  64  -0.983  -8.403 -13.868
  520   HE22  GLN  64          HE22      GLN  64   0.754  -8.755 -14.168
  521    H    ALA  65           HN       ALA  65  -1.108  -7.232  -8.745
  522    HA   ALA  65           HA       ALA  65  -3.615  -7.798  -7.404
  523    HB1  ALA  65           HB1      ALA  65  -1.511  -7.674  -6.178
  524    HB2  ALA  65           HB2      ALA  65  -2.682  -6.510  -5.560
  525    HB3  ALA  65           HB3      ALA  65  -1.363  -5.968  -6.596
  526    H    ARG  66           HN       ARG  66  -2.121  -4.943  -8.906
  527    HA   ARG  66           HA       ARG  66  -4.119  -3.073  -8.113
  528    HB2  ARG  66           HB2      ARG  66  -1.865  -2.498  -8.987
  529    HB3  ARG  66           HB1      ARG  66  -2.380  -3.015 -10.585
  530    HG2  ARG  66           HG2      ARG  66  -4.030  -1.255 -10.668
  531    HG3  ARG  66           HG1      ARG  66  -3.646  -0.780  -9.013
  532    HD2  ARG  66           HD2      ARG  66  -2.577   0.716 -10.604
  533    HD3  ARG  66           HD1      ARG  66  -1.369  -0.202  -9.709
  534    HE   ARG  66           HE       ARG  66  -1.838  -1.670 -12.029
  535   HH11  ARG  66          HH11      ARG  66  -0.746   1.610 -11.260
  536   HH12  ARG  66          HH12      ARG  66   0.255   1.735 -12.666
  537   HH21  ARG  66          HH21      ARG  66  -0.514  -1.459 -13.870
  538   HH22  ARG  66          HH22      ARG  66   0.386  -0.006 -14.150
  539    H    VAL  67           HN       VAL  67  -4.036  -5.452 -10.707
  540    HA   VAL  67           HA       VAL  67  -6.400  -4.221 -11.986
  541    HB   VAL  67           HB       VAL  67  -4.581  -5.063 -13.423
  542   HG11  VAL  67          HG11      VAL  67  -5.382  -7.790 -12.412
  543   HG12  VAL  67          HG12      VAL  67  -3.866  -6.962 -12.062
  544   HG13  VAL  67          HG13      VAL  67  -4.237  -7.460 -13.712
  545   HG21  VAL  67          HG21      VAL  67  -6.864  -4.914 -14.283
  546   HG22  VAL  67          HG22      VAL  67  -7.179  -6.564 -13.743
  547   HG23  VAL  67          HG23      VAL  67  -5.991  -6.264 -15.011
  548    H    LYS  68           HN       LYS  68  -5.495  -7.129 -10.145
  549    HA   LYS  68           HA       LYS  68  -8.029  -8.452 -10.510
  550    HB2  LYS  68           HB2      LYS  68  -5.761  -8.790  -8.565
  551    HB3  LYS  68           HB1      LYS  68  -7.239  -9.725  -8.406
  552    HG2  LYS  68           HG2      LYS  68  -6.914 -10.662 -10.621
  553    HG3  LYS  68           HG1      LYS  68  -5.462  -9.684 -10.839
  554    HD2  LYS  68           HD2      LYS  68  -4.392 -10.835  -8.975
  555    HD3  LYS  68           HD1      LYS  68  -5.853 -11.789  -8.709
  556    HE2  LYS  68           HE2      LYS  68  -4.153 -11.818 -11.204
  557    HE3  LYS  68           HE1      LYS  68  -4.151 -13.050  -9.943
  558    HZ1  LYS  68           HZ1      LYS  68  -6.520 -13.443 -10.440
  559    HZ2  LYS  68           HZ2      LYS  68  -5.514 -13.773 -11.759
  560    HZ3  LYS  68           HZ3      LYS  68  -6.421 -12.347 -11.726
  561    H    TYR  69           HN       TYR  69  -6.767  -6.139  -8.167
  562    HA   TYR  69           HA       TYR  69  -9.415  -6.196  -6.793
  563    HB2  TYR  69           HB2      TYR  69  -6.662  -5.468  -5.790
  564    HB3  TYR  69           HB1      TYR  69  -8.130  -5.075  -4.907
  565    HD1  TYR  69           HD1      TYR  69  -6.730  -8.100  -6.625
  566    HD2  TYR  69           HD2      TYR  69  -8.582  -6.481  -3.155
  567    HE1  TYR  69           HE1      TYR  69  -6.685 -10.321  -5.574
  568    HE2  TYR  69           HE2      TYR  69  -8.539  -8.693  -2.092
  569    HH   TYR  69           HH       TYR  69  -6.711 -11.268  -3.255
  570    H    SER  70           HN       SER  70 -10.318  -4.173  -6.082
  571    HA   SER  70           HA       SER  70  -9.996  -2.116  -8.100
  572    HB2  SER  70           HB2      SER  70 -12.193  -2.657  -7.096
  573    HB3  SER  70           HB1      SER  70 -11.615  -2.062  -5.540
  574    HG   SER  70           HG       SER  70 -12.111  -0.615  -7.915
  575    H    LEU  71           HN       LEU  71  -7.850  -1.417  -7.922
  576    HA   LEU  71           HA       LEU  71  -7.342   0.248  -5.496
  577    HB2  LEU  71           HB2      LEU  71  -5.459  -1.391  -7.177
  578    HB3  LEU  71           HB1      LEU  71  -4.878  -0.066  -6.188
  579    HG   LEU  71           HG       LEU  71  -5.908  -1.225  -4.200
  580   HD11  LEU  71          HD11      LEU  71  -7.480  -2.698  -5.096
  581   HD12  LEU  71          HD12      LEU  71  -6.158  -3.742  -4.573
  582   HD13  LEU  71          HD13      LEU  71  -6.342  -3.338  -6.280
  583   HD21  LEU  71          HD21      LEU  71  -3.562  -1.334  -4.450
  584   HD22  LEU  71          HD22      LEU  71  -3.683  -2.504  -5.763
  585   HD23  LEU  71          HD23      LEU  71  -4.099  -2.980  -4.116
  586    H    LEU  72           HN       LEU  72  -5.731   0.008  -8.681
  587    HA   LEU  72           HA       LEU  72  -6.505   2.843  -9.170
  588    HB2  LEU  72           HB2      LEU  72  -3.791   1.568  -9.433
  589    HB3  LEU  72           HB1      LEU  72  -4.212   3.022 -10.315
  590    HG   LEU  72           HG       LEU  72  -2.990   3.682  -8.382
  591   HD11  LEU  72          HD11      LEU  72  -4.548   5.132  -7.246
  592   HD12  LEU  72          HD12      LEU  72  -5.909   4.165  -7.814
  593   HD13  LEU  72          HD13      LEU  72  -4.931   5.073  -8.967
  594   HD21  LEU  72          HD21      LEU  72  -4.969   2.288  -6.603
  595   HD22  LEU  72          HD22      LEU  72  -3.418   3.002  -6.171
  596   HD23  LEU  72          HD23      LEU  72  -3.471   1.528  -7.137
  597    H    GLU  73           HN       GLU  73  -7.980   2.641 -10.743
  598    HA   GLU  73           HA       GLU  73  -7.049   1.706 -13.332
  599    HB2  GLU  73           HB2      GLU  73  -8.941   0.090 -13.652
  600    HB3  GLU  73           HB1      GLU  73  -7.694  -0.448 -12.539
  601    HG2  GLU  73           HG2      GLU  73 -10.231   0.848 -11.591
  602    HG3  GLU  73           HG1      GLU  73 -10.111  -0.882 -11.895
  Start of MODEL   16
    1    H1   SER   1           HT1      SER   1   1.362  16.827   4.463
    2    H2   SER   1           HT2      SER   1   0.531  16.828   5.936
    3    H3   SER   1           HT3      SER   1  -0.308  17.096   4.492
    4    HA   SER   1           HA       SER   1  -0.681  14.862   5.323
    5    HB2  SER   1           HB2      SER   1   0.963  15.013   2.781
    6    HB3  SER   1           HB1      SER   1  -0.057  13.651   3.241
    7    HG   SER   1           HG       SER   1  -1.844  14.887   2.970
    8    H    ASP   2           HN       ASP   2   0.045  13.271   6.563
    9    HA   ASP   2           HA       ASP   2   2.998  12.788   6.575
   10    HB2  ASP   2           HB2      ASP   2   1.081  12.674   8.920
   11    HB3  ASP   2           HB1      ASP   2   2.784  12.231   8.976
   12    H    VAL   3           HN       VAL   3   3.078  11.011   5.258
   13    HA   VAL   3           HA       VAL   3   1.153   8.875   5.439
   14    HB   VAL   3           HB       VAL   3   2.456   9.422   3.388
   15   HG11  VAL   3          HG11      VAL   3   4.638   9.778   4.474
   16   HG12  VAL   3          HG12      VAL   3   4.728   8.637   3.133
   17   HG13  VAL   3          HG13      VAL   3   4.741   8.048   4.794
   18   HG21  VAL   3          HG21      VAL   3   2.690   6.586   4.385
   19   HG22  VAL   3          HG22      VAL   3   2.809   7.091   2.700
   20   HG23  VAL   3          HG23      VAL   3   1.295   7.301   3.578
   21    H    TRP   4           HN       TRP   4   4.356   9.448   6.872
   22    HA   TRP   4           HA       TRP   4   4.484   6.720   7.892
   23    HB2  TRP   4           HB2      TRP   4   6.381   8.647   7.356
   24    HB3  TRP   4           HB1      TRP   4   6.307   8.657   9.115
   25    HD1  TRP   4           HD1      TRP   4   6.131   5.716   9.908
   26    HE1  TRP   4           HE1      TRP   4   7.995   3.995   9.365
   27    HE3  TRP   4           HE3      TRP   4   8.332   8.198   6.014
   28    HZ2  TRP   4           HZ2      TRP   4  10.111   3.783   7.497
   29    HZ3  TRP   4           HZ3      TRP   4  10.271   7.167   4.905
   30    HH2  TRP   4           HH2      TRP   4  11.142   5.004   5.633
   31    H    SER   5           HN       SER   5   3.882   9.984   9.218
   32    HA   SER   5           HA       SER   5   3.658   9.198  11.939
   33    HB2  SER   5           HB2      SER   5   3.777  11.558  11.155
   34    HB3  SER   5           HB1      SER   5   2.138  11.408  10.523
   35    HG   SER   5           HG       SER   5   1.357  11.544  12.489
   36    H    LEU   6           HN       LEU   6   1.122   9.636   9.441
   37    HA   LEU   6           HA       LEU   6  -0.768   8.165  11.186
   38    HB2  LEU   6           HB2      LEU   6  -1.186   9.719   8.630
   39    HB3  LEU   6           HB1      LEU   6  -2.459   8.873   9.489
   40    HG   LEU   6           HG       LEU   6  -0.841  11.157  10.625
   41   HD11  LEU   6          HD11      LEU   6  -2.256  11.932   8.819
   42   HD12  LEU   6          HD12      LEU   6  -2.906  12.462  10.372
   43   HD13  LEU   6          HD13      LEU   6  -3.646  11.104   9.523
   44   HD21  LEU   6          HD21      LEU   6  -1.638   9.641  12.344
   45   HD22  LEU   6          HD22      LEU   6  -3.268   9.707  11.676
   46   HD23  LEU   6          HD23      LEU   6  -2.550  11.149  12.391
   47    H    SER   7           HN       SER   7   0.004   6.080  11.011
   48    HA   SER   7           HA       SER   7  -0.301   4.876   8.291
   49    HB2  SER   7           HB2      SER   7   1.639   4.151  10.496
   50    HB3  SER   7           HB1      SER   7   1.392   3.188   9.041
   51    HG   SER   7           HG       SER   7   2.672   4.504   8.039
   52    H    LYS   8           HN       LYS   8  -2.073   5.194  10.891
   53    HA   LYS   8           HA       LYS   8  -2.718   2.307  11.161
   54    HB2  LYS   8           HB2      LYS   8  -3.548   4.675  12.846
   55    HB3  LYS   8           HB1      LYS   8  -4.009   3.008  13.149
   56    HG2  LYS   8           HG2      LYS   8  -1.221   4.142  13.233
   57    HG3  LYS   8           HG1      LYS   8  -2.202   3.641  14.612
   58    HD2  LYS   8           HD2      LYS   8  -1.292   1.801  12.399
   59    HD3  LYS   8           HD1      LYS   8  -0.474   1.976  13.951
   60    HE2  LYS   8           HE2      LYS   8  -2.494   1.227  15.104
   61    HE3  LYS   8           HE1      LYS   8  -3.325   1.068  13.557
   62    HZ1  LYS   8           HZ1      LYS   8  -1.714  -0.619  12.911
   63    HZ2  LYS   8           HZ2      LYS   8  -2.510  -1.063  14.335
   64    HZ3  LYS   8           HZ3      LYS   8  -0.927  -0.471  14.402
   65    H    THR   9           HN       THR   9  -3.431   3.871   8.783
   66    HA   THR   9           HA       THR   9  -6.400   3.769   9.059
   67    HB   THR   9           HB       THR   9  -5.861   6.029   8.594
   68    HG1  THR   9           HG1      THR   9  -7.486   5.746   7.238
   69   HG21  THR   9          HG21      THR   9  -4.421   6.742   6.747
   70   HG22  THR   9          HG22      THR   9  -4.088   5.059   6.345
   71   HG23  THR   9          HG23      THR   9  -3.536   5.725   7.882
   72    H    SER  10           HN       SER  10  -7.052   1.859   8.310
   73    HA   SER  10           HA       SER  10  -5.661   0.645   6.017
   74    HB2  SER  10           HB2      SER  10  -7.165  -1.282   6.441
   75    HB3  SER  10           HB1      SER  10  -6.267  -0.805   7.879
   76    HG   SER  10           HG       SER  10  -8.988  -0.614   7.330
   77    H    MET  11           HN       MET  11  -6.995  -0.392   4.270
   78    HA   MET  11           HA       MET  11  -9.370   1.259   3.584
   79    HB2  MET  11           HB2      MET  11  -7.515   2.271   2.388
   80    HB3  MET  11           HB1      MET  11  -7.019   0.701   1.768
   81    HG2  MET  11           HG2      MET  11  -8.918   0.544   0.372
   82    HG3  MET  11           HG1      MET  11  -9.696   1.916   1.157
   83    HE1  MET  11           HE1      MET  11  -8.912   4.441   0.847
   84    HE2  MET  11           HE2      MET  11  -7.475   4.906  -0.061
   85    HE3  MET  11           HE3      MET  11  -7.313   3.983   1.432
   86    H    THR  12           HN       THR  12 -11.021   0.195   2.618
   87    HA   THR  12           HA       THR  12 -10.725  -2.725   2.488
   88    HB   THR  12           HB       THR  12 -13.175  -0.993   2.086
   89    HG1  THR  12           HG1      THR  12 -12.755  -0.861   4.210
   90   HG21  THR  12          HG21      THR  12 -14.418  -3.112   2.425
   91   HG22  THR  12          HG22      THR  12 -12.888  -3.988   2.385
   92   HG23  THR  12          HG23      THR  12 -13.447  -3.120   0.953
   93    H    PHE  13           HN       PHE  13 -10.161  -3.757   0.738
   94    HA   PHE  13           HA       PHE  13 -10.500  -2.468  -1.902
   95    HB2  PHE  13           HB2      PHE  13  -8.876  -4.772  -0.869
   96    HB3  PHE  13           HB1      PHE  13  -9.155  -4.580  -2.593
   97    HD1  PHE  13           HD2      PHE  13  -8.963  -1.704  -2.979
   98    HD2  PHE  13           HD1      PHE  13  -6.661  -4.283  -0.499
   99    HE1  PHE  13           HE2      PHE  13  -7.072  -0.137  -3.112
  100    HE2  PHE  13           HE1      PHE  13  -4.770  -2.723  -0.628
  101    HZ   PHE  13           HZ       PHE  13  -4.970  -0.645  -1.936
  102    H    GLN  14           HN       GLN  14 -11.605  -3.364  -3.613
  103    HA   GLN  14           HA       GLN  14 -13.476  -5.544  -2.818
  104    HB2  GLN  14           HB2      GLN  14 -14.596  -3.373  -3.154
  105    HB3  GLN  14           HB1      GLN  14 -13.945  -3.292  -4.783
  106    HG2  GLN  14           HG2      GLN  14 -15.188  -5.360  -5.335
  107    HG3  GLN  14           HG1      GLN  14 -15.905  -5.316  -3.726
  108   HE21  GLN  14          HE21      GLN  14 -15.790  -3.861  -6.896
  109   HE22  GLN  14          HE22      GLN  14 -17.267  -2.856  -6.699
  110    HA   PRO  15           HA       PRO  15 -11.194  -7.813  -5.951
  111    HB2  PRO  15           HB2      PRO  15 -13.426  -9.719  -5.573
  112    HB3  PRO  15           HB1      PRO  15 -11.686  -9.979  -5.438
  113    HG2  PRO  15           HG2      PRO  15 -13.234  -9.888  -3.269
  114    HG3  PRO  15           HG1      PRO  15 -11.598  -9.201  -3.266
  115    HD2  PRO  15           HD2      PRO  15 -14.237  -7.812  -3.465
  116    HD3  PRO  15           HD1      PRO  15 -12.774  -7.333  -2.581
  117    H    LYS  16           HN       LYS  16 -11.399  -8.260  -8.123
  118    HA   LYS  16           HA       LYS  16 -13.620  -6.941  -9.449
  119    HB2  LYS  16           HB2      LYS  16 -11.311  -8.570 -10.525
  120    HB3  LYS  16           HB1      LYS  16 -12.474  -7.724 -11.533
  121    HG2  LYS  16           HG2      LYS  16 -10.629  -6.438  -9.530
  122    HG3  LYS  16           HG1      LYS  16 -10.392  -6.474 -11.278
  123    HD2  LYS  16           HD2      LYS  16 -12.505  -5.234 -11.561
  124    HD3  LYS  16           HD1      LYS  16 -12.680  -5.162  -9.806
  125    HE2  LYS  16           HE2      LYS  16 -10.513  -3.965  -9.690
  126    HE3  LYS  16           HE1      LYS  16 -10.460  -3.953 -11.451
  127    HZ1  LYS  16           HZ1      LYS  16 -12.552  -2.675  -9.772
  128    HZ2  LYS  16           HZ2      LYS  16 -12.513  -2.669 -11.462
  129    HZ3  LYS  16           HZ3      LYS  16 -11.307  -1.869 -10.586
  130    H    LYS  17           HN       LYS  17 -12.561 -10.296  -8.907
  131    HA   LYS  17           HA       LYS  17 -15.127 -11.208 -10.124
  132    HB2  LYS  17           HB2      LYS  17 -12.580 -12.787  -9.725
  133    HB3  LYS  17           HB1      LYS  17 -14.043 -13.360 -10.512
  134    HG2  LYS  17           HG2      LYS  17 -12.765 -12.831 -12.328
  135    HG3  LYS  17           HG1      LYS  17 -13.631 -11.311 -12.093
  136    HD2  LYS  17           HD2      LYS  17 -11.673 -10.507 -10.750
  137    HD3  LYS  17           HD1      LYS  17 -10.817 -11.973 -11.229
  138    HE2  LYS  17           HE2      LYS  17 -11.110 -11.335 -13.592
  139    HE3  LYS  17           HE1      LYS  17 -11.898  -9.846 -13.075
  140    HZ1  LYS  17           HZ1      LYS  17  -9.613  -9.397 -13.564
  141    HZ2  LYS  17           HZ2      LYS  17  -9.087 -10.640 -12.547
  142    HZ3  LYS  17           HZ3      LYS  17  -9.825  -9.268 -11.890
  143    H    ALA  18           HN       ALA  18 -15.962 -13.307  -9.190
  144    HA   ALA  18           HA       ALA  18 -16.454 -12.914  -6.393
  145    HB1  ALA  18           HB1      ALA  18 -18.078 -13.939  -7.912
  146    HB2  ALA  18           HB2      ALA  18 -17.736 -14.978  -6.529
  147    HB3  ALA  18           HB3      ALA  18 -17.019 -15.336  -8.100
  148    H    SER  19           HN       SER  19 -14.349 -15.138  -8.207
  149    HA   SER  19           HA       SER  19 -13.609 -16.863  -6.123
  150    HB2  SER  19           HB2      SER  19 -12.959 -17.172  -8.486
  151    HB3  SER  19           HB1      SER  19 -11.836 -15.820  -8.348
  152    HG   SER  19           HG       SER  19 -10.494 -17.028  -7.205
  153    H    LEU  20           HN       LEU  20 -12.261 -13.673  -6.978
  154    HA   LEU  20           HA       LEU  20 -10.191 -13.750  -4.986
  155    HB2  LEU  20           HB2      LEU  20 -11.495 -11.408  -6.366
  156    HB3  LEU  20           HB1      LEU  20 -10.021 -11.328  -5.430
  157    HG   LEU  20           HG       LEU  20 -10.337 -12.971  -7.941
  158   HD11  LEU  20          HD11      LEU  20  -9.053 -10.270  -7.569
  159   HD12  LEU  20          HD12      LEU  20 -10.561 -10.589  -8.424
  160   HD13  LEU  20          HD13      LEU  20  -9.041 -11.230  -9.047
  161   HD21  LEU  20          HD21      LEU  20  -7.915 -13.125  -7.869
  162   HD22  LEU  20          HD22      LEU  20  -8.612 -13.766  -6.381
  163   HD23  LEU  20          HD23      LEU  20  -7.877 -12.163  -6.392
  164    H    GLN  21           HN       GLN  21 -10.007 -12.488  -3.056
  165    HA   GLN  21           HA       GLN  21 -12.656 -11.991  -1.771
  166    HB2  GLN  21           HB2      GLN  21 -10.119 -13.096  -0.569
  167    HB3  GLN  21           HB1      GLN  21 -11.501 -12.573   0.385
  168    HG2  GLN  21           HG2      GLN  21 -12.898 -14.240  -0.735
  169    HG3  GLN  21           HG1      GLN  21 -11.502 -14.773  -1.671
  170   HE21  GLN  21          HE21      GLN  21  -9.870 -15.965  -0.703
  171   HE22  GLN  21          HE22      GLN  21 -10.097 -16.719   0.913
  172    HA   PRO  22           HA       PRO  22 -11.522  -7.757  -1.225
  173    HB2  PRO  22           HB2      PRO  22 -12.948  -7.992   1.373
  174    HB3  PRO  22           HB1      PRO  22 -13.206  -6.856   0.045
  175    HG2  PRO  22           HG2      PRO  22 -14.901  -8.865   0.457
  176    HG3  PRO  22           HG1      PRO  22 -14.456  -8.374  -1.187
  177    HD2  PRO  22           HD2      PRO  22 -13.515 -10.720   0.413
  178    HD3  PRO  22           HD1      PRO  22 -13.889 -10.613  -1.320
  179    H    LEU  23           HN       LEU  23 -10.156  -6.397  -0.052
  180    HA   LEU  23           HA       LEU  23  -8.636  -7.760   2.126
  181    HB2  LEU  23           HB2      LEU  23  -7.454  -7.551  -0.103
  182    HB3  LEU  23           HB1      LEU  23  -7.474  -5.818   0.145
  183    HG   LEU  23           HG       LEU  23  -6.178  -6.151   2.249
  184   HD11  LEU  23          HD11      LEU  23  -5.997  -8.993   1.260
  185   HD12  LEU  23          HD12      LEU  23  -6.816  -8.445   2.723
  186   HD13  LEU  23          HD13      LEU  23  -5.063  -8.307   2.591
  187   HD21  LEU  23          HD21      LEU  23  -4.921  -7.230  -0.269
  188   HD22  LEU  23          HD22      LEU  23  -4.052  -6.609   1.134
  189   HD23  LEU  23          HD23      LEU  23  -5.066  -5.531   0.176
  190    H    THR  24           HN       THR  24  -7.769  -6.456   3.792
  191    HA   THR  24           HA       THR  24  -8.465  -3.610   3.798
  192    HB   THR  24           HB       THR  24  -9.630  -5.400   5.940
  193    HG1  THR  24           HG1      THR  24 -11.114  -5.625   4.412
  194   HG21  THR  24          HG21      THR  24  -9.877  -2.427   5.456
  195   HG22  THR  24          HG22      THR  24  -8.981  -3.196   6.767
  196   HG23  THR  24          HG23      THR  24 -10.738  -3.338   6.696
  197    H    ILE  25           HN       ILE  25  -6.188  -3.393   3.866
  198    HA   ILE  25           HA       ILE  25  -5.091  -3.939   6.584
  199    HB   ILE  25           HB       ILE  25  -4.221  -5.532   4.846
  200   HG12  ILE  25          HG12      ILE  25  -1.973  -3.814   5.850
  201   HG13  ILE  25          HG11      ILE  25  -3.008  -4.676   6.985
  202   HG21  ILE  25          HG21      ILE  25  -4.156  -3.953   2.971
  203   HG22  ILE  25          HG22      ILE  25  -2.599  -4.739   3.226
  204   HG23  ILE  25          HG23      ILE  25  -2.845  -3.077   3.762
  205   HD11  ILE  25          HD11      ILE  25  -2.406  -6.785   5.967
  206   HD12  ILE  25          HD12      ILE  25  -0.960  -5.905   6.463
  207   HD13  ILE  25          HD13      ILE  25  -1.427  -5.947   4.763
  208    H    SER  26           HN       SER  26  -3.337  -2.540   7.272
  209    HA   SER  26           HA       SER  26  -3.520   0.130   5.949
  210    HB2  SER  26           HB2      SER  26  -4.561  -0.002   8.207
  211    HB3  SER  26           HB1      SER  26  -2.994  -0.460   8.871
  212    HG   SER  26           HG       SER  26  -2.479   1.564   8.885
  213    H    LEU  27           HN       LEU  27  -1.646   1.599   6.666
  214    HA   LEU  27           HA       LEU  27   0.769   0.655   5.526
  215    HB2  LEU  27           HB2      LEU  27   0.406   2.930   7.458
  216    HB3  LEU  27           HB1      LEU  27   1.750   2.706   6.357
  217    HG   LEU  27           HG       LEU  27  -1.109   3.326   5.615
  218   HD11  LEU  27          HD11      LEU  27   1.443   4.904   5.326
  219   HD12  LEU  27          HD12      LEU  27   0.129   5.236   6.454
  220   HD13  LEU  27          HD13      LEU  27  -0.141   5.390   4.719
  221   HD21  LEU  27          HD21      LEU  27  -0.122   1.773   3.999
  222   HD22  LEU  27          HD22      LEU  27   1.258   2.853   3.805
  223   HD23  LEU  27          HD23      LEU  27  -0.349   3.377   3.303
  224    H    ASP  28           HN       ASP  28   0.269   1.539   8.962
  225    HA   ASP  28           HA       ASP  28   2.729   0.438   9.844
  226    HB2  ASP  28           HB2      ASP  28   1.417   2.092  11.118
  227    HB3  ASP  28           HB1      ASP  28   0.180   0.876  11.416
  228    H    GLU  29           HN       GLU  29  -0.495  -0.990   9.520
  229    HA   GLU  29           HA       GLU  29   0.274  -3.427  10.902
  230    HB2  GLU  29           HB2      GLU  29  -2.056  -2.474  10.782
  231    HB3  GLU  29           HB1      GLU  29  -2.109  -2.988   9.103
  232    HG2  GLU  29           HG2      GLU  29  -3.235  -4.559  10.613
  233    HG3  GLU  29           HG1      GLU  29  -1.886  -5.298   9.752
  234    H    LEU  30           HN       LEU  30   1.291  -2.294   7.951
  235    HA   LEU  30           HA       LEU  30   1.541  -5.090   6.980
  236    HB2  LEU  30           HB2      LEU  30  -0.201  -3.970   5.687
  237    HB3  LEU  30           HB1      LEU  30   0.901  -2.669   5.289
  238    HG   LEU  30           HG       LEU  30   2.194  -4.072   3.863
  239   HD11  LEU  30          HD11      LEU  30   1.854  -6.436   3.608
  240   HD12  LEU  30          HD12      LEU  30   0.498  -6.406   4.735
  241   HD13  LEU  30          HD13      LEU  30   2.132  -6.083   5.313
  242   HD21  LEU  30          HD21      LEU  30   0.127  -3.216   2.897
  243   HD22  LEU  30          HD22      LEU  30  -0.732  -4.659   3.436
  244   HD23  LEU  30          HD23      LEU  30   0.539  -4.791   2.219
  245    H    PHE  31           HN       PHE  31   3.330  -2.778   8.259
  246    HA   PHE  31           HA       PHE  31   5.545  -3.500   6.460
  247    HB2  PHE  31           HB2      PHE  31   5.238  -0.709   7.599
  248    HB3  PHE  31           HB1      PHE  31   6.571  -1.262   6.592
  249    HD1  PHE  31           HD1      PHE  31   5.433  -2.597   4.380
  250    HD2  PHE  31           HD2      PHE  31   3.916   0.776   6.479
  251    HE1  PHE  31           HE1      PHE  31   4.193  -1.909   2.371
  252    HE2  PHE  31           HE2      PHE  31   2.671   1.468   4.476
  253    HZ   PHE  31           HZ       PHE  31   2.806   0.124   2.420
  254    H    SER  32           HN       SER  32   7.525  -3.959   7.381
  255    HA   SER  32           HA       SER  32   7.666  -3.667  10.335
  256    HB2  SER  32           HB2      SER  32   8.405  -6.125   8.752
  257    HB3  SER  32           HB1      SER  32   8.642  -5.919  10.487
  258    HG   SER  32           HG       SER  32   6.374  -6.547   9.095
  259    H    SER  33           HN       SER  33   8.927  -2.319   7.832
  260    HA   SER  33           HA       SER  33  11.645  -2.256   8.913
  261    HB2  SER  33           HB2      SER  33  11.140  -3.165   6.071
  262    HB3  SER  33           HB1      SER  33  12.718  -2.744   6.731
  263    HG   SER  33           HG       SER  33  12.697  -4.528   7.968
  264    H    ARG  34           HN       ARG  34  12.519  -0.275   8.777
  265    HA   ARG  34           HA       ARG  34  10.950   1.869   7.742
  266    HB2  ARG  34           HB2      ARG  34  12.958   3.268   8.168
  267    HB3  ARG  34           HB1      ARG  34  12.513   2.261   9.538
  268    HG2  ARG  34           HG2      ARG  34  14.287   0.684   8.961
  269    HG3  ARG  34           HG1      ARG  34  14.731   1.691   7.580
  270    HD2  ARG  34           HD2      ARG  34  15.288   3.527   9.066
  271    HD3  ARG  34           HD1      ARG  34  14.768   2.584  10.461
  272    HE   ARG  34           HE       ARG  34  16.701   1.010   9.281
  273   HH11  ARG  34          HH11      ARG  34  16.582   4.347  10.466
  274   HH12  ARG  34          HH12      ARG  34  18.258   4.379  10.900
  275   HH21  ARG  34          HH21      ARG  34  18.906   1.100   9.874
  276   HH22  ARG  34          HH22      ARG  34  19.575   2.541  10.564
  277    H    GLY  35           HN       GLY  35  13.731   0.081   6.415
  278    HA2  GLY  35           HA2      GLY  35  14.031   1.769   4.101
  279    HA3  GLY  35           HA1      GLY  35  14.657   0.140   4.288
  280    H    GLU  36           HN       GLU  36  12.185  -1.210   4.755
  281    HA   GLU  36           HA       GLU  36  11.361  -1.686   2.080
  282    HB2  GLU  36           HB2      GLU  36  11.074  -3.306   3.924
  283    HB3  GLU  36           HB1      GLU  36   9.856  -2.263   4.643
  284    HG2  GLU  36           HG2      GLU  36   8.858  -4.130   3.439
  285    HG3  GLU  36           HG1      GLU  36   8.409  -2.581   2.727
  286    H    PHE  37           HN       PHE  37  10.031   0.362   4.660
  287    HA   PHE  37           HA       PHE  37   7.633   1.149   3.408
  288    HB2  PHE  37           HB2      PHE  37   8.440   1.678   5.768
  289    HB3  PHE  37           HB1      PHE  37   9.393   2.975   5.057
  290    HD1  PHE  37           HD1      PHE  37   8.282   4.920   4.049
  291    HD2  PHE  37           HD2      PHE  37   6.079   1.866   6.030
  292    HE1  PHE  37           HE1      PHE  37   6.340   6.423   4.200
  293    HE2  PHE  37           HE2      PHE  37   4.132   3.362   6.182
  294    HZ   PHE  37           HZ       PHE  37   4.261   5.645   5.267
  295    H    ILE  38           HN       ILE  38  10.928   2.506   3.157
  296    HA   ILE  38           HA       ILE  38  10.383   4.642   1.434
  297    HB   ILE  38           HB       ILE  38  12.832   2.871   1.492
  298   HG12  ILE  38          HG12      ILE  38  12.414   3.862   3.657
  299   HG13  ILE  38          HG11      ILE  38  13.758   4.710   2.903
  300   HG21  ILE  38          HG21      ILE  38  13.989   4.846   0.526
  301   HG22  ILE  38          HG22      ILE  38  12.414   5.603   0.286
  302   HG23  ILE  38          HG23      ILE  38  12.814   4.111  -0.565
  303   HD11  ILE  38          HD11      ILE  38  12.251   6.248   4.024
  304   HD12  ILE  38          HD12      ILE  38  10.910   5.680   3.028
  305   HD13  ILE  38          HD13      ILE  38  12.263   6.533   2.283
  306    H    SER  39           HN       SER  39  11.337   1.273   0.529
  307    HA   SER  39           HA       SER  39  11.244   1.721  -2.267
  308    HB2  SER  39           HB2      SER  39  12.245  -0.295  -1.257
  309    HB3  SER  39           HB1      SER  39  10.653  -0.856  -0.752
  310    HG   SER  39           HG       SER  39  10.611  -1.784  -2.633
  311    H    VAL  40           HN       VAL  40   8.749  -0.098  -0.366
  312    HA   VAL  40           HA       VAL  40   6.784  -0.388  -2.114
  313    HB   VAL  40           HB       VAL  40   5.077  -0.016  -0.358
  314   HG11  VAL  40          HG11      VAL  40   6.276  -2.130  -0.528
  315   HG12  VAL  40          HG12      VAL  40   5.910  -1.745   1.154
  316   HG13  VAL  40          HG13      VAL  40   7.543  -1.508   0.529
  317   HG21  VAL  40          HG21      VAL  40   7.409   0.898   1.318
  318   HG22  VAL  40          HG22      VAL  40   5.759   0.635   1.881
  319   HG23  VAL  40          HG23      VAL  40   6.103   1.927   0.732
  320    H    GLY  41           HN       GLY  41   7.493   2.889  -0.754
  321    HA2  GLY  41           HA2      GLY  41   6.980   4.572  -2.595
  322    HA3  GLY  41           HA1      GLY  41   5.360   3.893  -2.574
  323    H    GLY  42           HN       GLY  42   7.542   4.575   0.182
  324    HA2  GLY  42           HA2      GLY  42   5.442   6.471   1.150
  325    HA3  GLY  42           HA1      GLY  42   6.326   5.388   2.204
  326    H    ASP  43           HN       ASP  43   6.345   8.358   0.422
  327    HA   ASP  43           HA       ASP  43   9.059   9.019   1.373
  328    HB2  ASP  43           HB2      ASP  43   7.070  10.572  -0.299
  329    HB3  ASP  43           HB1      ASP  43   8.666  11.172   0.143
  330    H    GLY  44           HN       GLY  44   6.131  11.089   1.309
  331    HA2  GLY  44           HA2      GLY  44   6.049  11.189   4.240
  332    HA3  GLY  44           HA1      GLY  44   6.641  12.657   3.479
  333    H    ARG  45           HN       ARG  45   5.232  13.524   1.664
  334    HA   ARG  45           HA       ARG  45   2.512  13.684   2.737
  335    HB2  ARG  45           HB2      ARG  45   4.031  15.156   0.600
  336    HB3  ARG  45           HB1      ARG  45   2.292  15.349   0.768
  337    HG2  ARG  45           HG2      ARG  45   3.542  17.117   1.916
  338    HG3  ARG  45           HG1      ARG  45   2.562  16.158   3.024
  339    HD2  ARG  45           HD2      ARG  45   4.497  14.925   3.747
  340    HD3  ARG  45           HD1      ARG  45   5.509  15.743   2.560
  341    HE   ARG  45           HE       ARG  45   4.850  17.876   3.852
  342   HH11  ARG  45          HH11      ARG  45   5.240  14.682   5.351
  343   HH12  ARG  45          HH12      ARG  45   5.645  15.334   6.902
  344   HH21  ARG  45          HH21      ARG  45   5.389  18.677   5.910
  345   HH22  ARG  45          HH22      ARG  45   5.731  17.597   7.219
  346    H    MET  46           HN       MET  46   1.517  11.737   2.329
  347    HA   MET  46           HA       MET  46   1.500  10.714  -0.425
  348    HB2  MET  46           HB2      MET  46   1.486   9.401   1.882
  349    HB3  MET  46           HB1      MET  46  -0.254   9.595   1.716
  350    HG2  MET  46           HG2      MET  46  -0.136   7.681   0.575
  351    HG3  MET  46           HG1      MET  46   0.404   8.699  -0.753
  352    HE1  MET  46           HE1      MET  46   4.293   8.296  -0.582
  353    HE2  MET  46           HE2      MET  46   3.353   9.537   0.248
  354    HE3  MET  46           HE3      MET  46   2.935   9.070  -1.401
  355    H    SER  47           HN       SER  47  -0.646  10.047  -1.400
  356    HA   SER  47           HA       SER  47  -2.384  12.418  -1.306
  357    HB2  SER  47           HB2      SER  47  -1.634  11.548  -3.485
  358    HB3  SER  47           HB1      SER  47  -2.454  10.026  -3.157
  359    HG   SER  47           HG       SER  47  -3.547  12.559  -3.695
  360    H    HIS  48           HN       HIS  48  -3.143   8.942  -1.661
  361    HA   HIS  48           HA       HIS  48  -4.837   8.626   0.606
  362    HB2  HIS  48           HB2      HIS  48  -6.244  10.353  -0.363
  363    HB3  HIS  48           HB1      HIS  48  -6.229   9.523  -1.915
  364    HD1  HIS  48           HD1      HIS  48  -8.079   9.797   1.232
  365    HD2  HIS  48           HD2      HIS  48  -7.646   6.958  -1.826
  366    HE1  HIS  48           HE1      HIS  48 -10.023   8.186   1.468
  367    HE2  HIS  48           HE2      HIS  48  -9.693   6.399  -0.309
  368    H    LYS  49           HN       LYS  49  -4.907   7.942  -2.921
  369    HA   LYS  49           HA       LYS  49  -5.476   5.114  -2.406
  370    HB2  LYS  49           HB2      LYS  49  -6.323   6.365  -4.377
  371    HB3  LYS  49           HB1      LYS  49  -4.671   6.537  -4.952
  372    HG2  LYS  49           HG2      LYS  49  -5.694   4.754  -6.137
  373    HG3  LYS  49           HG1      LYS  49  -4.505   4.062  -5.039
  374    HD2  LYS  49           HD2      LYS  49  -7.287   4.310  -4.041
  375    HD3  LYS  49           HD1      LYS  49  -6.988   3.098  -5.286
  376    HE2  LYS  49           HE2      LYS  49  -5.448   3.322  -2.701
  377    HE3  LYS  49           HE1      LYS  49  -6.795   2.219  -2.971
  378    HZ1  LYS  49           HZ1      LYS  49  -4.227   2.216  -4.468
  379    HZ2  LYS  49           HZ2      LYS  49  -5.524   1.166  -4.744
  380    HZ3  LYS  49           HZ3      LYS  49  -4.684   1.103  -3.278
  381    H    GLU  50           HN       GLU  50  -2.663   7.158  -2.905
  382    HA   GLU  50           HA       GLU  50  -0.841   5.169  -3.801
  383    HB2  GLU  50           HB2      GLU  50  -0.444   7.766  -2.321
  384    HB3  GLU  50           HB1      GLU  50   0.886   6.787  -2.916
  385    HG2  GLU  50           HG2      GLU  50  -0.007   7.015  -5.202
  386    HG3  GLU  50           HG1      GLU  50  -1.272   8.069  -4.573
  387    H    ALA  51           HN       ALA  51  -1.381   6.501  -0.499
  388    HA   ALA  51           HA       ALA  51   0.557   5.043   0.854
  389    HB1  ALA  51           HB1      ALA  51  -0.834   5.282   2.867
  390    HB2  ALA  51           HB2      ALA  51  -2.207   5.732   1.857
  391    HB3  ALA  51           HB3      ALA  51  -0.785   6.771   1.925
  392    H    ILE  52           HN       ILE  52  -2.879   3.935   0.460
  393    HA   ILE  52           HA       ILE  52  -2.323   1.459   1.705
  394    HB   ILE  52           HB       ILE  52  -4.424   2.004  -0.425
  395   HG12  ILE  52          HG12      ILE  52  -4.552   3.517   1.530
  396   HG13  ILE  52          HG11      ILE  52  -5.936   2.441   1.431
  397   HG21  ILE  52          HG21      ILE  52  -4.041  -0.384  -0.098
  398   HG22  ILE  52          HG22      ILE  52  -5.622   0.099   0.514
  399   HG23  ILE  52          HG23      ILE  52  -4.294  -0.193   1.637
  400   HD11  ILE  52          HD11      ILE  52  -4.914   1.010   3.149
  401   HD12  ILE  52          HD12      ILE  52  -5.199   2.655   3.715
  402   HD13  ILE  52          HD13      ILE  52  -3.571   2.148   3.267
  403    H    LEU  53           HN       LEU  53  -2.208   2.423  -1.740
  404    HA   LEU  53           HA       LEU  53  -1.877  -0.126  -2.850
  405    HB2  LEU  53           HB2      LEU  53  -2.140   2.060  -4.081
  406    HB3  LEU  53           HB1      LEU  53  -0.467   2.461  -3.763
  407    HG   LEU  53           HG       LEU  53   0.204   0.438  -5.074
  408   HD11  LEU  53          HD11      LEU  53  -2.733   0.374  -5.753
  409   HD12  LEU  53          HD12      LEU  53  -1.835  -0.856  -4.863
  410   HD13  LEU  53          HD13      LEU  53  -1.474  -0.558  -6.563
  411   HD21  LEU  53          HD21      LEU  53  -1.437   2.573  -6.427
  412   HD22  LEU  53          HD22      LEU  53  -0.371   1.457  -7.276
  413   HD23  LEU  53          HD23      LEU  53   0.298   2.597  -6.109
  414    H    LEU  54           HN       LEU  54   0.542   1.778  -1.029
  415    HA   LEU  54           HA       LEU  54   2.979   0.692  -1.847
  416    HB2  LEU  54           HB2      LEU  54   1.823   1.537   0.813
  417    HB3  LEU  54           HB1      LEU  54   3.343   0.676   0.828
  418    HG   LEU  54           HG       LEU  54   4.338   2.374  -0.634
  419   HD11  LEU  54          HD11      LEU  54   2.322   3.042  -1.838
  420   HD12  LEU  54          HD12      LEU  54   3.138   4.432  -1.126
  421   HD13  LEU  54          HD13      LEU  54   1.688   3.780  -0.368
  422   HD21  LEU  54          HD21      LEU  54   4.378   4.201   0.996
  423   HD22  LEU  54          HD22      LEU  54   4.512   2.628   1.782
  424   HD23  LEU  54          HD23      LEU  54   2.981   3.501   1.811
  425    H    GLY  55           HN       GLY  55   0.375  -0.876   0.093
  426    HA2  GLY  55           HA2      GLY  55   1.679  -3.051   1.206
  427    HA3  GLY  55           HA1      GLY  55   0.037  -3.105   0.595
  428    H    LEU  56           HN       LEU  56   0.392  -2.883  -2.141
  429    HA   LEU  56           HA       LEU  56   0.934  -5.506  -2.915
  430    HB2  LEU  56           HB2      LEU  56   1.385  -3.098  -4.667
  431    HB3  LEU  56           HB1      LEU  56   1.023  -4.734  -5.187
  432    HG   LEU  56           HG       LEU  56  -0.828  -2.772  -3.849
  433   HD11  LEU  56          HD11      LEU  56  -2.204  -3.398  -5.890
  434   HD12  LEU  56          HD12      LEU  56  -0.735  -4.143  -6.519
  435   HD13  LEU  56          HD13      LEU  56  -0.769  -2.417  -6.166
  436   HD21  LEU  56          HD21      LEU  56  -1.183  -5.733  -4.267
  437   HD22  LEU  56          HD22      LEU  56  -2.520  -4.620  -3.978
  438   HD23  LEU  56          HD23      LEU  56  -1.271  -4.838  -2.752
  439    H    ARG  57           HN       ARG  57   3.177  -2.725  -2.938
  440    HA   ARG  57           HA       ARG  57   5.361  -4.172  -4.089
  441    HB2  ARG  57           HB2      ARG  57   5.261  -1.688  -2.382
  442    HB3  ARG  57           HB1      ARG  57   6.756  -2.321  -3.052
  443    HG2  ARG  57           HG2      ARG  57   6.164  -0.718  -4.594
  444    HG3  ARG  57           HG1      ARG  57   5.510  -2.186  -5.320
  445    HD2  ARG  57           HD2      ARG  57   3.303  -1.654  -4.582
  446    HD3  ARG  57           HD1      ARG  57   3.897  -0.322  -3.592
  447    HE   ARG  57           HE       ARG  57   4.365  -0.187  -6.506
  448   HH11  ARG  57          HH11      ARG  57   2.502   0.911  -3.698
  449   HH12  ARG  57          HH12      ARG  57   1.898   2.319  -4.501
  450   HH21  ARG  57          HH21      ARG  57   3.546   1.676  -7.519
  451   HH22  ARG  57          HH22      ARG  57   2.488   2.753  -6.670
  452    H    TYR  58           HN       TYR  58   4.144  -3.886  -0.805
  453    HA   TYR  58           HA       TYR  58   6.505  -4.979   0.461
  454    HB2  TYR  58           HB2      TYR  58   4.788  -3.571   1.619
  455    HB3  TYR  58           HB1      TYR  58   3.660  -4.914   1.493
  456    HD1  TYR  58           HD2      TYR  58   6.773  -3.755   3.087
  457    HD2  TYR  58           HD1      TYR  58   3.803  -6.796   2.964
  458    HE1  TYR  58           HE2      TYR  58   7.632  -4.668   5.200
  459    HE2  TYR  58           HE1      TYR  58   4.649  -7.718   5.079
  460    HH   TYR  58           HH       TYR  58   6.866  -7.693   6.349
  461    H    LYS  59           HN       LYS  59   3.305  -6.283  -0.426
  462    HA   LYS  59           HA       LYS  59   3.908  -8.974   0.405
  463    HB2  LYS  59           HB2      LYS  59   1.778  -7.899  -1.439
  464    HB3  LYS  59           HB1      LYS  59   1.828  -9.537  -0.810
  465    HG2  LYS  59           HG2      LYS  59   1.565  -7.037   0.845
  466    HG3  LYS  59           HG1      LYS  59   0.252  -8.132   0.412
  467    HD2  LYS  59           HD2      LYS  59   1.561  -9.962   1.557
  468    HD3  LYS  59           HD1      LYS  59   2.632  -8.700   2.169
  469    HE2  LYS  59           HE2      LYS  59   1.091  -9.023   3.897
  470    HE3  LYS  59           HE1      LYS  59   0.505  -7.589   3.057
  471    HZ1  LYS  59           HZ1      LYS  59  -0.527 -10.345   2.659
  472    HZ2  LYS  59           HZ2      LYS  59  -1.103  -8.950   1.894
  473    HZ3  LYS  59           HZ3      LYS  59  -1.287  -9.134   3.564
  474    H    LYS  60           HN       LYS  60   4.738  -7.140  -2.387
  475    HA   LYS  60           HA       LYS  60   5.941  -7.705  -4.241
  476    HB2  LYS  60           HB2      LYS  60   6.035 -10.552  -3.223
  477    HB3  LYS  60           HB1      LYS  60   7.076  -9.830  -4.441
  478    HG2  LYS  60           HG2      LYS  60   7.002  -9.182  -1.503
  479    HG3  LYS  60           HG1      LYS  60   8.288 -10.005  -2.385
  480    HD2  LYS  60           HD2      LYS  60   8.748  -7.989  -3.654
  481    HD3  LYS  60           HD1      LYS  60   7.405  -7.160  -2.867
  482    HE2  LYS  60           HE2      LYS  60   8.560  -7.529  -0.682
  483    HE3  LYS  60           HE1      LYS  60   9.942  -8.154  -1.581
  484    HZ1  LYS  60           HZ1      LYS  60   8.814  -5.411  -1.772
  485    HZ2  LYS  60           HZ2      LYS  60  10.085  -6.000  -2.721
  486    HZ3  LYS  60           HZ3      LYS  60  10.282  -5.847  -1.050
  487    H    LEU  61           HN       LEU  61   3.650  -7.221  -4.945
  488    HA   LEU  61           HA       LEU  61   3.006  -9.073  -7.042
  489    HB2  LEU  61           HB2      LEU  61   0.567  -9.388  -6.195
  490    HB3  LEU  61           HB1      LEU  61   1.834 -10.442  -5.606
  491    HG   LEU  61           HG       LEU  61   1.983  -9.124  -3.535
  492   HD11  LEU  61          HD11      LEU  61   1.284  -6.961  -4.445
  493   HD12  LEU  61          HD12      LEU  61   0.339  -7.415  -3.028
  494   HD13  LEU  61          HD13      LEU  61  -0.355  -7.580  -4.640
  495   HD21  LEU  61          HD21      LEU  61  -0.154  -9.807  -2.578
  496   HD22  LEU  61          HD22      LEU  61   0.501 -11.059  -3.632
  497   HD23  LEU  61          HD23      LEU  61  -0.815 -10.030  -4.197
  498    H    TYR  62           HN       TYR  62   3.580  -6.215  -6.652
  499    HA   TYR  62           HA       TYR  62   1.207  -4.680  -6.975
  500    HB2  TYR  62           HB2      TYR  62   3.337  -3.687  -6.336
  501    HB3  TYR  62           HB1      TYR  62   4.036  -4.127  -7.890
  502    HD1  TYR  62           HD1      TYR  62   1.121  -2.214  -6.541
  503    HD2  TYR  62           HD2      TYR  62   4.162  -2.481  -9.503
  504    HE1  TYR  62           HE1      TYR  62   0.403  -0.058  -7.466
  505    HE2  TYR  62           HE2      TYR  62   3.454  -0.320 -10.433
  506    HH   TYR  62           HH       TYR  62   1.488   1.820  -8.836
  507    H    ASN  63           HN       ASN  63   2.748  -6.842  -9.162
  508    HA   ASN  63           HA       ASN  63   2.081  -5.507 -11.608
  509    HB2  ASN  63           HB2      ASN  63   3.812  -7.225 -11.475
  510    HB3  ASN  63           HB1      ASN  63   2.602  -8.434 -11.061
  511   HD21  ASN  63          HD21      ASN  63   1.400  -9.386 -12.619
  512   HD22  ASN  63          HD22      ASN  63   1.627  -9.053 -14.371
  513    H    GLN  64           HN       GLN  64   0.560  -8.469 -10.175
  514    HA   GLN  64           HA       GLN  64  -1.798  -7.894 -11.857
  515    HB2  GLN  64           HB2      GLN  64  -0.766 -10.317 -10.471
  516    HB3  GLN  64           HB1      GLN  64  -2.491 -10.211 -10.795
  517    HG2  GLN  64           HG2      GLN  64  -1.905  -9.775 -13.199
  518    HG3  GLN  64           HG1      GLN  64  -0.240 -10.175 -12.783
  519   HE21  GLN  64          HE21      GLN  64  -3.476 -11.360 -13.266
  520   HE22  GLN  64          HE22      GLN  64  -3.050 -13.107 -13.241
  521    H    ALA  65           HN       ALA  65  -0.857  -7.193  -8.658
  522    HA   ALA  65           HA       ALA  65  -3.393  -7.770  -7.394
  523    HB1  ALA  65           HB1      ALA  65  -2.540  -6.394  -5.550
  524    HB2  ALA  65           HB2      ALA  65  -1.168  -5.924  -6.554
  525    HB3  ALA  65           HB3      ALA  65  -1.378  -7.609  -6.079
  526    H    ARG  66           HN       ARG  66  -1.969  -4.918  -8.956
  527    HA   ARG  66           HA       ARG  66  -4.090  -3.135  -8.177
  528    HB2  ARG  66           HB2      ARG  66  -1.710  -2.573  -8.968
  529    HB3  ARG  66           HB1      ARG  66  -2.336  -2.782 -10.597
  530    HG2  ARG  66           HG2      ARG  66  -3.895  -0.992 -10.300
  531    HG3  ARG  66           HG1      ARG  66  -3.488  -0.861  -8.588
  532    HD2  ARG  66           HD2      ARG  66  -2.321   0.888  -9.644
  533    HD3  ARG  66           HD1      ARG  66  -1.118  -0.361  -9.337
  534    HE   ARG  66           HE       ARG  66  -1.900  -0.964 -11.864
  535   HH11  ARG  66          HH11      ARG  66  -0.908   2.081 -10.349
  536   HH12  ARG  66          HH12      ARG  66  -0.251   2.733 -11.811
  537   HH21  ARG  66          HH21      ARG  66  -1.027  -0.064 -13.765
  538   HH22  ARG  66          HH22      ARG  66  -0.321   1.517 -13.752
  539    H    VAL  67           HN       VAL  67  -3.741  -5.481 -10.751
  540    HA   VAL  67           HA       VAL  67  -6.007  -4.296 -12.234
  541    HB   VAL  67           HB       VAL  67  -5.585  -6.024 -13.928
  542   HG11  VAL  67          HG11      VAL  67  -3.403  -5.208 -14.682
  543   HG12  VAL  67          HG12      VAL  67  -3.113  -4.521 -13.082
  544   HG13  VAL  67          HG13      VAL  67  -4.421  -3.897 -14.087
  545   HG21  VAL  67          HG21      VAL  67  -4.792  -7.832 -12.522
  546   HG22  VAL  67          HG22      VAL  67  -3.356  -6.902 -12.094
  547   HG23  VAL  67          HG23      VAL  67  -3.587  -7.456 -13.752
  548    H    LYS  68           HN       LYS  68  -5.170  -7.248 -10.421
  549    HA   LYS  68           HA       LYS  68  -7.634  -8.606 -10.968
  550    HB2  LYS  68           HB2      LYS  68  -5.523  -8.917  -8.849
  551    HB3  LYS  68           HB1      LYS  68  -6.972  -9.911  -8.850
  552    HG2  LYS  68           HG2      LYS  68  -5.042  -9.715 -11.154
  553    HG3  LYS  68           HG1      LYS  68  -5.013 -10.982  -9.924
  554    HD2  LYS  68           HD2      LYS  68  -7.323 -11.599 -10.557
  555    HD3  LYS  68           HD1      LYS  68  -7.273 -10.381 -11.833
  556    HE2  LYS  68           HE2      LYS  68  -5.418 -11.547 -12.893
  557    HE3  LYS  68           HE1      LYS  68  -5.420 -12.749 -11.603
  558    HZ1  LYS  68           HZ1      LYS  68  -7.642 -12.248 -13.510
  559    HZ2  LYS  68           HZ2      LYS  68  -7.659 -13.394 -12.266
  560    HZ3  LYS  68           HZ3      LYS  68  -6.576 -13.560 -13.554
  561    H    TYR  69           HN       TYR  69  -6.697  -6.208  -8.573
  562    HA   TYR  69           HA       TYR  69  -9.456  -6.399  -7.454
  563    HB2  TYR  69           HB2      TYR  69  -6.865  -5.699  -6.070
  564    HB3  TYR  69           HB1      TYR  69  -8.450  -5.430  -5.355
  565    HD1  TYR  69           HD1      TYR  69  -6.083  -8.017  -6.509
  566    HD2  TYR  69           HD2      TYR  69  -9.703  -7.229  -4.416
  567    HE1  TYR  69           HE1      TYR  69  -6.094 -10.327  -5.667
  568    HE2  TYR  69           HE2      TYR  69  -9.722  -9.535  -3.570
  569    HH   TYR  69           HH       TYR  69  -7.072 -11.569  -3.694
  570    H    SER  70           HN       SER  70 -10.350  -4.380  -6.594
  571    HA   SER  70           HA       SER  70 -10.006  -2.263  -8.534
  572    HB2  SER  70           HB2      SER  70 -12.192  -2.808  -7.522
  573    HB3  SER  70           HB1      SER  70 -11.589  -2.278  -5.953
  574    HG   SER  70           HG       SER  70 -12.325  -0.781  -8.182
  575    H    LEU  71           HN       LEU  71  -8.020  -1.313  -8.474
  576    HA   LEU  71           HA       LEU  71  -7.451   0.225  -5.988
  577    HB2  LEU  71           HB2      LEU  71  -5.521  -1.378  -7.654
  578    HB3  LEU  71           HB1      LEU  71  -4.987  -0.091  -6.590
  579    HG   LEU  71           HG       LEU  71  -6.240  -1.402  -4.740
  580   HD11  LEU  71          HD11      LEU  71  -7.430  -2.989  -6.053
  581   HD12  LEU  71          HD12      LEU  71  -6.188  -3.865  -5.161
  582   HD13  LEU  71          HD13      LEU  71  -5.958  -3.505  -6.872
  583   HD21  LEU  71          HD21      LEU  71  -4.237  -2.843  -4.398
  584   HD22  LEU  71          HD22      LEU  71  -3.868  -1.148  -4.709
  585   HD23  LEU  71          HD23      LEU  71  -3.670  -2.343  -5.991
  586    H    LEU  72           HN       LEU  72  -5.872  -0.039  -9.195
  587    HA   LEU  72           HA       LEU  72  -6.556   2.832  -9.638
  588    HB2  LEU  72           HB2      LEU  72  -3.933   1.420 -10.066
  589    HB3  LEU  72           HB1      LEU  72  -4.318   2.925 -10.873
  590    HG   LEU  72           HG       LEU  72  -2.965   3.448  -8.988
  591   HD11  LEU  72          HD11      LEU  72  -4.844   4.964  -9.424
  592   HD12  LEU  72          HD12      LEU  72  -4.392   4.932  -7.720
  593   HD13  LEU  72          HD13      LEU  72  -5.825   4.063  -8.268
  594   HD21  LEU  72          HD21      LEU  72  -3.356   2.740  -6.764
  595   HD22  LEU  72          HD22      LEU  72  -3.463   1.298  -7.773
  596   HD23  LEU  72          HD23      LEU  72  -4.931   2.070  -7.178
  597    H    GLU  73           HN       GLU  73  -6.097   3.450 -12.029
  598    HA   GLU  73           HA       GLU  73  -7.715   1.631 -13.626
  599    HB2  GLU  73           HB2      GLU  73  -6.323   4.207 -14.391
  600    HB3  GLU  73           HB1      GLU  73  -7.493   3.349 -15.385
  601    HG2  GLU  73           HG2      GLU  73  -9.189   3.692 -13.630
  602    HG3  GLU  73           HG1      GLU  73  -8.011   4.624 -12.708
  Start of MODEL   17
    1    H1   SER   1           HT1      SER   1  -1.853  14.073   7.664
    2    H2   SER   1           HT2      SER   1  -1.943  14.963   9.099
    3    H3   SER   1           HT3      SER   1  -0.903  13.633   8.993
    4    HA   SER   1           HA       SER   1  -0.669  16.149   7.445
    5    HB2  SER   1           HB2      SER   1   0.975  15.072   9.751
    6    HB3  SER   1           HB1      SER   1   1.399  16.489   8.791
    7    HG   SER   1           HG       SER   1  -0.602  16.160  10.702
    8    H    ASP   2           HN       ASP   2   1.302  13.351   8.547
    9    HA   ASP   2           HA       ASP   2   2.418  13.239   5.780
   10    HB2  ASP   2           HB2      ASP   2   3.617  12.711   8.478
   11    HB3  ASP   2           HB1      ASP   2   4.275  11.897   7.064
   12    H    VAL   3           HN       VAL   3   3.263  11.026   5.159
   13    HA   VAL   3           HA       VAL   3   1.040   9.190   5.245
   14    HB   VAL   3           HB       VAL   3   2.663   9.493   3.322
   15   HG11  VAL   3          HG11      VAL   3   4.715   9.306   4.756
   16   HG12  VAL   3          HG12      VAL   3   4.728   8.317   3.298
   17   HG13  VAL   3          HG13      VAL   3   4.399   7.575   4.864
   18   HG21  VAL   3          HG21      VAL   3   1.015   7.668   3.456
   19   HG22  VAL   3          HG22      VAL   3   2.219   6.666   4.266
   20   HG23  VAL   3          HG23      VAL   3   2.484   7.191   2.604
   21    H    TRP   4           HN       TRP   4   4.136   9.416   6.954
   22    HA   TRP   4           HA       TRP   4   3.939   6.739   8.031
   23    HB2  TRP   4           HB2      TRP   4   6.058   8.199   7.678
   24    HB3  TRP   4           HB1      TRP   4   5.619   8.924   9.219
   25    HD1  TRP   4           HD1      TRP   4   5.295   6.955  11.283
   26    HE1  TRP   4           HE1      TRP   4   6.879   4.967  11.815
   27    HE3  TRP   4           HE3      TRP   4   7.672   6.663   6.765
   28    HZ2  TRP   4           HZ2      TRP   4   8.873   3.509  10.435
   29    HZ3  TRP   4           HZ3      TRP   4   9.410   4.946   6.454
   30    HH2  TRP   4           HH2      TRP   4   9.995   3.405   8.253
   31    H    SER   5           HN       SER   5   3.114  10.010   9.113
   32    HA   SER   5           HA       SER   5   2.493   9.329  11.807
   33    HB2  SER   5           HB2      SER   5   1.302  11.491  10.044
   34    HB3  SER   5           HB1      SER   5   1.150  11.413  11.798
   35    HG   SER   5           HG       SER   5   2.867  12.693  11.525
   36    H    LEU   6           HN       LEU   6   0.439   9.552   8.889
   37    HA   LEU   6           HA       LEU   6  -1.739   8.182  10.363
   38    HB2  LEU   6           HB2      LEU   6  -1.737   9.364   7.580
   39    HB3  LEU   6           HB1      LEU   6  -3.136   8.768   8.452
   40    HG   LEU   6           HG       LEU   6  -1.479  11.158   9.267
   41   HD11  LEU   6          HD11      LEU   6  -4.198  11.012   7.973
   42   HD12  LEU   6          HD12      LEU   6  -2.711  11.575   7.209
   43   HD13  LEU   6          HD13      LEU   6  -3.408  12.477   8.555
   44   HD21  LEU   6          HD21      LEU   6  -3.320  11.582  10.837
   45   HD22  LEU   6          HD22      LEU   6  -2.502  10.056  11.174
   46   HD23  LEU   6          HD23      LEU   6  -4.067  10.057  10.360
   47    H    SER   7           HN       SER   7  -0.591   6.163  10.492
   48    HA   SER   7           HA       SER   7  -0.560   4.724   7.877
   49    HB2  SER   7           HB2      SER   7   1.257   3.323   8.844
   50    HB3  SER   7           HB1      SER   7   1.702   5.019   8.682
   51    HG   SER   7           HG       SER   7   1.743   5.229  10.802
   52    H    LYS   8           HN       LYS   8  -2.321   4.959  10.655
   53    HA   LYS   8           HA       LYS   8  -2.710   2.058  10.985
   54    HB2  LYS   8           HB2      LYS   8  -3.939   4.399  12.440
   55    HB3  LYS   8           HB1      LYS   8  -4.195   2.709  12.847
   56    HG2  LYS   8           HG2      LYS   8  -1.601   4.232  12.991
   57    HG3  LYS   8           HG1      LYS   8  -2.574   3.655  14.344
   58    HD2  LYS   8           HD2      LYS   8  -1.205   1.910  12.294
   59    HD3  LYS   8           HD1      LYS   8  -0.623   2.218  13.929
   60    HE2  LYS   8           HE2      LYS   8  -2.687   1.212  14.827
   61    HE3  LYS   8           HE1      LYS   8  -3.211   0.859  13.182
   62    HZ1  LYS   8           HZ1      LYS   8  -2.217  -1.082  14.171
   63    HZ2  LYS   8           HZ2      LYS   8  -0.796  -0.234  14.525
   64    HZ3  LYS   8           HZ3      LYS   8  -1.226  -0.531  12.915
   65    H    THR   9           HN       THR   9  -4.252   4.777   9.417
   66    HA   THR   9           HA       THR   9  -6.887   3.613   9.280
   67    HB   THR   9           HB       THR   9  -7.252   5.287   7.434
   68    HG1  THR   9           HG1      THR   9  -5.607   6.539   6.777
   69   HG21  THR   9          HG21      THR   9  -7.094   7.248   8.908
   70   HG22  THR   9          HG22      THR   9  -6.064   6.333  10.008
   71   HG23  THR   9          HG23      THR   9  -7.741   5.846   9.760
   72    H    SER  10           HN       SER  10  -7.151   1.645   8.411
   73    HA   SER  10           HA       SER  10  -5.612   0.843   6.052
   74    HB2  SER  10           HB2      SER  10  -7.861  -0.617   7.461
   75    HB3  SER  10           HB1      SER  10  -6.734  -1.306   6.295
   76    HG   SER  10           HG       SER  10  -5.854  -1.822   8.204
   77    H    MET  11           HN       MET  11  -6.921  -0.431   4.307
   78    HA   MET  11           HA       MET  11  -9.352   1.110   3.564
   79    HB2  MET  11           HB2      MET  11  -7.594   2.180   2.323
   80    HB3  MET  11           HB1      MET  11  -6.939   0.629   1.818
   81    HG2  MET  11           HG2      MET  11  -8.732   0.229   0.350
   82    HG3  MET  11           HG1      MET  11  -9.697   1.526   1.051
   83    HE1  MET  11           HE1      MET  11 -10.206   2.341  -1.454
   84    HE2  MET  11           HE2      MET  11  -9.166   1.079  -2.115
   85    HE3  MET  11           HE3      MET  11  -8.947   2.755  -2.619
   86    H    THR  12           HN       THR  12 -10.886   0.015   2.360
   87    HA   THR  12           HA       THR  12 -10.613  -2.906   2.511
   88    HB   THR  12           HB       THR  12 -12.986  -1.254   1.628
   89    HG1  THR  12           HG1      THR  12 -12.888  -0.815   3.734
   90   HG21  THR  12          HG21      THR  12 -13.097  -3.538   0.795
   91   HG22  THR  12          HG22      THR  12 -14.265  -3.316   2.097
   92   HG23  THR  12          HG23      THR  12 -12.751  -4.165   2.407
   93    H    PHE  13           HN       PHE  13 -10.077  -4.196   0.919
   94    HA   PHE  13           HA       PHE  13  -9.926  -3.110  -1.830
   95    HB2  PHE  13           HB2      PHE  13  -8.831  -5.594  -0.513
   96    HB3  PHE  13           HB1      PHE  13  -8.743  -5.326  -2.246
   97    HD1  PHE  13           HD1      PHE  13  -7.674  -3.990   1.030
   98    HD2  PHE  13           HD2      PHE  13  -7.071  -3.969  -3.183
   99    HE1  PHE  13           HE1      PHE  13  -5.588  -2.730   1.339
  100    HE2  PHE  13           HE2      PHE  13  -4.981  -2.706  -2.878
  101    HZ   PHE  13           HZ       PHE  13  -4.236  -2.087  -0.615
  102    H    GLN  14           HN       GLN  14 -11.050  -3.896  -3.564
  103    HA   GLN  14           HA       GLN  14 -13.172  -5.879  -2.876
  104    HB2  GLN  14           HB2      GLN  14 -14.118  -3.667  -3.258
  105    HB3  GLN  14           HB1      GLN  14 -13.295  -3.556  -4.807
  106    HG2  GLN  14           HG2      GLN  14 -14.627  -5.394  -5.670
  107    HG3  GLN  14           HG1      GLN  14 -15.421  -5.570  -4.108
  108   HE21  GLN  14          HE21      GLN  14 -16.935  -4.054  -3.421
  109   HE22  GLN  14          HE22      GLN  14 -17.672  -2.891  -4.577
  110    HA   PRO  15           HA       PRO  15 -10.786  -8.275  -5.870
  111    HB2  PRO  15           HB2      PRO  15 -13.017 -10.173  -5.374
  112    HB3  PRO  15           HB1      PRO  15 -11.274 -10.432  -5.277
  113    HG2  PRO  15           HG2      PRO  15 -12.759 -10.248  -3.070
  114    HG3  PRO  15           HG1      PRO  15 -11.127  -9.559  -3.140
  115    HD2  PRO  15           HD2      PRO  15 -13.774  -8.184  -3.315
  116    HD3  PRO  15           HD1      PRO  15 -12.284  -7.661  -2.507
  117    H    LYS  16           HN       LYS  16 -11.036  -8.825  -8.032
  118    HA   LYS  16           HA       LYS  16 -13.299  -7.571  -9.362
  119    HB2  LYS  16           HB2      LYS  16 -10.885  -9.093 -10.335
  120    HB3  LYS  16           HB1      LYS  16 -12.153  -8.573 -11.434
  121    HG2  LYS  16           HG2      LYS  16 -10.575  -6.733  -9.649
  122    HG3  LYS  16           HG1      LYS  16 -10.231  -7.031 -11.353
  123    HD2  LYS  16           HD2      LYS  16 -12.347  -6.095 -12.001
  124    HD3  LYS  16           HD1      LYS  16 -12.852  -5.959 -10.316
  125    HE2  LYS  16           HE2      LYS  16 -11.060  -4.347  -9.907
  126    HE3  LYS  16           HE1      LYS  16 -10.543  -4.489 -11.586
  127    HZ1  LYS  16           HZ1      LYS  16 -11.901  -2.532 -11.266
  128    HZ2  LYS  16           HZ2      LYS  16 -13.171  -3.464 -10.654
  129    HZ3  LYS  16           HZ3      LYS  16 -12.705  -3.628 -12.272
  130    H    LYS  17           HN       LYS  17 -12.172 -10.890  -8.742
  131    HA   LYS  17           HA       LYS  17 -14.800 -11.864  -9.767
  132    HB2  LYS  17           HB2      LYS  17 -13.686 -14.002 -10.274
  133    HB3  LYS  17           HB1      LYS  17 -12.985 -12.667 -11.173
  134    HG2  LYS  17           HG2      LYS  17 -11.701 -13.336  -8.598
  135    HG3  LYS  17           HG1      LYS  17 -11.529 -14.512  -9.900
  136    HD2  LYS  17           HD2      LYS  17 -10.925 -11.582 -10.250
  137    HD3  LYS  17           HD1      LYS  17  -9.713 -12.756  -9.732
  138    HE2  LYS  17           HE2      LYS  17 -11.311 -12.966 -12.281
  139    HE3  LYS  17           HE1      LYS  17  -9.691 -12.280 -12.177
  140    HZ1  LYS  17           HZ1      LYS  17  -8.903 -14.425 -11.333
  141    HZ2  LYS  17           HZ2      LYS  17  -9.585 -14.570 -12.874
  142    HZ3  LYS  17           HZ3      LYS  17 -10.456 -15.075 -11.515
  143    H    ALA  18           HN       ALA  18 -15.380 -14.082  -8.793
  144    HA   ALA  18           HA       ALA  18 -15.665 -13.711  -5.966
  145    HB1  ALA  18           HB1      ALA  18 -16.157 -16.188  -7.615
  146    HB2  ALA  18           HB2      ALA  18 -17.315 -14.889  -7.335
  147    HB3  ALA  18           HB3      ALA  18 -16.764 -15.883  -5.987
  148    H    SER  19           HN       SER  19 -13.425 -15.611  -7.946
  149    HA   SER  19           HA       SER  19 -12.393 -17.329  -5.977
  150    HB2  SER  19           HB2      SER  19 -11.827 -17.476  -8.371
  151    HB3  SER  19           HB1      SER  19 -10.882 -15.993  -8.239
  152    HG   SER  19           HG       SER  19 -10.128 -18.498  -7.718
  153    H    LEU  20           HN       LEU  20 -11.459 -13.976  -6.761
  154    HA   LEU  20           HA       LEU  20  -9.347 -13.911  -4.785
  155    HB2  LEU  20           HB2      LEU  20 -10.773 -11.774  -6.351
  156    HB3  LEU  20           HB1      LEU  20  -9.478 -11.423  -5.231
  157    HG   LEU  20           HG       LEU  20  -9.172 -13.234  -7.623
  158   HD11  LEU  20          HD11      LEU  20  -8.405 -10.334  -7.323
  159   HD12  LEU  20          HD12      LEU  20  -9.718 -10.954  -8.325
  160   HD13  LEU  20          HD13      LEU  20  -8.047 -11.370  -8.704
  161   HD21  LEU  20          HD21      LEU  20  -6.784 -12.927  -7.224
  162   HD22  LEU  20          HD22      LEU  20  -7.573 -13.632  -5.813
  163   HD23  LEU  20          HD23      LEU  20  -7.139 -11.923  -5.818
  164    H    GLN  21           HN       GLN  21  -9.264 -12.828  -2.814
  165    HA   GLN  21           HA       GLN  21 -11.944 -12.383  -1.581
  166    HB2  GLN  21           HB2      GLN  21  -9.359 -13.205  -0.245
  167    HB3  GLN  21           HB1      GLN  21 -10.901 -12.967   0.564
  168    HG2  GLN  21           HG2      GLN  21 -10.317 -15.052  -1.529
  169    HG3  GLN  21           HG1      GLN  21 -10.412 -15.328   0.209
  170   HE21  GLN  21          HE21      GLN  21 -12.412 -15.228   1.272
  171   HE22  GLN  21          HE22      GLN  21 -13.946 -15.362   0.346
  172    HA   PRO  22           HA       PRO  22 -10.990  -8.093  -1.021
  173    HB2  PRO  22           HB2      PRO  22 -12.456  -8.363   1.551
  174    HB3  PRO  22           HB1      PRO  22 -12.744  -7.261   0.200
  175    HG2  PRO  22           HG2      PRO  22 -14.356  -9.333   0.610
  176    HG3  PRO  22           HG1      PRO  22 -13.891  -8.858  -1.034
  177    HD2  PRO  22           HD2      PRO  22 -12.862 -11.111   0.650
  178    HD3  PRO  22           HD1      PRO  22 -13.238 -11.083  -1.085
  179    H    LEU  23           HN       LEU  23 -10.112  -6.543   0.634
  180    HA   LEU  23           HA       LEU  23  -8.488  -7.869   2.723
  181    HB2  LEU  23           HB2      LEU  23  -7.143  -7.786   0.618
  182    HB3  LEU  23           HB1      LEU  23  -7.268  -6.041   0.660
  183    HG   LEU  23           HG       LEU  23  -6.101  -6.071   2.874
  184   HD11  LEU  23          HD11      LEU  23  -6.620  -8.338   3.549
  185   HD12  LEU  23          HD12      LEU  23  -4.873  -8.108   3.483
  186   HD13  LEU  23          HD13      LEU  23  -5.697  -8.978   2.189
  187   HD21  LEU  23          HD21      LEU  23  -4.609  -7.311   0.568
  188   HD22  LEU  23          HD22      LEU  23  -3.887  -6.469   1.939
  189   HD23  LEU  23          HD23      LEU  23  -4.906  -5.589   0.802
  190    H    THR  24           HN       THR  24  -7.606  -6.438   4.319
  191    HA   THR  24           HA       THR  24  -8.431  -3.618   4.211
  192    HB   THR  24           HB       THR  24  -9.426  -5.311   6.513
  193    HG1  THR  24           HG1      THR  24 -10.886  -5.892   5.060
  194   HG21  THR  24          HG21      THR  24 -10.762  -3.307   7.019
  195   HG22  THR  24          HG22      THR  24 -10.009  -2.472   5.658
  196   HG23  THR  24          HG23      THR  24  -9.032  -2.961   7.043
  197    H    ILE  25           HN       ILE  25  -6.136  -3.380   4.190
  198    HA   ILE  25           HA       ILE  25  -5.002  -3.535   6.933
  199    HB   ILE  25           HB       ILE  25  -4.265  -5.502   5.469
  200   HG12  ILE  25          HG12      ILE  25  -1.795  -5.134   6.160
  201   HG13  ILE  25          HG11      ILE  25  -2.373  -3.631   6.869
  202   HG21  ILE  25          HG21      ILE  25  -3.943  -4.216   3.403
  203   HG22  ILE  25          HG22      ILE  25  -2.494  -5.105   3.871
  204   HG23  ILE  25          HG23      ILE  25  -2.592  -3.368   4.155
  205   HD11  ILE  25          HD11      ILE  25  -3.395  -6.377   7.545
  206   HD12  ILE  25          HD12      ILE  25  -3.893  -4.859   8.296
  207   HD13  ILE  25          HD13      ILE  25  -2.242  -5.445   8.499
  208    H    SER  26           HN       SER  26  -3.305  -2.032   7.380
  209    HA   SER  26           HA       SER  26  -3.222   0.195   5.392
  210    HB2  SER  26           HB2      SER  26  -4.403   0.654   7.578
  211    HB3  SER  26           HB1      SER  26  -2.845   0.461   8.377
  212    HG   SER  26           HG       SER  26  -3.218   2.639   7.911
  213    H    LEU  27           HN       LEU  27  -1.316   1.767   6.151
  214    HA   LEU  27           HA       LEU  27   1.103   0.691   5.249
  215    HB2  LEU  27           HB2      LEU  27   0.789   2.972   7.169
  216    HB3  LEU  27           HB1      LEU  27   2.136   2.686   6.086
  217    HG   LEU  27           HG       LEU  27  -0.677   3.456   5.312
  218   HD11  LEU  27          HD11      LEU  27   0.683   5.281   6.179
  219   HD12  LEU  27          HD12      LEU  27   0.392   5.468   4.449
  220   HD13  LEU  27          HD13      LEU  27   1.956   4.890   5.022
  221   HD21  LEU  27          HD21      LEU  27   0.189   1.873   3.688
  222   HD22  LEU  27          HD22      LEU  27   1.684   2.799   3.550
  223   HD23  LEU  27          HD23      LEU  27   0.159   3.498   3.003
  224    H    ASP  28           HN       ASP  28   0.406   1.549   8.659
  225    HA   ASP  28           HA       ASP  28   2.810   0.391   9.650
  226    HB2  ASP  28           HB2      ASP  28   1.516   2.090  10.869
  227    HB3  ASP  28           HB1      ASP  28   0.214   0.930  11.107
  228    H    GLU  29           HN       GLU  29  -0.477  -0.916   9.304
  229    HA   GLU  29           HA       GLU  29   0.168  -3.371  10.694
  230    HB2  GLU  29           HB2      GLU  29  -2.135  -2.688   8.864
  231    HB3  GLU  29           HB1      GLU  29  -2.013  -4.157   9.818
  232    HG2  GLU  29           HG2      GLU  29  -3.303  -2.941  11.209
  233    HG3  GLU  29           HG1      GLU  29  -1.724  -2.413  11.788
  234    H    LEU  30           HN       LEU  30   0.813  -2.243   7.495
  235    HA   LEU  30           HA       LEU  30   1.194  -5.073   6.653
  236    HB2  LEU  30           HB2      LEU  30  -0.473  -3.617   5.384
  237    HB3  LEU  30           HB1      LEU  30   0.909  -2.710   4.800
  238    HG   LEU  30           HG       LEU  30   1.786  -4.753   3.730
  239   HD11  LEU  30          HD11      LEU  30  -0.764  -5.969   4.773
  240   HD12  LEU  30          HD12      LEU  30   0.891  -6.467   5.129
  241   HD13  LEU  30          HD13      LEU  30   0.231  -6.692   3.510
  242   HD21  LEU  30          HD21      LEU  30   0.234  -4.802   1.908
  243   HD22  LEU  30          HD22      LEU  30   0.313  -3.155   2.534
  244   HD23  LEU  30          HD23      LEU  30  -1.060  -4.184   2.933
  245    H    PHE  31           HN       PHE  31   3.056  -3.057   8.086
  246    HA   PHE  31           HA       PHE  31   5.326  -3.829   6.419
  247    HB2  PHE  31           HB2      PHE  31   4.779  -0.951   7.157
  248    HB3  PHE  31           HB1      PHE  31   6.386  -1.506   6.699
  249    HD1  PHE  31           HD1      PHE  31   6.296  -3.016   4.442
  250    HD2  PHE  31           HD2      PHE  31   3.583   0.082   5.501
  251    HE1  PHE  31           HE1      PHE  31   5.743  -2.699   2.073
  252    HE2  PHE  31           HE2      PHE  31   3.018   0.402   3.129
  253    HZ   PHE  31           HZ       PHE  31   4.100  -0.990   1.409
  254    H    SER  32           HN       SER  32   7.252  -4.211   7.525
  255    HA   SER  32           HA       SER  32   7.153  -3.700  10.449
  256    HB2  SER  32           HB2      SER  32   7.927  -6.289   9.116
  257    HB3  SER  32           HB1      SER  32   8.091  -5.954  10.840
  258    HG   SER  32           HG       SER  32   6.157  -6.920  10.697
  259    H    SER  33           HN       SER  33   8.580  -2.250   8.323
  260    HA   SER  33           HA       SER  33  11.231  -2.309   9.476
  261    HB2  SER  33           HB2      SER  33  11.571  -4.200   8.018
  262    HB3  SER  33           HB1      SER  33  10.873  -3.329   6.657
  263    HG   SER  33           HG       SER  33  13.230  -3.394   6.750
  264    H    ARG  34           HN       ARG  34  12.228  -0.408   9.333
  265    HA   ARG  34           HA       ARG  34  10.800   1.812   8.254
  266    HB2  ARG  34           HB2      ARG  34  12.846   3.106   8.799
  267    HB3  ARG  34           HB1      ARG  34  12.297   2.097  10.128
  268    HG2  ARG  34           HG2      ARG  34  14.012   0.396   9.374
  269    HG3  ARG  34           HG1      ARG  34  14.650   1.652   8.313
  270    HD2  ARG  34           HD2      ARG  34  14.335   1.936  11.297
  271    HD3  ARG  34           HD1      ARG  34  15.832   1.463  10.495
  272    HE   ARG  34           HE       ARG  34  14.873   3.908   9.375
  273   HH11  ARG  34          HH11      ARG  34  16.365   2.615  12.314
  274   HH12  ARG  34          HH12      ARG  34  17.141   4.107  12.720
  275   HH21  ARG  34          HH21      ARG  34  15.913   5.854   9.949
  276   HH22  ARG  34          HH22      ARG  34  16.884   5.946  11.380
  277    H    GLY  35           HN       GLY  35  13.717   0.078   7.096
  278    HA2  GLY  35           HA2      GLY  35  14.043   1.745   4.769
  279    HA3  GLY  35           HA1      GLY  35  14.762   0.162   5.024
  280    H    GLU  36           HN       GLU  36  12.168  -1.156   5.461
  281    HA   GLU  36           HA       GLU  36  11.623  -1.979   2.818
  282    HB2  GLU  36           HB2      GLU  36  11.056  -3.322   4.766
  283    HB3  GLU  36           HB1      GLU  36   9.891  -2.117   5.293
  284    HG2  GLU  36           HG2      GLU  36   8.480  -2.585   3.405
  285    HG3  GLU  36           HG1      GLU  36   9.686  -3.678   2.729
  286    H    PHE  37           HN       PHE  37   9.981   0.411   4.897
  287    HA   PHE  37           HA       PHE  37   7.851   1.021   3.138
  288    HB2  PHE  37           HB2      PHE  37   8.119   1.751   5.547
  289    HB3  PHE  37           HB1      PHE  37   9.227   2.993   4.971
  290    HD1  PHE  37           HD2      PHE  37   5.776   1.718   4.374
  291    HD2  PHE  37           HD1      PHE  37   8.387   5.077   4.458
  292    HE1  PHE  37           HE2      PHE  37   3.866   3.208   3.947
  293    HE2  PHE  37           HE1      PHE  37   6.482   6.573   4.033
  294    HZ   PHE  37           HZ       PHE  37   4.218   5.640   3.776
  295    H    ILE  38           HN       ILE  38  11.174   2.307   3.324
  296    HA   ILE  38           HA       ILE  38  10.946   4.381   1.461
  297    HB   ILE  38           HB       ILE  38  13.301   2.533   1.877
  298   HG12  ILE  38          HG12      ILE  38  12.633   3.579   3.957
  299   HG13  ILE  38          HG11      ILE  38  14.097   4.361   3.375
  300   HG21  ILE  38          HG21      ILE  38  14.647   4.410   1.016
  301   HG22  ILE  38          HG22      ILE  38  13.160   5.276   0.629
  302   HG23  ILE  38          HG23      ILE  38  13.540   3.765  -0.196
  303   HD11  ILE  38          HD11      ILE  38  12.541   5.991   4.253
  304   HD12  ILE  38          HD12      ILE  38  11.295   5.434   3.135
  305   HD13  ILE  38          HD13      ILE  38  12.750   6.217   2.517
  306    H    SER  39           HN       SER  39  11.935   0.963   0.784
  307    HA   SER  39           HA       SER  39  12.179   1.280  -2.006
  308    HB2  SER  39           HB2      SER  39  11.288  -1.179  -0.449
  309    HB3  SER  39           HB1      SER  39  11.794  -1.191  -2.138
  310    HG   SER  39           HG       SER  39  13.783  -1.194  -1.486
  311    H    VAL  40           HN       VAL  40   9.371  -0.306  -0.371
  312    HA   VAL  40           HA       VAL  40   7.629  -0.577  -2.359
  313    HB   VAL  40           HB       VAL  40   5.749  -0.090  -0.827
  314   HG11  VAL  40          HG11      VAL  40   7.895  -1.646   0.585
  315   HG12  VAL  40          HG12      VAL  40   7.123  -2.230  -0.888
  316   HG13  VAL  40          HG13      VAL  40   6.157  -1.939   0.556
  317   HG21  VAL  40          HG21      VAL  40   7.910   0.682   1.127
  318   HG22  VAL  40          HG22      VAL  40   6.181   0.572   1.455
  319   HG23  VAL  40          HG23      VAL  40   6.794   1.809   0.357
  320    H    GLY  41           HN       GLY  41   8.345   2.711  -1.034
  321    HA2  GLY  41           HA2      GLY  41   8.082   4.365  -2.927
  322    HA3  GLY  41           HA1      GLY  41   6.454   3.723  -3.102
  323    H    GLY  42           HN       GLY  42   8.361   4.489  -0.163
  324    HA2  GLY  42           HA2      GLY  42   6.153   6.366   0.570
  325    HA3  GLY  42           HA1      GLY  42   6.981   5.346   1.726
  326    H    ASP  43           HN       ASP  43   6.953   8.313   0.008
  327    HA   ASP  43           HA       ASP  43   9.662   9.063   0.881
  328    HB2  ASP  43           HB2      ASP  43   7.460  10.641  -0.481
  329    HB3  ASP  43           HB1      ASP  43   9.051  11.294  -0.104
  330    H    GLY  44           HN       GLY  44   6.652  11.009   1.274
  331    HA2  GLY  44           HA2      GLY  44   6.909  10.823   4.195
  332    HA3  GLY  44           HA1      GLY  44   7.341  12.383   3.521
  333    H    ARG  45           HN       ARG  45   5.645  13.362   1.994
  334    HA   ARG  45           HA       ARG  45   3.070  13.101   3.421
  335    HB2  ARG  45           HB2      ARG  45   4.201  15.189   1.574
  336    HB3  ARG  45           HB1      ARG  45   2.504  15.180   2.042
  337    HG2  ARG  45           HG2      ARG  45   3.061  15.471   4.342
  338    HG3  ARG  45           HG1      ARG  45   4.778  15.238   4.008
  339    HD2  ARG  45           HD2      ARG  45   4.777  17.273   2.645
  340    HD3  ARG  45           HD1      ARG  45   3.068  17.509   3.002
  341    HE   ARG  45           HE       ARG  45   4.084  17.422   5.492
  342   HH11  ARG  45          HH11      ARG  45   5.174  19.168   2.607
  343   HH12  ARG  45          HH12      ARG  45   5.872  20.467   3.512
  344   HH21  ARG  45          HH21      ARG  45   5.015  19.151   6.640
  345   HH22  ARG  45          HH22      ARG  45   5.781  20.458   5.802
  346    H    MET  46           HN       MET  46   2.108  11.303   2.657
  347    HA   MET  46           HA       MET  46   1.842  10.924  -0.247
  348    HB2  MET  46           HB2      MET  46   2.168   9.093   1.565
  349    HB3  MET  46           HB1      MET  46   0.443   9.282   1.846
  350    HG2  MET  46           HG2      MET  46  -0.076   8.099   0.043
  351    HG3  MET  46           HG1      MET  46   1.061   8.987  -0.968
  352    HE1  MET  46           HE1      MET  46   4.405   7.064  -0.326
  353    HE2  MET  46           HE2      MET  46   3.811   8.506   0.496
  354    HE3  MET  46           HE3      MET  46   3.619   8.344  -1.250
  355    H    SER  47           HN       SER  47  -0.370  10.395  -1.165
  356    HA   SER  47           HA       SER  47  -2.133  12.619  -0.415
  357    HB2  SER  47           HB2      SER  47  -2.173  10.649  -2.701
  358    HB3  SER  47           HB1      SER  47  -3.430  11.860  -2.452
  359    HG   SER  47           HG       SER  47  -2.120  13.060  -3.587
  360    H    HIS  48           HN       HIS  48  -3.017   9.327  -1.432
  361    HA   HIS  48           HA       HIS  48  -4.404   8.574   0.988
  362    HB2  HIS  48           HB2      HIS  48  -5.953  10.338   0.332
  363    HB3  HIS  48           HB1      HIS  48  -6.065   9.653  -1.284
  364    HD1  HIS  48           HD1      HIS  48  -7.410   9.371   2.164
  365    HD2  HIS  48           HD2      HIS  48  -7.516   7.181  -1.411
  366    HE1  HIS  48           HE1      HIS  48  -9.281   7.677   2.414
  367    HE2  HIS  48           HE2      HIS  48  -9.386   6.389   0.226
  368    H    LYS  49           HN       LYS  49  -5.301   8.196  -2.477
  369    HA   LYS  49           HA       LYS  49  -5.505   5.391  -2.249
  370    HB2  LYS  49           HB2      LYS  49  -6.457   6.760  -4.088
  371    HB3  LYS  49           HB1      LYS  49  -4.835   7.000  -4.719
  372    HG2  LYS  49           HG2      LYS  49  -5.868   5.302  -6.003
  373    HG3  LYS  49           HG1      LYS  49  -4.658   4.526  -4.987
  374    HD2  LYS  49           HD2      LYS  49  -7.430   4.712  -3.936
  375    HD3  LYS  49           HD1      LYS  49  -7.129   3.570  -5.244
  376    HE2  LYS  49           HE2      LYS  49  -5.559   3.667  -2.671
  377    HE3  LYS  49           HE1      LYS  49  -6.919   2.587  -2.965
  378    HZ1  LYS  49           HZ1      LYS  49  -4.815   1.479  -3.360
  379    HZ2  LYS  49           HZ2      LYS  49  -4.384   2.637  -4.513
  380    HZ3  LYS  49           HZ3      LYS  49  -5.691   1.605  -4.802
  381    H    GLU  50           HN       GLU  50  -2.747   7.485  -2.815
  382    HA   GLU  50           HA       GLU  50  -0.924   5.554  -3.838
  383    HB2  GLU  50           HB2      GLU  50  -0.491   8.080  -2.238
  384    HB3  GLU  50           HB1      GLU  50   0.806   7.163  -2.987
  385    HG2  GLU  50           HG2      GLU  50  -0.279   7.523  -5.186
  386    HG3  GLU  50           HG1      GLU  50  -1.467   8.549  -4.384
  387    H    ALA  51           HN       ALA  51  -1.671   6.592  -0.496
  388    HA   ALA  51           HA       ALA  51   0.387   5.165   0.801
  389    HB1  ALA  51           HB1      ALA  51  -0.979   5.338   2.815
  390    HB2  ALA  51           HB2      ALA  51  -2.384   5.758   1.837
  391    HB3  ALA  51           HB3      ALA  51  -1.001   6.850   1.906
  392    H    ILE  52           HN       ILE  52  -3.051   4.088   0.369
  393    HA   ILE  52           HA       ILE  52  -2.528   1.558   1.503
  394    HB   ILE  52           HB       ILE  52  -4.623   2.224  -0.602
  395   HG12  ILE  52          HG12      ILE  52  -4.755   3.671   1.378
  396   HG13  ILE  52          HG11      ILE  52  -6.124   2.577   1.305
  397   HG21  ILE  52          HG21      ILE  52  -4.305  -0.177  -0.389
  398   HG22  ILE  52          HG22      ILE  52  -5.859   0.306   0.289
  399   HG23  ILE  52          HG23      ILE  52  -4.507  -0.064   1.360
  400   HD11  ILE  52          HD11      ILE  52  -5.050   1.140   2.975
  401   HD12  ILE  52          HD12      ILE  52  -5.307   2.781   3.570
  402   HD13  ILE  52          HD13      ILE  52  -3.698   2.270   3.057
  403    H    LEU  53           HN       LEU  53  -2.501   2.600  -1.936
  404    HA   LEU  53           HA       LEU  53  -2.156   0.083  -3.098
  405    HB2  LEU  53           HB2      LEU  53  -2.500   2.209  -4.335
  406    HB3  LEU  53           HB1      LEU  53  -0.866   2.726  -3.982
  407    HG   LEU  53           HG       LEU  53  -0.036   0.750  -5.288
  408   HD11  LEU  53          HD11      LEU  53  -2.936   0.536  -6.080
  409   HD12  LEU  53          HD12      LEU  53  -2.024  -0.643  -5.138
  410   HD13  LEU  53          HD13      LEU  53  -1.597  -0.339  -6.822
  411   HD21  LEU  53          HD21      LEU  53  -1.773   2.750  -6.728
  412   HD22  LEU  53          HD22      LEU  53  -0.525   1.757  -7.479
  413   HD23  LEU  53          HD23      LEU  53  -0.083   2.962  -6.270
  414    H    LEU  54           HN       LEU  54   0.279   1.938  -1.277
  415    HA   LEU  54           HA       LEU  54   2.614   0.720  -2.341
  416    HB2  LEU  54           HB2      LEU  54   1.928   2.414  -0.158
  417    HB3  LEU  54           HB1      LEU  54   2.776   1.063   0.567
  418    HG   LEU  54           HG       LEU  54   4.661   1.462  -1.016
  419   HD11  LEU  54          HD11      LEU  54   4.754   3.570  -2.225
  420   HD12  LEU  54          HD12      LEU  54   3.121   3.964  -1.691
  421   HD13  LEU  54          HD13      LEU  54   3.389   2.597  -2.773
  422   HD21  LEU  54          HD21      LEU  54   4.654   2.347   1.280
  423   HD22  LEU  54          HD22      LEU  54   3.906   3.832   0.691
  424   HD23  LEU  54          HD23      LEU  54   5.530   3.392   0.162
  425    H    GLY  55           HN       GLY  55   0.071  -0.664  -0.319
  426    HA2  GLY  55           HA2      GLY  55   1.437  -2.720   1.016
  427    HA3  GLY  55           HA1      GLY  55  -0.209  -2.842   0.421
  428    H    LEU  56           HN       LEU  56   0.188  -2.721  -2.330
  429    HA   LEU  56           HA       LEU  56   0.649  -5.351  -3.048
  430    HB2  LEU  56           HB2      LEU  56   1.397  -3.038  -4.821
  431    HB3  LEU  56           HB1      LEU  56   0.861  -4.635  -5.310
  432    HG   LEU  56           HG       LEU  56  -0.794  -2.449  -4.059
  433   HD11  LEU  56          HD11      LEU  56  -0.866  -3.859  -6.717
  434   HD12  LEU  56          HD12      LEU  56  -0.509  -2.160  -6.408
  435   HD13  LEU  56          HD13      LEU  56  -2.136  -2.784  -6.131
  436   HD21  LEU  56          HD21      LEU  56  -1.603  -4.364  -2.985
  437   HD22  LEU  56          HD22      LEU  56  -1.402  -5.364  -4.422
  438   HD23  LEU  56          HD23      LEU  56  -2.676  -4.146  -4.367
  439    H    ARG  57           HN       ARG  57   3.078  -2.740  -2.897
  440    HA   ARG  57           HA       ARG  57   5.222  -4.283  -3.969
  441    HB2  ARG  57           HB2      ARG  57   5.341  -1.979  -2.016
  442    HB3  ARG  57           HB1      ARG  57   6.691  -2.587  -2.962
  443    HG2  ARG  57           HG2      ARG  57   4.231  -1.168  -3.942
  444    HG3  ARG  57           HG1      ARG  57   5.911  -0.644  -4.052
  445    HD2  ARG  57           HD2      ARG  57   4.657  -2.978  -5.489
  446    HD3  ARG  57           HD1      ARG  57   5.133  -1.442  -6.205
  447    HE   ARG  57           HE       ARG  57   7.496  -2.056  -5.537
  448   HH11  ARG  57          HH11      ARG  57   5.044  -4.557  -6.145
  449   HH12  ARG  57          HH12      ARG  57   6.212  -5.753  -6.582
  450   HH21  ARG  57          HH21      ARG  57   8.983  -3.672  -6.124
  451   HH22  ARG  57          HH22      ARG  57   8.442  -5.255  -6.571
  452    H    TYR  58           HN       TYR  58   3.928  -3.957  -0.697
  453    HA   TYR  58           HA       TYR  58   6.054  -5.260   0.683
  454    HB2  TYR  58           HB2      TYR  58   4.310  -3.970   1.827
  455    HB3  TYR  58           HB1      TYR  58   3.099  -5.141   1.330
  456    HD1  TYR  58           HD2      TYR  58   6.239  -4.859   3.317
  457    HD2  TYR  58           HD1      TYR  58   2.573  -6.932   2.716
  458    HE1  TYR  58           HE2      TYR  58   6.634  -6.146   5.374
  459    HE2  TYR  58           HE1      TYR  58   2.957  -8.221   4.772
  460    HH   TYR  58           HH       TYR  58   4.949  -8.917   6.171
  461    H    LYS  59           HN       LYS  59   2.983  -6.481  -0.641
  462    HA   LYS  59           HA       LYS  59   3.619  -9.242   0.004
  463    HB2  LYS  59           HB2      LYS  59   1.407  -8.009  -1.628
  464    HB3  LYS  59           HB1      LYS  59   1.500  -9.708  -1.192
  465    HG2  LYS  59           HG2      LYS  59   1.407  -7.474   0.817
  466    HG3  LYS  59           HG1      LYS  59  -0.020  -8.332   0.234
  467    HD2  LYS  59           HD2      LYS  59   0.890 -10.435   1.076
  468    HD3  LYS  59           HD1      LYS  59   2.346  -9.600   1.620
  469    HE2  LYS  59           HE2      LYS  59   1.010  -8.263   3.163
  470    HE3  LYS  59           HE1      LYS  59  -0.456  -9.069   2.606
  471    HZ1  LYS  59           HZ1      LYS  59   1.833 -10.403   3.953
  472    HZ2  LYS  59           HZ2      LYS  59   0.407 -11.157   3.445
  473    HZ3  LYS  59           HZ3      LYS  59   0.359 -10.007   4.683
  474    H    LYS  60           HN       LYS  60   4.544  -7.158  -2.503
  475    HA   LYS  60           HA       LYS  60   5.633  -7.517  -4.472
  476    HB2  LYS  60           HB2      LYS  60   5.788 -10.410  -3.596
  477    HB3  LYS  60           HB1      LYS  60   6.719  -9.682  -4.895
  478    HG2  LYS  60           HG2      LYS  60   6.880  -8.860  -2.004
  479    HG3  LYS  60           HG1      LYS  60   7.998  -9.963  -2.805
  480    HD2  LYS  60           HD2      LYS  60   7.501  -7.096  -3.611
  481    HD3  LYS  60           HD1      LYS  60   8.873  -7.660  -2.659
  482    HE2  LYS  60           HE2      LYS  60   8.209  -8.510  -5.478
  483    HE3  LYS  60           HE1      LYS  60   9.467  -7.364  -5.017
  484    HZ1  LYS  60           HZ1      LYS  60   9.365 -10.254  -4.337
  485    HZ2  LYS  60           HZ2      LYS  60  10.521  -9.175  -3.738
  486    HZ3  LYS  60           HZ3      LYS  60  10.447  -9.500  -5.396
  487    H    LEU  61           HN       LEU  61   3.360  -7.000  -5.175
  488    HA   LEU  61           HA       LEU  61   2.717  -8.755  -7.351
  489    HB2  LEU  61           HB2      LEU  61   0.255  -9.052  -6.499
  490    HB3  LEU  61           HB1      LEU  61   1.507 -10.179  -6.026
  491    HG   LEU  61           HG       LEU  61   1.749  -8.993  -3.870
  492   HD11  LEU  61          HD11      LEU  61  -0.668  -7.416  -4.724
  493   HD12  LEU  61          HD12      LEU  61   0.976  -6.781  -4.674
  494   HD13  LEU  61          HD13      LEU  61   0.188  -7.308  -3.186
  495   HD21  LEU  61          HD21      LEU  61  -0.345  -9.758  -2.889
  496   HD22  LEU  61          HD22      LEU  61   0.272 -10.928  -4.058
  497   HD23  LEU  61          HD23      LEU  61  -1.067  -9.866  -4.495
  498    H    TYR  62           HN       TYR  62   3.296  -5.904  -6.820
  499    HA   TYR  62           HA       TYR  62   0.983  -4.313  -7.092
  500    HB2  TYR  62           HB2      TYR  62   3.217  -3.430  -6.583
  501    HB3  TYR  62           HB1      TYR  62   3.754  -3.831  -8.209
  502    HD1  TYR  62           HD2      TYR  62   3.005  -2.505 -10.128
  503    HD2  TYR  62           HD1      TYR  62   1.815  -1.505  -6.167
  504    HE1  TYR  62           HE2      TYR  62   2.287  -0.288 -10.910
  505    HE2  TYR  62           HE1      TYR  62   1.097   0.714  -6.938
  506    HH   TYR  62           HH       TYR  62   0.658   1.495 -10.159
  507    H    ASN  63           HN       ASN  63   2.573  -6.363  -9.420
  508    HA   ASN  63           HA       ASN  63   1.755  -5.080 -11.811
  509    HB2  ASN  63           HB2      ASN  63   2.239  -8.017 -11.280
  510    HB3  ASN  63           HB1      ASN  63   2.125  -7.282 -12.876
  511   HD21  ASN  63          HD21      ASN  63   3.766  -5.924 -13.627
  512   HD22  ASN  63          HD22      ASN  63   5.388  -5.927 -12.852
  513    H    GLN  64           HN       GLN  64   0.275  -8.069 -10.418
  514    HA   GLN  64           HA       GLN  64  -2.141  -7.442 -11.988
  515    HB2  GLN  64           HB2      GLN  64  -1.295  -9.915 -10.492
  516    HB3  GLN  64           HB1      GLN  64  -2.850  -9.752 -11.291
  517    HG2  GLN  64           HG2      GLN  64  -1.746  -9.473 -13.435
  518    HG3  GLN  64           HG1      GLN  64  -0.170  -9.565 -12.650
  519   HE21  GLN  64          HE21      GLN  64   0.498 -11.334 -13.843
  520   HE22  GLN  64          HE22      GLN  64  -0.198 -12.969 -13.571
  521    H    ALA  65           HN       ALA  65  -1.124  -6.752  -8.822
  522    HA   ALA  65           HA       ALA  65  -3.609  -7.436  -7.504
  523    HB1  ALA  65           HB1      ALA  65  -1.395  -5.575  -6.676
  524    HB2  ALA  65           HB2      ALA  65  -1.578  -7.268  -6.223
  525    HB3  ALA  65           HB3      ALA  65  -2.739  -6.071  -5.650
  526    H    ARG  66           HN       ARG  66  -2.334  -4.571  -9.144
  527    HA   ARG  66           HA       ARG  66  -4.449  -2.823  -8.248
  528    HB2  ARG  66           HB2      ARG  66  -2.185  -2.103  -9.077
  529    HB3  ARG  66           HB1      ARG  66  -2.716  -2.512 -10.702
  530    HG2  ARG  66           HG2      ARG  66  -4.399  -0.822 -10.657
  531    HG3  ARG  66           HG1      ARG  66  -4.118  -0.515  -8.942
  532    HD2  ARG  66           HD2      ARG  66  -3.059   1.224 -10.201
  533    HD3  ARG  66           HD1      ARG  66  -1.804   0.198  -9.511
  534    HE   ARG  66           HE       ARG  66  -2.109  -0.906 -11.965
  535   HH11  ARG  66          HH11      ARG  66  -1.713   2.459 -10.928
  536   HH12  ARG  66          HH12      ARG  66  -0.903   2.935 -12.381
  537   HH21  ARG  66          HH21      ARG  66  -1.035  -0.232 -13.860
  538   HH22  ARG  66          HH22      ARG  66  -0.517   1.411 -14.044
  539    H    VAL  67           HN       VAL  67  -4.139  -5.161 -10.839
  540    HA   VAL  67           HA       VAL  67  -6.532  -4.081 -12.199
  541    HB   VAL  67           HB       VAL  67  -6.142  -5.777 -13.907
  542   HG11  VAL  67          HG11      VAL  67  -4.009  -4.958 -14.759
  543   HG12  VAL  67          HG12      VAL  67  -3.617  -4.307 -13.168
  544   HG13  VAL  67          HG13      VAL  67  -4.971  -3.644 -14.082
  545   HG21  VAL  67          HG21      VAL  67  -5.303  -7.596 -12.547
  546   HG22  VAL  67          HG22      VAL  67  -3.848  -6.675 -12.166
  547   HG23  VAL  67          HG23      VAL  67  -4.141  -7.216 -13.818
  548    H    LYS  68           HN       LYS  68  -5.480  -6.899 -10.315
  549    HA   LYS  68           HA       LYS  68  -7.941  -8.363 -10.669
  550    HB2  LYS  68           HB2      LYS  68  -5.658  -8.590  -8.717
  551    HB3  LYS  68           HB1      LYS  68  -7.049  -9.661  -8.662
  552    HG2  LYS  68           HG2      LYS  68  -5.291  -9.312 -11.080
  553    HG3  LYS  68           HG1      LYS  68  -5.076 -10.581  -9.872
  554    HD2  LYS  68           HD2      LYS  68  -7.242 -11.500 -10.375
  555    HD3  LYS  68           HD1      LYS  68  -7.609 -10.153 -11.455
  556    HE2  LYS  68           HE2      LYS  68  -6.986 -12.109 -12.743
  557    HE3  LYS  68           HE1      LYS  68  -5.767 -10.850 -12.925
  558    HZ1  LYS  68           HZ1      LYS  68  -4.360 -11.996 -11.359
  559    HZ2  LYS  68           HZ2      LYS  68  -4.800 -13.063 -12.595
  560    HZ3  LYS  68           HZ3      LYS  68  -5.547 -13.171 -11.082
  561    H    TYR  69           HN       TYR  69  -7.047  -5.692  -8.681
  562    HA   TYR  69           HA       TYR  69  -9.604  -6.023  -7.190
  563    HB2  TYR  69           HB2      TYR  69  -6.923  -5.157  -6.099
  564    HB3  TYR  69           HB1      TYR  69  -8.440  -4.898  -5.249
  565    HD1  TYR  69           HD1      TYR  69  -6.127  -7.487  -6.515
  566    HD2  TYR  69           HD2      TYR  69  -9.488  -6.651  -4.044
  567    HE1  TYR  69           HE1      TYR  69  -5.949  -9.731  -5.524
  568    HE2  TYR  69           HE2      TYR  69  -9.320  -8.890  -3.048
  569    HH   TYR  69           HH       TYR  69  -8.390 -11.117  -3.654
  570    H    SER  70           HN       SER  70 -10.602  -4.030  -6.477
  571    HA   SER  70           HA       SER  70 -10.274  -1.952  -8.484
  572    HB2  SER  70           HB2      SER  70 -12.497  -2.605  -7.591
  573    HB3  SER  70           HB1      SER  70 -12.028  -1.966  -6.015
  574    HG   SER  70           HG       SER  70 -13.221  -0.440  -7.226
  575    H    LEU  71           HN       LEU  71  -8.252  -1.039  -8.252
  576    HA   LEU  71           HA       LEU  71  -7.863   0.490  -5.717
  577    HB2  LEU  71           HB2      LEU  71  -5.857  -0.815  -7.545
  578    HB3  LEU  71           HB1      LEU  71  -5.396   0.438  -6.410
  579    HG   LEU  71           HG       LEU  71  -6.350  -1.040  -4.579
  580   HD11  LEU  71          HD11      LEU  71  -6.371  -3.011  -6.853
  581   HD12  LEU  71          HD12      LEU  71  -7.726  -2.524  -5.834
  582   HD13  LEU  71          HD13      LEU  71  -6.404  -3.469  -5.151
  583   HD21  LEU  71          HD21      LEU  71  -3.976  -1.937  -6.201
  584   HD22  LEU  71          HD22      LEU  71  -4.350  -2.529  -4.582
  585   HD23  LEU  71          HD23      LEU  71  -3.986  -0.822  -4.833
  586    H    LEU  72           HN       LEU  72  -6.296   0.637  -8.935
  587    HA   LEU  72           HA       LEU  72  -6.988   3.535  -8.985
  588    HB2  LEU  72           HB2      LEU  72  -4.710   1.955 -10.139
  589    HB3  LEU  72           HB1      LEU  72  -5.126   3.528 -10.789
  590    HG   LEU  72           HG       LEU  72  -3.288   3.692  -9.195
  591   HD11  LEU  72          HD11      LEU  72  -4.203   5.439  -7.761
  592   HD12  LEU  72          HD12      LEU  72  -5.839   4.904  -8.141
  593   HD13  LEU  72          HD13      LEU  72  -4.815   5.579  -9.409
  594   HD21  LEU  72          HD21      LEU  72  -5.238   2.677  -7.132
  595   HD22  LEU  72          HD22      LEU  72  -3.576   3.188  -6.851
  596   HD23  LEU  72          HD23      LEU  72  -3.903   1.744  -7.809
  597    H    GLU  73           HN       GLU  73  -8.823   3.836 -10.067
  598    HA   GLU  73           HA       GLU  73  -8.887   3.226 -12.887
  599    HB2  GLU  73           HB2      GLU  73 -11.068   1.871 -12.679
  600    HB3  GLU  73           HB1      GLU  73  -9.547   1.042 -12.382
  601    HG2  GLU  73           HG2      GLU  73  -9.922   1.405  -9.937
  602    HG3  GLU  73           HG1      GLU  73 -11.524   2.020 -10.337
  Start of MODEL   18
    1    H1   SER   1           HT1      SER   1  -0.059  13.274   9.790
    2    H2   SER   1           HT2      SER   1  -1.194  13.752   8.631
    3    H3   SER   1           HT3      SER   1  -1.108  14.562  10.112
    4    HA   SER   1           HA       SER   1  -0.108  15.873   8.371
    5    HB2  SER   1           HB2      SER   1   1.900  14.739  10.338
    6    HB3  SER   1           HB1      SER   1   2.091  16.248   9.446
    7    HG   SER   1           HG       SER   1   1.216  16.923  11.292
    8    H    ASP   2           HN       ASP   2   1.962  13.002   9.004
    9    HA   ASP   2           HA       ASP   2   2.741  13.117   6.126
   10    HB2  ASP   2           HB2      ASP   2   4.299  12.345   8.580
   11    HB3  ASP   2           HB1      ASP   2   4.797  11.814   6.977
   12    H    VAL   3           HN       VAL   3   3.539  10.975   5.262
   13    HA   VAL   3           HA       VAL   3   1.395   9.081   5.450
   14    HB   VAL   3           HB       VAL   3   2.807   9.434   3.426
   15   HG11  VAL   3          HG11      VAL   3   4.869   7.862   4.964
   16   HG12  VAL   3          HG12      VAL   3   4.992   9.555   4.487
   17   HG13  VAL   3          HG13      VAL   3   4.964   8.291   3.257
   18   HG21  VAL   3          HG21      VAL   3   2.926   7.037   2.800
   19   HG22  VAL   3          HG22      VAL   3   1.395   7.494   3.545
   20   HG23  VAL   3          HG23      VAL   3   2.604   6.618   4.482
   21    H    TRP   4           HN       TRP   4   4.597   9.300   6.944
   22    HA   TRP   4           HA       TRP   4   4.472   6.595   8.006
   23    HB2  TRP   4           HB2      TRP   4   6.489   8.454   7.603
   24    HB3  TRP   4           HB1      TRP   4   6.310   8.423   9.354
   25    HD1  TRP   4           HD1      TRP   4   5.972   5.488  10.071
   26    HE1  TRP   4           HE1      TRP   4   7.778   3.690   9.576
   27    HE3  TRP   4           HE3      TRP   4   8.463   7.935   6.334
   28    HZ2  TRP   4           HZ2      TRP   4   9.964   3.416   7.804
   29    HZ3  TRP   4           HZ3      TRP   4  10.403   6.837   5.295
   30    HH2  TRP   4           HH2      TRP   4  11.138   4.624   6.015
   31    H    SER   5           HN       SER   5   3.902   9.898   9.204
   32    HA   SER   5           HA       SER   5   3.487   9.232  11.929
   33    HB2  SER   5           HB2      SER   5   2.187  11.419  10.277
   34    HB3  SER   5           HB1      SER   5   2.214  11.356  12.038
   35    HG   SER   5           HG       SER   5   3.914  12.615  10.769
   36    H    LEU   6           HN       LEU   6   1.128   9.586   9.252
   37    HA   LEU   6           HA       LEU   6  -0.900   8.241  10.943
   38    HB2  LEU   6           HB2      LEU   6  -1.118   9.638   8.274
   39    HB3  LEU   6           HB1      LEU   6  -2.460   8.868   9.097
   40    HG   LEU   6           HG       LEU   6  -0.882  11.219  10.149
   41   HD11  LEU   6          HD11      LEU   6  -2.257  11.830   8.243
   42   HD12  LEU   6          HD12      LEU   6  -2.936  12.487   9.732
   43   HD13  LEU   6          HD13      LEU   6  -3.659  11.061   8.986
   44   HD21  LEU   6          HD21      LEU   6  -2.649  11.324  11.859
   45   HD22  LEU   6          HD22      LEU   6  -1.718   9.830  11.954
   46   HD23  LEU   6          HD23      LEU   6  -3.328   9.823  11.232
   47    H    SER   7           HN       SER   7  -0.094   6.135  10.932
   48    HA   SER   7           HA       SER   7  -0.284   4.789   8.271
   49    HB2  SER   7           HB2      SER   7   1.568   4.177  10.583
   50    HB3  SER   7           HB1      SER   7   1.383   3.151   9.161
   51    HG   SER   7           HG       SER   7   2.498   4.537   8.003
   52    H    LYS   8           HN       LYS   8  -2.102   5.212  10.870
   53    HA   LYS   8           HA       LYS   8  -2.795   2.341  11.184
   54    HB2  LYS   8           HB2      LYS   8  -3.663   4.747  12.797
   55    HB3  LYS   8           HB1      LYS   8  -4.063   3.077  13.153
   56    HG2  LYS   8           HG2      LYS   8  -1.297   4.268  13.158
   57    HG3  LYS   8           HG1      LYS   8  -2.267   3.888  14.581
   58    HD2  LYS   8           HD2      LYS   8  -1.656   1.747  12.584
   59    HD3  LYS   8           HD1      LYS   8  -0.431   2.222  13.758
   60    HE2  LYS   8           HE2      LYS   8  -1.586   0.400  14.720
   61    HE3  LYS   8           HE1      LYS   8  -2.172   1.841  15.545
   62    HZ1  LYS   8           HZ1      LYS   8  -3.620   0.723  13.226
   63    HZ2  LYS   8           HZ2      LYS   8  -4.202   1.738  14.449
   64    HZ3  LYS   8           HZ3      LYS   8  -3.869   0.116  14.784
   65    H    THR   9           HN       THR   9  -3.461   3.886   8.766
   66    HA   THR   9           HA       THR   9  -6.436   3.816   9.002
   67    HB   THR   9           HB       THR   9  -5.862   6.070   8.532
   68    HG1  THR   9           HG1      THR   9  -7.533   5.543   7.207
   69   HG21  THR   9          HG21      THR   9  -4.397   6.752   6.692
   70   HG22  THR   9          HG22      THR   9  -4.081   5.060   6.309
   71   HG23  THR   9          HG23      THR   9  -3.536   5.731   7.845
   72    H    SER  10           HN       SER  10  -7.127   1.934   8.228
   73    HA   SER  10           HA       SER  10  -5.693   0.674   5.986
   74    HB2  SER  10           HB2      SER  10  -7.226  -1.228   6.390
   75    HB3  SER  10           HB1      SER  10  -6.371  -0.744   7.852
   76    HG   SER  10           HG       SER  10  -9.073  -0.490   7.195
   77    H    MET  11           HN       MET  11  -7.019  -0.381   4.236
   78    HA   MET  11           HA       MET  11  -9.355   1.283   3.466
   79    HB2  MET  11           HB2      MET  11  -7.383   2.243   2.342
   80    HB3  MET  11           HB1      MET  11  -7.011   0.667   1.655
   81    HG2  MET  11           HG2      MET  11  -8.075   2.064   0.007
   82    HG3  MET  11           HG1      MET  11  -9.125   0.711   0.421
   83    HE1  MET  11           HE1      MET  11  -8.477   4.079   2.443
   84    HE2  MET  11           HE2      MET  11  -9.772   5.075   1.777
   85    HE3  MET  11           HE3      MET  11  -8.457   4.527   0.739
   86    H    THR  12           HN       THR  12 -10.976   0.195   2.469
   87    HA   THR  12           HA       THR  12 -10.652  -2.728   2.376
   88    HB   THR  12           HB       THR  12 -13.131  -1.051   1.931
   89    HG1  THR  12           HG1      THR  12 -12.832  -0.828   4.044
   90   HG21  THR  12          HG21      THR  12 -14.339  -3.159   2.326
   91   HG22  THR  12          HG22      THR  12 -12.801  -4.018   2.404
   92   HG23  THR  12          HG23      THR  12 -13.310  -3.256   0.897
   93    H    PHE  13           HN       PHE  13 -10.193  -3.836   0.631
   94    HA   PHE  13           HA       PHE  13 -10.589  -2.553  -2.020
   95    HB2  PHE  13           HB2      PHE  13  -8.792  -4.730  -1.000
   96    HB3  PHE  13           HB1      PHE  13  -9.151  -4.616  -2.717
   97    HD1  PHE  13           HD2      PHE  13  -9.155  -1.737  -3.188
   98    HD2  PHE  13           HD1      PHE  13  -6.593  -4.108  -0.754
   99    HE1  PHE  13           HE2      PHE  13  -7.368  -0.067  -3.449
  100    HE2  PHE  13           HE1      PHE  13  -4.806  -2.445  -1.012
  101    HZ   PHE  13           HZ       PHE  13  -5.187  -0.420  -2.361
  102    H    GLN  14           HN       GLN  14 -11.648  -3.600  -3.714
  103    HA   GLN  14           HA       GLN  14 -13.380  -5.849  -2.798
  104    HB2  GLN  14           HB2      GLN  14 -14.714  -3.878  -3.152
  105    HB3  GLN  14           HB1      GLN  14 -13.985  -3.608  -4.729
  106    HG2  GLN  14           HG2      GLN  14 -15.006  -5.696  -5.533
  107    HG3  GLN  14           HG1      GLN  14 -15.771  -5.907  -3.959
  108   HE21  GLN  14          HE21      GLN  14 -17.464  -4.558  -3.325
  109   HE22  GLN  14          HE22      GLN  14 -18.352  -3.560  -4.530
  110    HA   PRO  15           HA       PRO  15 -11.275  -8.140  -5.989
  111    HB2  PRO  15           HB2      PRO  15 -12.861 -10.354  -5.889
  112    HB3  PRO  15           HB1      PRO  15 -11.586 -10.017  -4.716
  113    HG2  PRO  15           HG2      PRO  15 -14.533  -9.594  -4.487
  114    HG3  PRO  15           HG1      PRO  15 -13.387 -10.191  -3.273
  115    HD2  PRO  15           HD2      PRO  15 -14.317  -7.643  -3.294
  116    HD3  PRO  15           HD1      PRO  15 -12.704  -8.071  -2.695
  117    H    LYS  16           HN       LYS  16 -11.518  -8.532  -8.165
  118    HA   LYS  16           HA       LYS  16 -13.816  -7.289  -9.416
  119    HB2  LYS  16           HB2      LYS  16 -11.480  -8.856 -10.531
  120    HB3  LYS  16           HB1      LYS  16 -12.721  -8.127 -11.538
  121    HG2  LYS  16           HG2      LYS  16 -10.885  -6.655  -9.657
  122    HG3  LYS  16           HG1      LYS  16 -10.738  -6.722 -11.415
  123    HD2  LYS  16           HD2      LYS  16 -12.906  -5.611 -11.639
  124    HD3  LYS  16           HD1      LYS  16 -13.063  -5.557  -9.882
  125    HE2  LYS  16           HE2      LYS  16 -10.978  -4.207  -9.798
  126    HE3  LYS  16           HE1      LYS  16 -10.976  -4.171 -11.559
  127    HZ1  LYS  16           HZ1      LYS  16 -13.140  -3.100  -9.828
  128    HZ2  LYS  16           HZ2      LYS  16 -13.095  -3.032 -11.517
  129    HZ3  LYS  16           HZ3      LYS  16 -11.961  -2.170 -10.606
  130    H    LYS  17           HN       LYS  17 -12.664 -10.615  -8.913
  131    HA   LYS  17           HA       LYS  17 -15.221 -11.618 -10.070
  132    HB2  LYS  17           HB2      LYS  17 -14.035 -13.781 -10.316
  133    HB3  LYS  17           HB1      LYS  17 -13.282 -12.482 -11.229
  134    HG2  LYS  17           HG2      LYS  17 -11.691 -12.230  -9.261
  135    HG3  LYS  17           HG1      LYS  17 -12.330 -13.772  -8.694
  136    HD2  LYS  17           HD2      LYS  17 -10.324 -14.193  -9.942
  137    HD3  LYS  17           HD1      LYS  17 -11.698 -14.769 -10.886
  138    HE2  LYS  17           HE2      LYS  17 -11.628 -12.803 -12.278
  139    HE3  LYS  17           HE1      LYS  17 -10.371 -12.087 -11.270
  140    HZ1  LYS  17           HZ1      LYS  17 -10.100 -14.543 -12.923
  141    HZ2  LYS  17           HZ2      LYS  17  -8.897 -13.912 -11.916
  142    HZ3  LYS  17           HZ3      LYS  17  -9.420 -13.030 -13.261
  143    H    ALA  18           HN       ALA  18 -15.802 -13.881  -9.070
  144    HA   ALA  18           HA       ALA  18 -16.438 -13.338  -6.303
  145    HB1  ALA  18           HB1      ALA  18 -16.841 -15.850  -7.922
  146    HB2  ALA  18           HB2      ALA  18 -17.983 -14.513  -7.780
  147    HB3  ALA  18           HB3      ALA  18 -17.588 -15.489  -6.365
  148    H    SER  19           HN       SER  19 -14.155 -15.511  -7.962
  149    HA   SER  19           HA       SER  19 -13.394 -17.079  -5.753
  150    HB2  SER  19           HB2      SER  19 -11.325 -17.531  -6.980
  151    HB3  SER  19           HB1      SER  19 -12.706 -17.539  -8.076
  152    HG   SER  19           HG       SER  19 -11.014 -16.349  -8.974
  153    H    LEU  20           HN       LEU  20 -12.265 -13.849  -6.735
  154    HA   LEU  20           HA       LEU  20 -10.178 -13.750  -4.740
  155    HB2  LEU  20           HB2      LEU  20 -11.533 -11.603  -6.359
  156    HB3  LEU  20           HB1      LEU  20 -10.181 -11.303  -5.293
  157    HG   LEU  20           HG       LEU  20 -10.123 -13.094  -7.723
  158   HD11  LEU  20          HD11      LEU  20  -8.734 -11.361  -8.715
  159   HD12  LEU  20          HD12      LEU  20  -8.920 -10.366  -7.272
  160   HD13  LEU  20          HD13      LEU  20 -10.320 -10.720  -8.284
  161   HD21  LEU  20          HD21      LEU  20  -8.586 -13.874  -6.019
  162   HD22  LEU  20          HD22      LEU  20  -7.931 -12.247  -5.828
  163   HD23  LEU  20          HD23      LEU  20  -7.690 -13.125  -7.340
  164    H    GLN  21           HN       GLN  21 -10.061 -12.507  -2.859
  165    HA   GLN  21           HA       GLN  21 -12.725 -11.886  -1.661
  166    HB2  GLN  21           HB2      GLN  21 -10.258 -13.022  -0.336
  167    HB3  GLN  21           HB1      GLN  21 -11.682 -12.469   0.539
  168    HG2  GLN  21           HG2      GLN  21 -13.039 -14.151  -0.570
  169    HG3  GLN  21           HG1      GLN  21 -11.639 -14.686  -1.497
  170   HE21  GLN  21          HE21      GLN  21  -9.982 -15.843  -0.495
  171   HE22  GLN  21          HE22      GLN  21 -10.233 -16.613   1.110
  172    HA   PRO  22           HA       PRO  22 -11.520  -7.667  -1.128
  173    HB2  PRO  22           HB2      PRO  22 -12.814  -7.950   1.546
  174    HB3  PRO  22           HB1      PRO  22 -13.092  -6.747   0.281
  175    HG2  PRO  22           HG2      PRO  22 -14.839  -8.705   0.657
  176    HG3  PRO  22           HG1      PRO  22 -14.410  -8.189  -0.984
  177    HD2  PRO  22           HD2      PRO  22 -13.525 -10.605   0.537
  178    HD3  PRO  22           HD1      PRO  22 -13.924 -10.440  -1.185
  179    H    LEU  23           HN       LEU  23 -10.080  -6.317  -0.023
  180    HA   LEU  23           HA       LEU  23  -8.472  -7.667   2.099
  181    HB2  LEU  23           HB2      LEU  23  -7.411  -7.567  -0.206
  182    HB3  LEU  23           HB1      LEU  23  -7.340  -5.831  -0.000
  183    HG   LEU  23           HG       LEU  23  -6.048  -7.724   1.953
  184   HD11  LEU  23          HD11      LEU  23  -5.125  -8.173  -0.260
  185   HD12  LEU  23          HD12      LEU  23  -3.948  -7.358   0.771
  186   HD13  LEU  23          HD13      LEU  23  -4.801  -6.453  -0.479
  187   HD21  LEU  23          HD21      LEU  23  -4.598  -5.650   2.266
  188   HD22  LEU  23          HD22      LEU  23  -6.241  -5.583   2.896
  189   HD23  LEU  23          HD23      LEU  23  -5.848  -4.782   1.375
  190    H    THR  24           HN       THR  24  -8.170  -6.540   3.922
  191    HA   THR  24           HA       THR  24  -8.546  -3.596   3.777
  192    HB   THR  24           HB       THR  24  -9.790  -5.363   5.891
  193    HG1  THR  24           HG1      THR  24 -11.225  -5.491   4.297
  194   HG21  THR  24          HG21      THR  24  -9.930  -2.369   5.493
  195   HG22  THR  24          HG22      THR  24  -9.061  -3.203   6.783
  196   HG23  THR  24          HG23      THR  24 -10.821  -3.291   6.705
  197    H    ILE  25           HN       ILE  25  -6.347  -3.197   3.977
  198    HA   ILE  25           HA       ILE  25  -5.295  -3.748   6.702
  199    HB   ILE  25           HB       ILE  25  -4.424  -5.411   4.963
  200   HG12  ILE  25          HG12      ILE  25  -2.185  -3.863   6.227
  201   HG13  ILE  25          HG11      ILE  25  -3.382  -4.667   7.239
  202   HG21  ILE  25          HG21      ILE  25  -2.747  -3.056   4.118
  203   HG22  ILE  25          HG22      ILE  25  -4.093  -3.709   3.186
  204   HG23  ILE  25          HG23      ILE  25  -2.670  -4.703   3.494
  205   HD11  ILE  25          HD11      ILE  25  -1.699  -6.023   5.149
  206   HD12  ILE  25          HD12      ILE  25  -2.827  -6.798   6.262
  207   HD13  ILE  25          HD13      ILE  25  -1.371  -6.019   6.881
  208    H    SER  26           HN       SER  26  -3.410  -2.400   7.291
  209    HA   SER  26           HA       SER  26  -3.539   0.224   5.873
  210    HB2  SER  26           HB2      SER  26  -4.635   0.290   8.072
  211    HB3  SER  26           HB1      SER  26  -3.158  -0.298   8.830
  212    HG   SER  26           HG       SER  26  -2.452   1.667   8.836
  213    H    LEU  27           HN       LEU  27  -1.638   1.677   6.574
  214    HA   LEU  27           HA       LEU  27   0.769   0.670   5.502
  215    HB2  LEU  27           HB2      LEU  27   0.485   2.939   7.451
  216    HB3  LEU  27           HB1      LEU  27   1.797   2.686   6.317
  217    HG   LEU  27           HG       LEU  27  -1.051   3.445   5.674
  218   HD11  LEU  27          HD11      LEU  27   0.378   5.267   6.439
  219   HD12  LEU  27          HD12      LEU  27  -0.021   5.440   4.730
  220   HD13  LEU  27          HD13      LEU  27   1.571   4.854   5.209
  221   HD21  LEU  27          HD21      LEU  27   1.191   2.800   3.761
  222   HD22  LEU  27          HD22      LEU  27  -0.402   3.421   3.328
  223   HD23  LEU  27          HD23      LEU  27  -0.244   1.813   4.035
  224    H    ASP  28           HN       ASP  28   0.249   1.555   8.933
  225    HA   ASP  28           HA       ASP  28   2.676   0.371   9.833
  226    HB2  ASP  28           HB2      ASP  28   1.343   2.086  11.068
  227    HB3  ASP  28           HB1      ASP  28   0.153   0.842  11.439
  228    H    GLU  29           HN       GLU  29  -0.573  -0.919   9.390
  229    HA   GLU  29           HA       GLU  29   0.024  -3.388  10.808
  230    HB2  GLU  29           HB2      GLU  29  -2.294  -2.398   9.174
  231    HB3  GLU  29           HB1      GLU  29  -2.208  -4.069   9.707
  232    HG2  GLU  29           HG2      GLU  29  -3.564  -2.757  11.219
  233    HG3  GLU  29           HG1      GLU  29  -2.109  -3.330  12.032
  234    H    LEU  30           HN       LEU  30   1.129  -2.298   7.856
  235    HA   LEU  30           HA       LEU  30   1.296  -5.111   6.913
  236    HB2  LEU  30           HB2      LEU  30  -0.405  -3.937   5.598
  237    HB3  LEU  30           HB1      LEU  30   0.750  -2.686   5.191
  238    HG   LEU  30           HG       LEU  30   2.043  -4.248   3.857
  239   HD11  LEU  30          HD11      LEU  30   1.157  -6.539   3.455
  240   HD12  LEU  30          HD12      LEU  30   0.036  -6.290   4.792
  241   HD13  LEU  30          HD13      LEU  30   1.774  -6.281   5.086
  242   HD21  LEU  30          HD21      LEU  30   0.409  -4.700   2.096
  243   HD22  LEU  30          HD22      LEU  30   0.200  -3.087   2.778
  244   HD23  LEU  30          HD23      LEU  30  -0.900  -4.386   3.234
  245    H    PHE  31           HN       PHE  31   3.136  -2.852   8.186
  246    HA   PHE  31           HA       PHE  31   5.368  -3.656   6.443
  247    HB2  PHE  31           HB2      PHE  31   5.052  -0.814   7.443
  248    HB3  PHE  31           HB1      PHE  31   6.431  -1.421   6.534
  249    HD1  PHE  31           HD1      PHE  31   5.473  -2.813   4.311
  250    HD2  PHE  31           HD2      PHE  31   3.720   0.566   6.209
  251    HE1  PHE  31           HE1      PHE  31   4.335  -2.225   2.210
  252    HE2  PHE  31           HE2      PHE  31   2.578   1.157   4.113
  253    HZ   PHE  31           HZ       PHE  31   2.882  -0.242   2.112
  254    H    SER  32           HN       SER  32   7.350  -4.065   7.422
  255    HA   SER  32           HA       SER  32   7.417  -3.670  10.366
  256    HB2  SER  32           HB2      SER  32   8.158  -6.197   8.895
  257    HB3  SER  32           HB1      SER  32   8.360  -5.930  10.627
  258    HG   SER  32           HG       SER  32   6.196  -5.954  10.898
  259    H    SER  33           HN       SER  33   8.715  -2.135   8.203
  260    HA   SER  33           HA       SER  33  11.410  -2.166   9.236
  261    HB2  SER  33           HB2      SER  33  11.706  -4.056   7.754
  262    HB3  SER  33           HB1      SER  33  10.980  -3.165   6.417
  263    HG   SER  33           HG       SER  33  13.054  -2.798   6.052
  264    H    ARG  34           HN       ARG  34  12.478  -0.270   8.918
  265    HA   ARG  34           HA       ARG  34  10.944   1.937   7.950
  266    HB2  ARG  34           HB2      ARG  34  12.986   3.260   8.294
  267    HB3  ARG  34           HB1      ARG  34  12.657   2.212   9.666
  268    HG2  ARG  34           HG2      ARG  34  14.336   0.616   8.799
  269    HG3  ARG  34           HG1      ARG  34  14.706   1.756   7.506
  270    HD2  ARG  34           HD2      ARG  34  16.332   2.037   9.228
  271    HD3  ARG  34           HD1      ARG  34  15.273   3.443   9.247
  272    HE   ARG  34           HE       ARG  34  14.078   2.305  11.167
  273   HH11  ARG  34          HH11      ARG  34  17.500   1.640  10.472
  274   HH12  ARG  34          HH12      ARG  34  17.861   1.200  12.105
  275   HH21  ARG  34          HH21      ARG  34  14.616   1.720  13.297
  276   HH22  ARG  34          HH22      ARG  34  16.232   1.247  13.705
  277    H    GLY  35           HN       GLY  35  13.684   0.115   6.547
  278    HA2  GLY  35           HA2      GLY  35  13.852   1.711   4.166
  279    HA3  GLY  35           HA1      GLY  35  14.488   0.087   4.374
  280    H    GLU  36           HN       GLU  36  11.957  -1.148   5.057
  281    HA   GLU  36           HA       GLU  36  11.032  -1.843   2.477
  282    HB2  GLU  36           HB2      GLU  36  10.662  -3.283   4.394
  283    HB3  GLU  36           HB1      GLU  36   9.675  -2.057   5.174
  284    HG2  GLU  36           HG2      GLU  36   8.247  -3.748   4.286
  285    HG3  GLU  36           HG1      GLU  36   8.029  -2.277   3.342
  286    H    PHE  37           HN       PHE  37   9.827   0.503   4.860
  287    HA   PHE  37           HA       PHE  37   7.480   1.286   3.476
  288    HB2  PHE  37           HB2      PHE  37   8.265   1.862   5.864
  289    HB3  PHE  37           HB1      PHE  37   9.177   3.165   5.113
  290    HD1  PHE  37           HD2      PHE  37   5.818   1.878   5.839
  291    HD2  PHE  37           HD1      PHE  37   8.089   5.121   4.276
  292    HE1  PHE  37           HE2      PHE  37   3.818   3.309   5.911
  293    HE2  PHE  37           HE1      PHE  37   6.093   6.556   4.348
  294    HZ   PHE  37           HZ       PHE  37   3.955   5.650   5.166
  295    H    ILE  38           HN       ILE  38  10.831   2.538   3.332
  296    HA   ILE  38           HA       ILE  38  10.432   4.651   1.557
  297    HB   ILE  38           HB       ILE  38  12.797   2.775   1.690
  298   HG12  ILE  38          HG12      ILE  38  12.370   3.798   3.840
  299   HG13  ILE  38          HG11      ILE  38  13.771   4.578   3.114
  300   HG21  ILE  38          HG21      ILE  38  12.828   4.036  -0.382
  301   HG22  ILE  38          HG22      ILE  38  14.077   4.629   0.710
  302   HG23  ILE  38          HG23      ILE  38  12.581   5.540   0.505
  303   HD11  ILE  38          HD11      ILE  38  10.970   5.673   3.220
  304   HD12  ILE  38          HD12      ILE  38  12.336   6.447   2.416
  305   HD13  ILE  38          HD13      ILE  38  12.357   6.218   4.164
  306    H    SER  39           HN       SER  39  11.261   1.240   0.699
  307    HA   SER  39           HA       SER  39  11.214   1.671  -2.107
  308    HB2  SER  39           HB2      SER  39  12.148  -0.360  -1.034
  309    HB3  SER  39           HB1      SER  39  10.521  -0.883  -0.606
  310    HG   SER  39           HG       SER  39  11.024  -1.902  -2.496
  311    H    VAL  40           HN       VAL  40   8.673  -0.065  -0.205
  312    HA   VAL  40           HA       VAL  40   6.711  -0.343  -1.948
  313    HB   VAL  40           HB       VAL  40   5.003   0.113  -0.215
  314   HG11  VAL  40          HG11      VAL  40   7.448  -1.494   0.436
  315   HG12  VAL  40          HG12      VAL  40   5.888  -2.046  -0.174
  316   HG13  VAL  40          HG13      VAL  40   6.036  -1.490   1.492
  317   HG21  VAL  40          HG21      VAL  40   7.339   1.016   1.459
  318   HG22  VAL  40          HG22      VAL  40   5.679   0.808   2.010
  319   HG23  VAL  40          HG23      VAL  40   6.067   2.062   0.832
  320    H    GLY  41           HN       GLY  41   7.467   2.955  -0.654
  321    HA2  GLY  41           HA2      GLY  41   7.021   4.597  -2.553
  322    HA3  GLY  41           HA1      GLY  41   5.384   3.954  -2.533
  323    H    GLY  42           HN       GLY  42   7.571   4.694   0.212
  324    HA2  GLY  42           HA2      GLY  42   5.534   6.706   1.071
  325    HA3  GLY  42           HA1      GLY  42   6.274   5.581   2.188
  326    H    ASP  43           HN       ASP  43   6.704   8.446   0.239
  327    HA   ASP  43           HA       ASP  43   9.394   8.939   1.306
  328    HB2  ASP  43           HB2      ASP  43   7.520  10.666  -0.334
  329    HB3  ASP  43           HB1      ASP  43   9.148  11.149   0.133
  330    H    GLY  44           HN       GLY  44   6.569  11.171   1.315
  331    HA2  GLY  44           HA2      GLY  44   6.693  11.272   4.263
  332    HA3  GLY  44           HA1      GLY  44   7.155  12.738   3.420
  333    H    ARG  45           HN       ARG  45   5.546  13.610   1.821
  334    HA   ARG  45           HA       ARG  45   2.914  13.538   3.139
  335    HB2  ARG  45           HB2      ARG  45   4.066  15.309   0.980
  336    HB3  ARG  45           HB1      ARG  45   2.408  15.430   1.549
  337    HG2  ARG  45           HG2      ARG  45   3.638  17.098   2.680
  338    HG3  ARG  45           HG1      ARG  45   3.331  15.818   3.852
  339    HD2  ARG  45           HD2      ARG  45   5.632  16.689   3.978
  340    HD3  ARG  45           HD1      ARG  45   5.577  14.973   3.584
  341    HE   ARG  45           HE       ARG  45   5.735  16.773   1.280
  342   HH11  ARG  45          HH11      ARG  45   7.534  14.837   3.639
  343   HH12  ARG  45          HH12      ARG  45   8.949  14.727   2.650
  344   HH21  ARG  45          HH21      ARG  45   7.618  16.601   0.010
  345   HH22  ARG  45          HH22      ARG  45   8.997  15.727   0.588
  346    H    MET  46           HN       MET  46   1.901  11.669   2.584
  347    HA   MET  46           HA       MET  46   1.828  10.818  -0.214
  348    HB2  MET  46           HB2      MET  46   1.751   9.398   2.020
  349    HB3  MET  46           HB1      MET  46   0.020   9.662   1.864
  350    HG2  MET  46           HG2      MET  46   0.055   7.812   0.621
  351    HG3  MET  46           HG1      MET  46   0.676   8.859  -0.650
  352    HE1  MET  46           HE1      MET  46   4.536   8.256  -0.402
  353    HE2  MET  46           HE2      MET  46   3.619   9.514   0.425
  354    HE3  MET  46           HE3      MET  46   3.243   9.107  -1.249
  355    H    SER  47           HN       SER  47  -0.316  10.257  -1.244
  356    HA   SER  47           HA       SER  47  -1.987  12.671  -1.086
  357    HB2  SER  47           HB2      SER  47  -1.257  11.863  -3.283
  358    HB3  SER  47           HB1      SER  47  -2.082  10.332  -3.006
  359    HG   SER  47           HG       SER  47  -3.985  11.279  -3.306
  360    H    HIS  48           HN       HIS  48  -2.878   9.242  -1.571
  361    HA   HIS  48           HA       HIS  48  -4.581   8.930   0.698
  362    HB2  HIS  48           HB2      HIS  48  -6.053  10.590  -0.103
  363    HB3  HIS  48           HB1      HIS  48  -5.844  10.081  -1.774
  364    HD1  HIS  48           HD1      HIS  48  -7.887   9.508   1.273
  365    HD2  HIS  48           HD2      HIS  48  -7.286   7.698  -2.465
  366    HE1  HIS  48           HE1      HIS  48  -9.818   7.898   0.937
  367    HE2  HIS  48           HE2      HIS  48  -9.409   6.739  -1.288
  368    H    LYS  49           HN       LYS  49  -4.985   8.276  -2.811
  369    HA   LYS  49           HA       LYS  49  -5.518   5.488  -2.344
  370    HB2  LYS  49           HB2      LYS  49  -6.351   6.674  -4.303
  371    HB3  LYS  49           HB1      LYS  49  -4.714   7.022  -4.830
  372    HG2  LYS  49           HG2      LYS  49  -5.703   4.209  -4.525
  373    HG3  LYS  49           HG1      LYS  49  -5.986   5.140  -5.994
  374    HD2  LYS  49           HD2      LYS  49  -3.358   4.278  -4.810
  375    HD3  LYS  49           HD1      LYS  49  -4.030   3.872  -6.384
  376    HE2  LYS  49           HE2      LYS  49  -3.815   6.226  -7.066
  377    HE3  LYS  49           HE1      LYS  49  -3.104   6.602  -5.498
  378    HZ1  LYS  49           HZ1      LYS  49  -1.406   6.301  -7.184
  379    HZ2  LYS  49           HZ2      LYS  49  -1.962   4.737  -7.509
  380    HZ3  LYS  49           HZ3      LYS  49  -1.280   5.097  -6.003
  381    H    GLU  50           HN       GLU  50  -2.622   7.403  -2.996
  382    HA   GLU  50           HA       GLU  50  -0.878   5.349  -3.835
  383    HB2  GLU  50           HB2      GLU  50  -0.363   7.717  -4.037
  384    HB3  GLU  50           HB1      GLU  50  -0.318   7.883  -2.289
  385    HG2  GLU  50           HG2      GLU  50   1.914   7.814  -3.286
  386    HG3  GLU  50           HG1      GLU  50   1.639   6.488  -2.159
  387    H    ALA  51           HN       ALA  51  -1.340   6.699  -0.529
  388    HA   ALA  51           HA       ALA  51   0.533   5.187   0.831
  389    HB1  ALA  51           HB1      ALA  51  -2.230   5.845   1.853
  390    HB2  ALA  51           HB2      ALA  51  -0.851   6.945   1.860
  391    HB3  ALA  51           HB3      ALA  51  -0.812   5.476   2.835
  392    H    ILE  52           HN       ILE  52  -2.898   4.126   0.307
  393    HA   ILE  52           HA       ILE  52  -2.415   1.654   1.601
  394    HB   ILE  52           HB       ILE  52  -4.466   2.288  -0.554
  395   HG12  ILE  52          HG12      ILE  52  -4.619   3.666   1.499
  396   HG13  ILE  52          HG11      ILE  52  -6.010   2.615   1.297
  397   HG21  ILE  52          HG21      ILE  52  -4.347  -0.061   1.333
  398   HG22  ILE  52          HG22      ILE  52  -4.151  -0.109  -0.419
  399   HG23  ILE  52          HG23      ILE  52  -5.705   0.338   0.282
  400   HD11  ILE  52          HD11      ILE  52  -5.302   2.677   3.608
  401   HD12  ILE  52          HD12      ILE  52  -3.685   2.145   3.146
  402   HD13  ILE  52          HD13      ILE  52  -5.063   1.064   2.938
  403    H    LEU  53           HN       LEU  53  -2.238   2.563  -1.863
  404    HA   LEU  53           HA       LEU  53  -1.910  -0.025  -2.893
  405    HB2  LEU  53           HB2      LEU  53  -2.193   2.146  -4.170
  406    HB3  LEU  53           HB1      LEU  53  -0.494   2.493  -3.932
  407    HG   LEU  53           HG       LEU  53   0.075   0.440  -5.199
  408   HD11  LEU  53          HD11      LEU  53  -1.690  -0.644  -6.524
  409   HD12  LEU  53          HD12      LEU  53  -2.899   0.316  -5.671
  410   HD13  LEU  53          HD13      LEU  53  -1.925  -0.860  -4.790
  411   HD21  LEU  53          HD21      LEU  53  -0.532   1.323  -7.395
  412   HD22  LEU  53          HD22      LEU  53   0.001   2.608  -6.309
  413   HD23  LEU  53          HD23      LEU  53  -1.718   2.388  -6.639
  414    H    LEU  54           HN       LEU  54   0.519   1.945  -1.164
  415    HA   LEU  54           HA       LEU  54   2.956   0.900  -1.924
  416    HB2  LEU  54           HB2      LEU  54   1.740   1.665   0.719
  417    HB3  LEU  54           HB1      LEU  54   3.267   0.818   0.758
  418    HG   LEU  54           HG       LEU  54   4.280   2.557  -0.649
  419   HD11  LEU  54          HD11      LEU  54   3.059   4.633  -1.081
  420   HD12  LEU  54          HD12      LEU  54   1.597   3.906  -0.419
  421   HD13  LEU  54          HD13      LEU  54   2.315   3.255  -1.893
  422   HD21  LEU  54          HD21      LEU  54   4.406   2.754   1.772
  423   HD22  LEU  54          HD22      LEU  54   2.863   3.607   1.798
  424   HD23  LEU  54          HD23      LEU  54   4.267   4.345   1.026
  425    H    GLY  55           HN       GLY  55   0.400  -0.758  -0.001
  426    HA2  GLY  55           HA2      GLY  55   1.747  -2.920   1.077
  427    HA3  GLY  55           HA1      GLY  55   0.101  -2.994   0.483
  428    H    LEU  56           HN       LEU  56   0.480  -2.753  -2.283
  429    HA   LEU  56           HA       LEU  56   0.975  -5.384  -3.036
  430    HB2  LEU  56           HB2      LEU  56   1.546  -2.986  -4.778
  431    HB3  LEU  56           HB1      LEU  56   1.185  -4.613  -5.320
  432    HG   LEU  56           HG       LEU  56  -0.700  -2.656  -4.019
  433   HD11  LEU  56          HD11      LEU  56  -0.658  -4.017  -6.706
  434   HD12  LEU  56          HD12      LEU  56  -0.369  -2.308  -6.381
  435   HD13  LEU  56          HD13      LEU  56  -1.967  -3.000  -6.105
  436   HD21  LEU  56          HD21      LEU  56  -2.408  -4.452  -4.265
  437   HD22  LEU  56          HD22      LEU  56  -1.187  -4.787  -3.037
  438   HD23  LEU  56          HD23      LEU  56  -1.099  -5.584  -4.606
  439    H    ARG  57           HN       ARG  57   3.322  -2.696  -2.940
  440    HA   ARG  57           HA       ARG  57   5.494  -4.153  -4.070
  441    HB2  ARG  57           HB2      ARG  57   5.555  -1.874  -2.083
  442    HB3  ARG  57           HB1      ARG  57   6.922  -2.425  -3.039
  443    HG2  ARG  57           HG2      ARG  57   4.374  -1.223  -4.106
  444    HG3  ARG  57           HG1      ARG  57   5.943  -0.424  -3.996
  445    HD2  ARG  57           HD2      ARG  57   5.337  -2.880  -5.643
  446    HD3  ARG  57           HD1      ARG  57   5.462  -1.236  -6.266
  447    HE   ARG  57           HE       ARG  57   7.855  -1.816  -4.880
  448   HH11  ARG  57          HH11      ARG  57   6.117  -2.858  -7.783
  449   HH12  ARG  57          HH12      ARG  57   7.557  -3.308  -8.629
  450   HH21  ARG  57          HH21      ARG  57   9.726  -2.419  -6.030
  451   HH22  ARG  57          HH22      ARG  57   9.608  -3.059  -7.636
  452    H    TYR  58           HN       TYR  58   4.260  -3.901  -0.766
  453    HA   TYR  58           HA       TYR  58   6.468  -5.169   0.533
  454    HB2  TYR  58           HB2      TYR  58   4.702  -3.844   1.680
  455    HB3  TYR  58           HB1      TYR  58   3.556  -5.137   1.359
  456    HD1  TYR  58           HD2      TYR  58   6.571  -4.213   3.265
  457    HD2  TYR  58           HD1      TYR  58   3.515  -7.116   2.697
  458    HE1  TYR  58           HE2      TYR  58   7.231  -5.307   5.365
  459    HE2  TYR  58           HE1      TYR  58   4.165  -8.219   4.797
  460    HH   TYR  58           HH       TYR  58   6.170  -6.790   7.085
  461    H    LYS  59           HN       LYS  59   3.362  -6.417  -0.685
  462    HA   LYS  59           HA       LYS  59   4.037  -9.167  -0.008
  463    HB2  LYS  59           HB2      LYS  59   1.758  -7.966  -1.572
  464    HB3  LYS  59           HB1      LYS  59   1.886  -9.667  -1.152
  465    HG2  LYS  59           HG2      LYS  59   1.797  -7.427   0.856
  466    HG3  LYS  59           HG1      LYS  59   0.394  -8.365   0.340
  467    HD2  LYS  59           HD2      LYS  59   1.328 -10.380   1.232
  468    HD3  LYS  59           HD1      LYS  59   2.871  -9.585   1.552
  469    HE2  LYS  59           HE2      LYS  59   1.800  -8.149   3.203
  470    HE3  LYS  59           HE1      LYS  59   0.242  -8.901   2.866
  471    HZ1  LYS  59           HZ1      LYS  59   1.261  -9.817   4.854
  472    HZ2  LYS  59           HZ2      LYS  59   2.626 -10.285   3.974
  473    HZ3  LYS  59           HZ3      LYS  59   1.128 -11.005   3.657
  474    H    LYS  60           HN       LYS  60   4.820  -7.105  -2.590
  475    HA   LYS  60           HA       LYS  60   5.881  -7.479  -4.565
  476    HB2  LYS  60           HB2      LYS  60   6.100 -10.353  -3.655
  477    HB3  LYS  60           HB1      LYS  60   6.968  -9.640  -5.006
  478    HG2  LYS  60           HG2      LYS  60   7.732  -7.938  -3.114
  479    HG3  LYS  60           HG1      LYS  60   7.403  -9.338  -2.093
  480    HD2  LYS  60           HD2      LYS  60   9.718  -9.369  -2.738
  481    HD3  LYS  60           HD1      LYS  60   8.883 -10.691  -3.556
  482    HE2  LYS  60           HE2      LYS  60   8.741  -9.346  -5.592
  483    HE3  LYS  60           HE1      LYS  60   9.548  -8.009  -4.774
  484    HZ1  LYS  60           HZ1      LYS  60  10.722 -10.683  -5.326
  485    HZ2  LYS  60           HZ2      LYS  60  11.500  -9.433  -4.493
  486    HZ3  LYS  60           HZ3      LYS  60  11.103  -9.241  -6.125
  487    H    LEU  61           HN       LEU  61   3.639  -6.972  -5.263
  488    HA   LEU  61           HA       LEU  61   2.954  -8.742  -7.414
  489    HB2  LEU  61           HB2      LEU  61   0.484  -8.959  -6.521
  490    HB3  LEU  61           HB1      LEU  61   1.708 -10.136  -6.099
  491    HG   LEU  61           HG       LEU  61   2.044  -9.005  -3.932
  492   HD11  LEU  61          HD11      LEU  61   1.339  -6.747  -4.712
  493   HD12  LEU  61          HD12      LEU  61   0.612  -7.250  -3.187
  494   HD13  LEU  61          HD13      LEU  61  -0.331  -7.314  -4.674
  495   HD21  LEU  61          HD21      LEU  61   0.460 -10.865  -4.134
  496   HD22  LEU  61          HD22      LEU  61  -0.833  -9.716  -4.482
  497   HD23  LEU  61          HD23      LEU  61  -0.041  -9.702  -2.907
  498    H    TYR  62           HN       TYR  62   3.584  -5.894  -6.881
  499    HA   TYR  62           HA       TYR  62   1.300  -4.259  -7.133
  500    HB2  TYR  62           HB2      TYR  62   3.642  -3.526  -6.639
  501    HB3  TYR  62           HB1      TYR  62   4.025  -3.755  -8.340
  502    HD1  TYR  62           HD1      TYR  62   2.239  -1.669  -5.911
  503    HD2  TYR  62           HD2      TYR  62   3.221  -2.193 -10.018
  504    HE1  TYR  62           HE1      TYR  62   1.512   0.632  -6.372
  505    HE2  TYR  62           HE2      TYR  62   2.492   0.108 -10.490
  506    HH   TYR  62           HH       TYR  62   0.948   1.804  -9.463
  507    H    ASN  63           HN       ASN  63   2.637  -6.447  -9.453
  508    HA   ASN  63           HA       ASN  63   1.748  -4.967 -11.785
  509    HB2  ASN  63           HB2      ASN  63   3.667  -6.566 -11.779
  510    HB3  ASN  63           HB1      ASN  63   2.511  -7.883 -11.603
  511   HD21  ASN  63          HD21      ASN  63   1.171  -8.462 -13.312
  512   HD22  ASN  63          HD22      ASN  63   1.494  -7.885 -14.984
  513    H    GLN  64           HN       GLN  64   0.708  -8.227 -10.597
  514    HA   GLN  64           HA       GLN  64  -1.767  -7.853 -12.113
  515    HB2  GLN  64           HB2      GLN  64  -0.521  -9.998 -12.183
  516    HB3  GLN  64           HB1      GLN  64  -0.877 -10.229 -10.478
  517    HG2  GLN  64           HG2      GLN  64  -2.374 -11.555 -11.805
  518    HG3  GLN  64           HG1      GLN  64  -3.277 -10.274 -11.004
  519   HE21  GLN  64          HE21      GLN  64  -4.980 -10.413 -12.460
  520   HE22  GLN  64          HE22      GLN  64  -4.821  -9.794 -14.140
  521    H    ALA  65           HN       ALA  65  -0.777  -7.352  -8.837
  522    HA   ALA  65           HA       ALA  65  -3.264  -8.055  -7.560
  523    HB1  ALA  65           HB1      ALA  65  -1.223  -6.032  -6.658
  524    HB2  ALA  65           HB2      ALA  65  -1.119  -7.770  -6.376
  525    HB3  ALA  65           HB3      ALA  65  -2.437  -6.839  -5.667
  526    H    ARG  66           HN       ARG  66  -1.980  -5.010  -8.908
  527    HA   ARG  66           HA       ARG  66  -4.187  -3.400  -8.043
  528    HB2  ARG  66           HB2      ARG  66  -1.875  -2.626  -8.733
  529    HB3  ARG  66           HB1      ARG  66  -2.390  -2.847 -10.398
  530    HG2  ARG  66           HG2      ARG  66  -4.078  -1.171 -10.173
  531    HG3  ARG  66           HG1      ARG  66  -3.796  -1.053  -8.435
  532    HD2  ARG  66           HD2      ARG  66  -2.742   0.808  -9.543
  533    HD3  ARG  66           HD1      ARG  66  -1.501  -0.263  -8.898
  534    HE   ARG  66           HE       ARG  66  -1.733  -1.173 -11.440
  535   HH11  ARG  66          HH11      ARG  66  -1.383   2.097 -10.127
  536   HH12  ARG  66          HH12      ARG  66  -0.530   2.690 -11.511
  537   HH21  ARG  66          HH21      ARG  66  -0.607  -0.349 -13.241
  538   HH22  ARG  66          HH22      ARG  66  -0.089   1.303 -13.278
  539    H    VAL  67           HN       VAL  67  -3.792  -5.569 -10.757
  540    HA   VAL  67           HA       VAL  67  -6.096  -4.328 -12.143
  541    HB   VAL  67           HB       VAL  67  -5.645  -6.016 -13.931
  542   HG11  VAL  67          HG11      VAL  67  -3.627  -4.898 -14.764
  543   HG12  VAL  67          HG12      VAL  67  -3.358  -4.209 -13.163
  544   HG13  VAL  67          HG13      VAL  67  -4.787  -3.753 -14.091
  545   HG21  VAL  67          HG21      VAL  67  -4.528  -7.703 -12.542
  546   HG22  VAL  67          HG22      VAL  67  -3.169  -6.605 -12.311
  547   HG23  VAL  67          HG23      VAL  67  -3.536  -7.226 -13.918
  548    H    LYS  68           HN       LYS  68  -5.180  -7.394 -10.551
  549    HA   LYS  68           HA       LYS  68  -7.617  -8.749 -11.211
  550    HB2  LYS  68           HB2      LYS  68  -6.966 -10.396  -9.593
  551    HB3  LYS  68           HB1      LYS  68  -5.519  -9.858 -10.431
  552    HG2  LYS  68           HG2      LYS  68  -4.893  -8.480  -8.554
  553    HG3  LYS  68           HG1      LYS  68  -6.398  -8.873  -7.729
  554    HD2  LYS  68           HD2      LYS  68  -4.578 -10.193  -6.822
  555    HD3  LYS  68           HD1      LYS  68  -5.728 -11.236  -7.659
  556    HE2  LYS  68           HE2      LYS  68  -4.262 -11.273  -9.620
  557    HE3  LYS  68           HE1      LYS  68  -3.115 -10.228  -8.782
  558    HZ1  LYS  68           HZ1      LYS  68  -2.828 -11.965  -7.114
  559    HZ2  LYS  68           HZ2      LYS  68  -2.431 -12.529  -8.658
  560    HZ3  LYS  68           HZ3      LYS  68  -3.903 -12.968  -7.951
  561    H    TYR  69           HN       TYR  69  -6.704  -6.545  -8.616
  562    HA   TYR  69           HA       TYR  69  -9.451  -6.827  -7.489
  563    HB2  TYR  69           HB2      TYR  69  -6.815  -6.071  -6.259
  564    HB3  TYR  69           HB1      TYR  69  -8.322  -5.551  -5.515
  565    HD1  TYR  69           HD2      TYR  69  -9.945  -7.271  -4.705
  566    HD2  TYR  69           HD1      TYR  69  -6.041  -8.305  -6.039
  567    HE1  TYR  69           HE2      TYR  69 -10.142  -9.444  -3.578
  568    HE2  TYR  69           HE1      TYR  69  -6.229 -10.483  -4.919
  569    HH   TYR  69           HH       TYR  69  -7.543 -11.458  -2.986
  570    H    SER  70           HN       SER  70 -10.438  -4.822  -6.621
  571    HA   SER  70           HA       SER  70 -10.177  -2.709  -8.624
  572    HB2  SER  70           HB2      SER  70 -12.389  -3.468  -7.760
  573    HB3  SER  70           HB1      SER  70 -11.965  -2.809  -6.180
  574    HG   SER  70           HG       SER  70 -13.234  -1.445  -7.724
  575    H    LEU  71           HN       LEU  71  -8.190  -1.734  -8.337
  576    HA   LEU  71           HA       LEU  71  -7.840  -0.316  -5.732
  577    HB2  LEU  71           HB2      LEU  71  -5.806  -1.249  -7.756
  578    HB3  LEU  71           HB1      LEU  71  -5.417  -0.148  -6.447
  579    HG   LEU  71           HG       LEU  71  -6.258  -1.969  -4.867
  580   HD11  LEU  71          HD11      LEU  71  -7.472  -3.376  -6.337
  581   HD12  LEU  71          HD12      LEU  71  -6.045  -4.277  -5.823
  582   HD13  LEU  71          HD13      LEU  71  -6.093  -3.539  -7.425
  583   HD21  LEU  71          HD21      LEU  71  -3.931  -1.498  -5.002
  584   HD22  LEU  71          HD22      LEU  71  -3.788  -2.342  -6.543
  585   HD23  LEU  71          HD23      LEU  71  -4.118  -3.250  -5.068
  586    H    LEU  72           HN       LEU  72  -6.743   0.086  -9.134
  587    HA   LEU  72           HA       LEU  72  -7.355   2.987  -8.839
  588    HB2  LEU  72           HB2      LEU  72  -5.404   1.466 -10.539
  589    HB3  LEU  72           HB1      LEU  72  -5.903   3.085 -10.986
  590    HG   LEU  72           HG       LEU  72  -3.779   3.126  -9.794
  591   HD11  LEU  72          HD11      LEU  72  -5.969   4.254  -8.059
  592   HD12  LEU  72          HD12      LEU  72  -5.391   4.995  -9.551
  593   HD13  LEU  72          HD13      LEU  72  -4.303   4.817  -8.177
  594   HD21  LEU  72          HD21      LEU  72  -5.252   2.037  -7.402
  595   HD22  LEU  72          HD22      LEU  72  -3.532   2.401  -7.536
  596   HD23  LEU  72          HD23      LEU  72  -4.224   1.061  -8.450
  597    H    GLU  73           HN       GLU  73  -8.916   3.924  -9.979
  598    HA   GLU  73           HA       GLU  73  -9.907   2.520 -12.402
  599    HB2  GLU  73           HB2      GLU  73 -11.712   3.585 -10.221
  600    HB3  GLU  73           HB1      GLU  73 -12.226   2.823 -11.720
  601    HG2  GLU  73           HG2      GLU  73 -11.147   0.733 -10.999
  602    HG3  GLU  73           HG1      GLU  73 -10.705   1.507  -9.479
  Start of MODEL   19
    1    H1   SER   1           HT1      SER   1   0.323  13.662  10.263
    2    H2   SER   1           HT2      SER   1  -0.851  13.219   9.131
    3    H3   SER   1           HT3      SER   1  -1.141  14.507  10.187
    4    HA   SER   1           HA       SER   1  -0.629  15.420   8.081
    5    HB2  SER   1           HB2      SER   1   0.307  16.574  10.052
    6    HB3  SER   1           HB1      SER   1   1.785  15.628   9.898
    7    HG   SER   1           HG       SER   1   2.136  17.563   8.877
    8    H    ASP   2           HN       ASP   2   1.822  13.055   9.137
    9    HA   ASP   2           HA       ASP   2   2.849  13.019   6.337
   10    HB2  ASP   2           HB2      ASP   2   4.438  13.480   8.284
   11    HB3  ASP   2           HB1      ASP   2   4.189  11.803   8.762
   12    H    VAL   3           HN       VAL   3   3.386  10.966   5.377
   13    HA   VAL   3           HA       VAL   3   1.262   9.090   5.559
   14    HB   VAL   3           HB       VAL   3   2.729   9.414   3.565
   15   HG11  VAL   3          HG11      VAL   3   4.699   7.664   5.028
   16   HG12  VAL   3          HG12      VAL   3   4.884   9.403   4.812
   17   HG13  VAL   3          HG13      VAL   3   4.863   8.338   3.406
   18   HG21  VAL   3          HG21      VAL   3   2.720   7.068   2.881
   19   HG22  VAL   3          HG22      VAL   3   1.237   7.494   3.733
   20   HG23  VAL   3          HG23      VAL   3   2.496   6.577   4.558
   21    H    TRP   4           HN       TRP   4   4.445   9.183   7.112
   22    HA   TRP   4           HA       TRP   4   4.216   6.472   8.144
   23    HB2  TRP   4           HB2      TRP   4   6.269   8.377   7.886
   24    HB3  TRP   4           HB1      TRP   4   6.072   8.128   9.618
   25    HD1  TRP   4           HD1      TRP   4   5.762   5.187  10.062
   26    HE1  TRP   4           HE1      TRP   4   7.501   3.406   9.325
   27    HE3  TRP   4           HE3      TRP   4   8.121   7.903   6.428
   28    HZ2  TRP   4           HZ2      TRP   4   9.591   3.245   7.427
   29    HZ3  TRP   4           HZ3      TRP   4   9.981   6.862   5.200
   30    HH2  TRP   4           HH2      TRP   4  10.701   4.581   5.690
   31    H    SER   5           HN       SER   5   3.602   9.767   9.362
   32    HA   SER   5           HA       SER   5   3.156   9.064  12.078
   33    HB2  SER   5           HB2      SER   5   3.383  11.395  11.289
   34    HB3  SER   5           HB1      SER   5   1.836  11.260  10.453
   35    HG   SER   5           HG       SER   5   0.842  11.569  12.281
   36    H    LEU   6           HN       LEU   6   0.834   9.460   9.377
   37    HA   LEU   6           HA       LEU   6  -1.218   8.066  10.998
   38    HB2  LEU   6           HB2      LEU   6  -1.463   9.396   8.296
   39    HB3  LEU   6           HB1      LEU   6  -2.784   8.778   9.267
   40    HG   LEU   6           HG       LEU   6  -1.012  11.122   9.963
   41   HD11  LEU   6          HD11      LEU   6  -2.617  11.589   8.181
   42   HD12  LEU   6          HD12      LEU   6  -3.034  12.444   9.665
   43   HD13  LEU   6          HD13      LEU   6  -3.927  10.996   9.202
   44   HD21  LEU   6          HD21      LEU   6  -3.351   9.941  11.458
   45   HD22  LEU   6          HD22      LEU   6  -2.521  11.442  11.867
   46   HD23  LEU   6          HD23      LEU   6  -1.663   9.905  11.967
   47    H    SER   7           HN       SER   7  -0.428   5.963  10.961
   48    HA   SER   7           HA       SER   7  -0.578   4.667   8.273
   49    HB2  SER   7           HB2      SER   7   1.338   4.081  10.539
   50    HB3  SER   7           HB1      SER   7   1.160   3.072   9.105
   51    HG   SER   7           HG       SER   7   2.871   4.556   8.871
   52    H    LYS   8           HN       LYS   8  -2.334   4.985  10.937
   53    HA   LYS   8           HA       LYS   8  -2.838   2.136  11.445
   54    HB2  LYS   8           HB2      LYS   8  -4.024   4.667  12.578
   55    HB3  LYS   8           HB1      LYS   8  -4.554   3.058  13.042
   56    HG2  LYS   8           HG2      LYS   8  -1.782   4.179  13.398
   57    HG3  LYS   8           HG1      LYS   8  -2.993   3.973  14.663
   58    HD2  LYS   8           HD2      LYS   8  -2.943   1.566  14.358
   59    HD3  LYS   8           HD1      LYS   8  -1.810   1.736  13.017
   60    HE2  LYS   8           HE2      LYS   8  -0.149   2.689  14.533
   61    HE3  LYS   8           HE1      LYS   8  -1.284   2.545  15.874
   62    HZ1  LYS   8           HZ1      LYS   8  -0.295   0.243  14.280
   63    HZ2  LYS   8           HZ2      LYS   8  -1.224   0.178  15.693
   64    HZ3  LYS   8           HZ3      LYS   8   0.372   0.731  15.756
   65    H    THR   9           HN       THR   9  -4.603   4.955  10.129
   66    HA   THR   9           HA       THR   9  -7.049   3.643   9.628
   67    HB   THR   9           HB       THR   9  -6.983   6.018   9.488
   68    HG1  THR   9           HG1      THR   9  -8.321   6.134   7.827
   69   HG21  THR   9          HG21      THR   9  -4.668   6.322   8.774
   70   HG22  THR   9          HG22      THR   9  -5.762   7.230   7.732
   71   HG23  THR   9          HG23      THR   9  -5.068   5.710   7.169
   72    H    SER  10           HN       SER  10  -7.387   1.840   8.531
   73    HA   SER  10           HA       SER  10  -5.687   1.223   6.197
   74    HB2  SER  10           HB2      SER  10  -6.827  -0.989   6.275
   75    HB3  SER  10           HB1      SER  10  -6.051  -0.572   7.800
   76    HG   SER  10           HG       SER  10  -8.041  -1.252   8.369
   77    H    MET  11           HN       MET  11  -6.986  -0.053   4.394
   78    HA   MET  11           HA       MET  11  -9.472   1.439   3.753
   79    HB2  MET  11           HB2      MET  11  -7.370   2.439   2.645
   80    HB3  MET  11           HB1      MET  11  -7.353   0.980   1.665
   81    HG2  MET  11           HG2      MET  11  -8.438   2.812   0.501
   82    HG3  MET  11           HG1      MET  11  -9.572   1.501   0.819
   83    HE1  MET  11           HE1      MET  11  -8.295   5.004   2.030
   84    HE2  MET  11           HE2      MET  11  -8.314   4.084   3.534
   85    HE3  MET  11           HE3      MET  11  -9.462   5.400   3.291
   86    H    THR  12           HN       THR  12 -10.975   0.330   2.528
   87    HA   THR  12           HA       THR  12 -10.471  -2.585   2.424
   88    HB   THR  12           HB       THR  12 -13.057  -1.053   2.087
   89    HG1  THR  12           HG1      THR  12 -12.062  -2.581   4.285
   90   HG21  THR  12          HG21      THR  12 -12.542  -4.020   2.349
   91   HG22  THR  12          HG22      THR  12 -13.142  -3.187   0.915
   92   HG23  THR  12          HG23      THR  12 -14.131  -3.256   2.373
   93    H    PHE  13           HN       PHE  13 -10.060  -3.666   0.645
   94    HA   PHE  13           HA       PHE  13 -10.501  -2.325  -1.969
   95    HB2  PHE  13           HB2      PHE  13  -8.732  -4.595  -1.080
   96    HB3  PHE  13           HB1      PHE  13  -9.041  -4.279  -2.780
   97    HD1  PHE  13           HD2      PHE  13  -9.111  -1.180  -2.376
   98    HD2  PHE  13           HD1      PHE  13  -6.378  -4.242  -1.248
   99    HE1  PHE  13           HE2      PHE  13  -7.275   0.455  -2.399
  100    HE2  PHE  13           HE1      PHE  13  -4.541  -2.613  -1.272
  101    HZ   PHE  13           HZ       PHE  13  -4.985  -0.260  -1.848
  102    H    GLN  14           HN       GLN  14 -11.542  -3.362  -3.691
  103    HA   GLN  14           HA       GLN  14 -13.300  -5.601  -2.793
  104    HB2  GLN  14           HB2      GLN  14 -14.586  -3.592  -3.182
  105    HB3  GLN  14           HB1      GLN  14 -13.857  -3.383  -4.768
  106    HG2  GLN  14           HG2      GLN  14 -14.925  -5.463  -5.515
  107    HG3  GLN  14           HG1      GLN  14 -15.678  -5.632  -3.930
  108   HE21  GLN  14          HE21      GLN  14 -17.762  -5.580  -4.740
  109   HE22  GLN  14          HE22      GLN  14 -18.482  -4.065  -5.387
  110    HA   PRO  15           HA       PRO  15 -11.187  -7.940  -5.942
  111    HB2  PRO  15           HB2      PRO  15 -12.808 -10.127  -5.853
  112    HB3  PRO  15           HB1      PRO  15 -11.546  -9.801  -4.663
  113    HG2  PRO  15           HG2      PRO  15 -14.488  -9.343  -4.484
  114    HG3  PRO  15           HG1      PRO  15 -13.368  -9.935  -3.246
  115    HD2  PRO  15           HD2      PRO  15 -14.278  -7.378  -3.320
  116    HD3  PRO  15           HD1      PRO  15 -12.689  -7.817  -2.672
  117    H    LYS  16           HN       LYS  16 -11.437  -8.533  -8.090
  118    HA   LYS  16           HA       LYS  16 -13.651  -7.218  -9.446
  119    HB2  LYS  16           HB2      LYS  16 -11.329  -8.876 -10.442
  120    HB3  LYS  16           HB1      LYS  16 -12.523  -8.152 -11.507
  121    HG2  LYS  16           HG2      LYS  16 -10.762  -6.619  -9.605
  122    HG3  LYS  16           HG1      LYS  16 -10.449  -6.836 -11.327
  123    HD2  LYS  16           HD2      LYS  16 -12.597  -5.724 -11.826
  124    HD3  LYS  16           HD1      LYS  16 -12.830  -5.448 -10.098
  125    HE2  LYS  16           HE2      LYS  16 -10.753  -4.138 -10.047
  126    HE3  LYS  16           HE1      LYS  16 -10.562  -4.387 -11.781
  127    HZ1  LYS  16           HZ1      LYS  16 -11.540  -2.233 -11.298
  128    HZ2  LYS  16           HZ2      LYS  16 -12.824  -2.967 -10.478
  129    HZ3  LYS  16           HZ3      LYS  16 -12.639  -3.204 -12.143
  130    H    LYS  17           HN       LYS  17 -12.606 -10.568  -8.842
  131    HA   LYS  17           HA       LYS  17 -15.193 -11.493 -10.005
  132    HB2  LYS  17           HB2      LYS  17 -12.640 -13.058  -9.589
  133    HB3  LYS  17           HB1      LYS  17 -14.114 -13.665 -10.329
  134    HG2  LYS  17           HG2      LYS  17 -13.861 -12.093 -12.167
  135    HG3  LYS  17           HG1      LYS  17 -12.404 -11.436 -11.416
  136    HD2  LYS  17           HD2      LYS  17 -11.345 -13.655 -11.592
  137    HD3  LYS  17           HD1      LYS  17 -12.792 -14.263 -12.399
  138    HE2  LYS  17           HE2      LYS  17 -12.463 -12.678 -14.216
  139    HE3  LYS  17           HE1      LYS  17 -11.050 -12.013 -13.400
  140    HZ1  LYS  17           HZ1      LYS  17 -11.314 -14.806 -14.379
  141    HZ2  LYS  17           HZ2      LYS  17  -9.950 -14.146 -13.625
  142    HZ3  LYS  17           HZ3      LYS  17 -10.436 -13.578 -15.142
  143    H    ALA  18           HN       ALA  18 -15.965 -13.626  -9.021
  144    HA   ALA  18           HA       ALA  18 -16.551 -13.157  -6.265
  145    HB1  ALA  18           HB1      ALA  18 -16.885 -15.668  -7.901
  146    HB2  ALA  18           HB2      ALA  18 -18.062 -14.364  -7.741
  147    HB3  ALA  18           HB3      ALA  18 -17.643 -15.350  -6.340
  148    H    SER  19           HN       SER  19 -14.262 -15.343  -7.897
  149    HA   SER  19           HA       SER  19 -13.458 -16.858  -5.667
  150    HB2  SER  19           HB2      SER  19 -11.802 -15.950  -8.034
  151    HB3  SER  19           HB1      SER  19 -11.351 -17.240  -6.920
  152    HG   SER  19           HG       SER  19 -12.388 -17.983  -8.860
  153    H    LEU  20           HN       LEU  20 -12.278 -13.691  -6.805
  154    HA   LEU  20           HA       LEU  20 -10.193 -13.506  -4.829
  155    HB2  LEU  20           HB2      LEU  20 -11.582 -11.312  -6.360
  156    HB3  LEU  20           HB1      LEU  20 -10.070 -11.161  -5.506
  157    HG   LEU  20           HG       LEU  20 -10.500 -12.971  -7.880
  158   HD11  LEU  20          HD11      LEU  20  -9.214 -11.312  -9.136
  159   HD12  LEU  20          HD12      LEU  20  -9.207 -10.253  -7.726
  160   HD13  LEU  20          HD13      LEU  20 -10.727 -10.640  -8.530
  161   HD21  LEU  20          HD21      LEU  20  -8.715 -13.667  -6.325
  162   HD22  LEU  20          HD22      LEU  20  -7.961 -12.084  -6.517
  163   HD23  LEU  20          HD23      LEU  20  -8.092 -13.171  -7.898
  164    H    GLN  21           HN       GLN  21 -10.060 -12.246  -2.963
  165    HA   GLN  21           HA       GLN  21 -12.713 -11.554  -1.777
  166    HB2  GLN  21           HB2      GLN  21 -10.267 -12.704  -0.428
  167    HB3  GLN  21           HB1      GLN  21 -11.673 -12.097   0.435
  168    HG2  GLN  21           HG2      GLN  21 -13.053 -13.768  -0.821
  169    HG3  GLN  21           HG1      GLN  21 -11.545 -14.448  -1.432
  170   HE21  GLN  21          HE21      GLN  21 -13.603 -13.976   1.349
  171   HE22  GLN  21          HE22      GLN  21 -12.776 -15.173   2.405
  172    HA   PRO  22           HA       PRO  22 -11.370  -7.397  -1.235
  173    HB2  PRO  22           HB2      PRO  22 -12.545  -6.829   1.192
  174    HB3  PRO  22           HB1      PRO  22 -13.391  -6.819  -0.358
  175    HG2  PRO  22           HG2      PRO  22 -13.292  -8.951   1.733
  176    HG3  PRO  22           HG1      PRO  22 -14.668  -8.394   0.764
  177    HD2  PRO  22           HD2      PRO  22 -13.361 -10.665   0.183
  178    HD3  PRO  22           HD1      PRO  22 -14.013  -9.616  -1.093
  179    H    LEU  23           HN       LEU  23  -9.854  -6.111  -0.211
  180    HA   LEU  23           HA       LEU  23  -8.331  -7.464   1.975
  181    HB2  LEU  23           HB2      LEU  23  -7.192  -7.423  -0.242
  182    HB3  LEU  23           HB1      LEU  23  -7.219  -5.674  -0.184
  183    HG   LEU  23           HG       LEU  23  -5.895  -7.221   2.018
  184   HD11  LEU  23          HD11      LEU  23  -4.943  -8.130  -0.017
  185   HD12  LEU  23          HD12      LEU  23  -3.779  -7.069   0.777
  186   HD13  LEU  23          HD13      LEU  23  -4.665  -6.503  -0.640
  187   HD21  LEU  23          HD21      LEU  23  -4.473  -5.173   2.044
  188   HD22  LEU  23          HD22      LEU  23  -6.170  -4.873   2.413
  189   HD23  LEU  23          HD23      LEU  23  -5.533  -4.479   0.816
  190    H    THR  24           HN       THR  24  -8.229  -6.401   3.840
  191    HA   THR  24           HA       THR  24  -8.531  -3.439   3.727
  192    HB   THR  24           HB       THR  24  -9.725  -5.218   5.858
  193    HG1  THR  24           HG1      THR  24 -11.565  -5.098   4.761
  194   HG21  THR  24          HG21      THR  24  -9.945  -2.242   5.373
  195   HG22  THR  24          HG22      THR  24  -9.100  -3.022   6.711
  196   HG23  THR  24          HG23      THR  24 -10.854  -3.147   6.585
  197    H    ILE  25           HN       ILE  25  -6.358  -2.984   3.935
  198    HA   ILE  25           HA       ILE  25  -5.303  -3.443   6.657
  199    HB   ILE  25           HB       ILE  25  -4.478  -5.256   5.001
  200   HG12  ILE  25          HG12      ILE  25  -2.190  -5.192   6.021
  201   HG13  ILE  25          HG11      ILE  25  -2.568  -3.601   6.663
  202   HG21  ILE  25          HG21      ILE  25  -3.963  -3.645   3.184
  203   HG22  ILE  25          HG22      ILE  25  -2.610  -4.694   3.609
  204   HG23  ILE  25          HG23      ILE  25  -2.637  -3.022   4.167
  205   HD11  ILE  25          HD11      ILE  25  -2.829  -5.455   8.286
  206   HD12  ILE  25          HD12      ILE  25  -4.136  -6.089   7.286
  207   HD13  ILE  25          HD13      ILE  25  -4.294  -4.504   8.043
  208    H    SER  26           HN       SER  26  -3.459  -2.062   7.205
  209    HA   SER  26           HA       SER  26  -3.459   0.401   5.519
  210    HB2  SER  26           HB2      SER  26  -4.556   0.595   7.777
  211    HB3  SER  26           HB1      SER  26  -2.983   0.264   8.499
  212    HG   SER  26           HG       SER  26  -3.104   2.441   8.386
  213    H    LEU  27           HN       LEU  27  -1.502   1.857   6.416
  214    HA   LEU  27           HA       LEU  27   0.875   0.775   5.329
  215    HB2  LEU  27           HB2      LEU  27   0.667   3.009   7.323
  216    HB3  LEU  27           HB1      LEU  27   1.952   2.743   6.161
  217    HG   LEU  27           HG       LEU  27  -0.897   3.513   5.523
  218   HD11  LEU  27          HD11      LEU  27   0.127   5.598   4.726
  219   HD12  LEU  27          HD12      LEU  27   1.690   5.042   5.325
  220   HD13  LEU  27          HD13      LEU  27   0.370   5.346   6.454
  221   HD21  LEU  27          HD21      LEU  27   0.042   2.033   3.814
  222   HD22  LEU  27          HD22      LEU  27   1.445   3.093   3.667
  223   HD23  LEU  27          HD23      LEU  27  -0.155   3.677   3.212
  224    H    ASP  28           HN       ASP  28   0.212   1.518   8.775
  225    HA   ASP  28           HA       ASP  28   2.617   0.267   9.693
  226    HB2  ASP  28           HB2      ASP  28   1.312   1.997  10.940
  227    HB3  ASP  28           HB1      ASP  28   0.085   0.780  11.266
  228    H    GLU  29           HN       GLU  29  -0.619  -0.934   9.049
  229    HA   GLU  29           HA       GLU  29  -0.114  -3.448  10.453
  230    HB2  GLU  29           HB2      GLU  29  -2.406  -2.378   8.830
  231    HB3  GLU  29           HB1      GLU  29  -2.361  -4.049   9.370
  232    HG2  GLU  29           HG2      GLU  29  -3.682  -2.742  10.887
  233    HG3  GLU  29           HG1      GLU  29  -2.212  -3.277  11.696
  234    H    LEU  30           HN       LEU  30   0.727  -2.236   7.371
  235    HA   LEU  30           HA       LEU  30   0.945  -5.050   6.415
  236    HB2  LEU  30           HB2      LEU  30  -0.690  -3.353   5.237
  237    HB3  LEU  30           HB1      LEU  30   0.770  -2.726   4.509
  238    HG   LEU  30           HG       LEU  30  -0.570  -4.364   3.124
  239   HD11  LEU  30          HD11      LEU  30   1.282  -5.144   2.028
  240   HD12  LEU  30          HD12      LEU  30   2.166  -5.468   3.517
  241   HD13  LEU  30          HD13      LEU  30   1.967  -3.808   2.955
  242   HD21  LEU  30          HD21      LEU  30  -0.288  -6.730   3.576
  243   HD22  LEU  30          HD22      LEU  30  -1.125  -5.933   4.904
  244   HD23  LEU  30          HD23      LEU  30   0.578  -6.359   5.066
  245    H    PHE  31           HN       PHE  31   2.796  -2.787   7.723
  246    HA   PHE  31           HA       PHE  31   5.052  -3.639   6.037
  247    HB2  PHE  31           HB2      PHE  31   4.824  -0.789   7.040
  248    HB3  PHE  31           HB1      PHE  31   6.144  -1.441   6.077
  249    HD1  PHE  31           HD1      PHE  31   4.901  -2.849   3.926
  250    HD2  PHE  31           HD2      PHE  31   3.655   0.750   5.818
  251    HE1  PHE  31           HE1      PHE  31   3.716  -2.187   1.877
  252    HE2  PHE  31           HE2      PHE  31   2.465   1.417   3.773
  253    HZ   PHE  31           HZ       PHE  31   2.493  -0.054   1.802
  254    H    SER  32           HN       SER  32   6.978  -4.101   7.070
  255    HA   SER  32           HA       SER  32   6.989  -3.682  10.010
  256    HB2  SER  32           HB2      SER  32   7.722  -6.232   8.577
  257    HB3  SER  32           HB1      SER  32   7.868  -5.955  10.313
  258    HG   SER  32           HG       SER  32   5.652  -6.544   8.807
  259    H    SER  33           HN       SER  33   8.376  -2.336   7.675
  260    HA   SER  33           HA       SER  33  11.057  -2.369   8.800
  261    HB2  SER  33           HB2      SER  33  11.306  -4.292   7.351
  262    HB3  SER  33           HB1      SER  33  10.603  -3.408   5.997
  263    HG   SER  33           HG       SER  33  13.132  -3.129   7.190
  264    H    ARG  34           HN       ARG  34  12.072  -0.462   8.578
  265    HA   ARG  34           HA       ARG  34  10.609   1.727   7.457
  266    HB2  ARG  34           HB2      ARG  34  13.523   1.560   8.254
  267    HB3  ARG  34           HB1      ARG  34  12.643   3.048   7.931
  268    HG2  ARG  34           HG2      ARG  34  11.137   2.543   9.809
  269    HG3  ARG  34           HG1      ARG  34  12.079   1.089  10.149
  270    HD2  ARG  34           HD2      ARG  34  12.791   2.841  11.632
  271    HD3  ARG  34           HD1      ARG  34  14.079   2.515  10.474
  272    HE   ARG  34           HE       ARG  34  12.365   4.643   9.563
  273   HH11  ARG  34          HH11      ARG  34  15.007   3.905  11.801
  274   HH12  ARG  34          HH12      ARG  34  15.609   5.528  11.815
  275   HH21  ARG  34          HH21      ARG  34  13.190   6.767   9.611
  276   HH22  ARG  34          HH22      ARG  34  14.579   7.153  10.571
  277    H    GLY  35           HN       GLY  35  13.526  -0.041   6.360
  278    HA2  GLY  35           HA2      GLY  35  13.920   1.494   3.988
  279    HA3  GLY  35           HA1      GLY  35  14.496  -0.143   4.257
  280    H    GLU  36           HN       GLU  36  11.934  -1.388   4.651
  281    HA   GLU  36           HA       GLU  36  11.244  -1.925   1.942
  282    HB2  GLU  36           HB2      GLU  36  10.814  -3.487   3.813
  283    HB3  GLU  36           HB1      GLU  36   9.589  -2.391   4.435
  284    HG2  GLU  36           HG2      GLU  36   8.617  -4.272   3.220
  285    HG3  GLU  36           HG1      GLU  36   8.230  -2.726   2.467
  286    H    PHE  37           HN       PHE  37   9.843   0.222   4.406
  287    HA   PHE  37           HA       PHE  37   7.552   1.058   2.990
  288    HB2  PHE  37           HB2      PHE  37   8.225   1.598   5.393
  289    HB3  PHE  37           HB1      PHE  37   9.242   2.867   4.722
  290    HD1  PHE  37           HD2      PHE  37   5.800   1.756   5.294
  291    HD2  PHE  37           HD1      PHE  37   8.286   4.879   3.821
  292    HE1  PHE  37           HE2      PHE  37   3.872   3.283   5.292
  293    HE2  PHE  37           HE1      PHE  37   6.364   6.414   3.820
  294    HZ   PHE  37           HZ       PHE  37   4.154   5.616   4.556
  295    H    ILE  38           HN       ILE  38  10.898   2.326   2.945
  296    HA   ILE  38           HA       ILE  38  10.529   4.439   1.156
  297    HB   ILE  38           HB       ILE  38  12.906   2.583   1.372
  298   HG12  ILE  38          HG12      ILE  38  12.415   3.605   3.501
  299   HG13  ILE  38          HG11      ILE  38  13.816   4.415   2.810
  300   HG21  ILE  38          HG21      ILE  38  12.686   5.330   0.145
  301   HG22  ILE  38          HG22      ILE  38  13.014   3.818  -0.703
  302   HG23  ILE  38          HG23      ILE  38  14.197   4.465   0.434
  303   HD11  ILE  38          HD11      ILE  38  12.296   6.000   3.840
  304   HD12  ILE  38          HD12      ILE  38  10.989   5.452   2.790
  305   HD13  ILE  38          HD13      ILE  38  12.394   6.266   2.100
  306    H    SER  39           HN       SER  39  11.362   1.013   0.379
  307    HA   SER  39           HA       SER  39  11.420   1.399  -2.434
  308    HB2  SER  39           HB2      SER  39  12.286  -0.635  -1.315
  309    HB3  SER  39           HB1      SER  39  10.645  -1.119  -0.895
  310    HG   SER  39           HG       SER  39  11.926  -1.116  -3.386
  311    H    VAL  40           HN       VAL  40   8.780  -0.245  -0.565
  312    HA   VAL  40           HA       VAL  40   6.868  -0.519  -2.372
  313    HB   VAL  40           HB       VAL  40   5.116  -0.031  -0.703
  314   HG11  VAL  40          HG11      VAL  40   5.783  -1.725   0.884
  315   HG12  VAL  40          HG12      VAL  40   7.477  -1.515   0.441
  316   HG13  VAL  40          HG13      VAL  40   6.336  -2.173  -0.730
  317   HG21  VAL  40          HG21      VAL  40   6.224   1.945   0.313
  318   HG22  VAL  40          HG22      VAL  40   7.371   0.850   1.085
  319   HG23  VAL  40          HG23      VAL  40   5.660   0.763   1.494
  320    H    GLY  41           HN       GLY  41   7.672   2.781  -1.116
  321    HA2  GLY  41           HA2      GLY  41   7.301   4.419  -3.016
  322    HA3  GLY  41           HA1      GLY  41   5.663   3.785  -3.076
  323    H    GLY  42           HN       GLY  42   7.757   4.573  -0.269
  324    HA2  GLY  42           HA2      GLY  42   5.649   6.535   0.535
  325    HA3  GLY  42           HA1      GLY  42   6.419   5.453   1.674
  326    H    ASP  43           HN       ASP  43   6.640   8.382  -0.141
  327    HA   ASP  43           HA       ASP  43   9.365   8.977   0.778
  328    HB2  ASP  43           HB2      ASP  43   7.263  10.661  -0.614
  329    HB3  ASP  43           HB1      ASP  43   8.866  11.257  -0.195
  330    H    GLY  44           HN       GLY  44   6.419  11.021   1.169
  331    HA2  GLY  44           HA2      GLY  44   6.744  10.905   4.095
  332    HA3  GLY  44           HA1      GLY  44   7.123  12.450   3.358
  333    H    ARG  45           HN       ARG  45   5.385  13.366   1.886
  334    HA   ARG  45           HA       ARG  45   2.853  13.129   3.374
  335    HB2  ARG  45           HB2      ARG  45   3.866  15.095   1.321
  336    HB3  ARG  45           HB1      ARG  45   2.213  15.117   1.922
  337    HG2  ARG  45           HG2      ARG  45   3.563  16.733   3.111
  338    HG3  ARG  45           HG1      ARG  45   3.049  15.443   4.198
  339    HD2  ARG  45           HD2      ARG  45   5.202  14.415   4.115
  340    HD3  ARG  45           HD1      ARG  45   5.736  15.507   2.841
  341    HE   ARG  45           HE       ARG  45   4.986  17.093   5.044
  342   HH11  ARG  45          HH11      ARG  45   7.429  14.663   4.226
  343   HH12  ARG  45          HH12      ARG  45   8.600  15.292   5.334
  344   HH21  ARG  45          HH21      ARG  45   6.559  17.888   6.491
  345   HH22  ARG  45          HH22      ARG  45   8.107  17.124   6.620
  346    H    MET  46           HN       MET  46   1.851  11.284   2.758
  347    HA   MET  46           HA       MET  46   1.600  10.658  -0.094
  348    HB2  MET  46           HB2      MET  46   1.834   9.034   1.961
  349    HB3  MET  46           HB1      MET  46   0.089   9.222   2.052
  350    HG2  MET  46           HG2      MET  46  -0.127   7.657   0.512
  351    HG3  MET  46           HG1      MET  46   0.688   8.708  -0.641
  352    HE1  MET  46           HE1      MET  46   4.409   7.611  -0.323
  353    HE2  MET  46           HE2      MET  46   3.627   8.912   0.572
  354    HE3  MET  46           HE3      MET  46   3.256   8.669  -1.135
  355    H    SER  47           HN       SER  47  -0.611  10.007  -0.939
  356    HA   SER  47           HA       SER  47  -2.390  12.297  -0.450
  357    HB2  SER  47           HB2      SER  47  -2.291  10.177  -2.589
  358    HB3  SER  47           HB1      SER  47  -3.607  11.341  -2.470
  359    HG   SER  47           HG       SER  47  -2.214  12.974  -2.908
  360    H    HIS  48           HN       HIS  48  -3.292   8.965  -1.305
  361    HA   HIS  48           HA       HIS  48  -4.750   8.362   1.115
  362    HB2  HIS  48           HB2      HIS  48  -6.280  10.076   0.413
  363    HB3  HIS  48           HB1      HIS  48  -6.277   9.467  -1.237
  364    HD1  HIS  48           HD1      HIS  48  -7.864   9.031   2.097
  365    HD2  HIS  48           HD2      HIS  48  -7.785   7.062  -1.608
  366    HE1  HIS  48           HE1      HIS  48  -9.797   7.389   2.115
  367    HE2  HIS  48           HE2      HIS  48  -9.688   6.126  -0.087
  368    H    LYS  49           HN       LYS  49  -5.499   7.875  -2.367
  369    HA   LYS  49           HA       LYS  49  -5.722   5.034  -2.020
  370    HB2  LYS  49           HB2      LYS  49  -6.749   6.461  -3.846
  371    HB3  LYS  49           HB1      LYS  49  -5.158   6.514  -4.595
  372    HG2  LYS  49           HG2      LYS  49  -5.165   4.171  -4.967
  373    HG3  LYS  49           HG1      LYS  49  -6.605   3.953  -3.971
  374    HD2  LYS  49           HD2      LYS  49  -6.519   5.542  -6.535
  375    HD3  LYS  49           HD1      LYS  49  -7.052   3.867  -6.413
  376    HE2  LYS  49           HE2      LYS  49  -8.812   4.563  -4.839
  377    HE3  LYS  49           HE1      LYS  49  -8.294   6.238  -5.025
  378    HZ1  LYS  49           HZ1      LYS  49  -9.300   4.517  -7.227
  379    HZ2  LYS  49           HZ2      LYS  49  -8.877   6.150  -7.349
  380    HZ3  LYS  49           HZ3      LYS  49 -10.212   5.690  -6.417
  381    H    GLU  50           HN       GLU  50  -3.043   7.203  -2.586
  382    HA   GLU  50           HA       GLU  50  -1.214   5.315  -3.725
  383    HB2  GLU  50           HB2      GLU  50  -0.869   7.702  -3.928
  384    HB3  GLU  50           HB1      GLU  50  -0.775   7.876  -2.182
  385    HG2  GLU  50           HG2      GLU  50   1.424   7.992  -3.197
  386    HG3  GLU  50           HG1      GLU  50   1.283   6.584  -2.148
  387    H    ALA  51           HN       ALA  51  -1.628   6.534  -0.366
  388    HA   ALA  51           HA       ALA  51   0.459   5.141   0.843
  389    HB1  ALA  51           HB1      ALA  51  -0.953   6.814   1.974
  390    HB2  ALA  51           HB2      ALA  51  -0.766   5.347   2.931
  391    HB3  ALA  51           HB3      ALA  51  -2.264   5.639   2.048
  392    H    ILE  52           HN       ILE  52  -2.956   3.937   0.682
  393    HA   ILE  52           HA       ILE  52  -2.327   1.455   1.834
  394    HB   ILE  52           HB       ILE  52  -4.459   1.943  -0.273
  395   HG12  ILE  52          HG12      ILE  52  -4.599   3.508   1.647
  396   HG13  ILE  52          HG11      ILE  52  -5.961   2.409   1.577
  397   HG21  ILE  52          HG21      ILE  52  -4.069  -0.421   0.090
  398   HG22  ILE  52          HG22      ILE  52  -5.620   0.051   0.785
  399   HG23  ILE  52          HG23      ILE  52  -4.223  -0.203   1.833
  400   HD11  ILE  52          HD11      ILE  52  -5.250   2.664   3.851
  401   HD12  ILE  52          HD12      ILE  52  -3.597   2.223   3.422
  402   HD13  ILE  52          HD13      ILE  52  -4.887   1.024   3.315
  403    H    LEU  53           HN       LEU  53  -2.301   2.428  -1.611
  404    HA   LEU  53           HA       LEU  53  -1.961  -0.125  -2.716
  405    HB2  LEU  53           HB2      LEU  53  -2.331   2.056  -3.939
  406    HB3  LEU  53           HB1      LEU  53  -0.638   2.449  -3.737
  407    HG   LEU  53           HG       LEU  53  -0.060   0.406  -5.050
  408   HD11  LEU  53          HD11      LEU  53  -3.032   0.319  -5.548
  409   HD12  LEU  53          HD12      LEU  53  -2.090  -0.875  -4.654
  410   HD13  LEU  53          HD13      LEU  53  -1.818  -0.652  -6.382
  411   HD21  LEU  53          HD21      LEU  53  -1.745   2.570  -6.277
  412   HD22  LEU  53          HD22      LEU  53  -0.901   1.360  -7.242
  413   HD23  LEU  53          HD23      LEU  53   0.014   2.458  -6.207
  414    H    LEU  54           HN       LEU  54   0.499   1.815  -1.000
  415    HA   LEU  54           HA       LEU  54   2.858   0.678  -2.037
  416    HB2  LEU  54           HB2      LEU  54   2.004   1.727   0.670
  417    HB3  LEU  54           HB1      LEU  54   3.519   0.861   0.576
  418    HG   LEU  54           HG       LEU  54   4.354   2.459  -1.078
  419   HD11  LEU  54          HD11      LEU  54   1.730   3.875  -0.656
  420   HD12  LEU  54          HD12      LEU  54   2.242   3.059  -2.134
  421   HD13  LEU  54          HD13      LEU  54   3.102   4.493  -1.573
  422   HD21  LEU  54          HD21      LEU  54   4.807   2.899   1.248
  423   HD22  LEU  54          HD22      LEU  54   3.242   3.686   1.440
  424   HD23  LEU  54          HD23      LEU  54   4.479   4.422   0.424
  425    H    GLY  55           HN       GLY  55   0.394  -0.794   0.109
  426    HA2  GLY  55           HA2      GLY  55   1.778  -2.892   1.282
  427    HA3  GLY  55           HA1      GLY  55   0.122  -3.008   0.721
  428    H    LEU  56           HN       LEU  56   0.397  -2.876  -2.020
  429    HA   LEU  56           HA       LEU  56   0.907  -5.495  -2.772
  430    HB2  LEU  56           HB2      LEU  56   1.428  -3.121  -4.543
  431    HB3  LEU  56           HB1      LEU  56   1.011  -4.750  -5.046
  432    HG   LEU  56           HG       LEU  56  -0.780  -2.752  -3.669
  433   HD11  LEU  56          HD11      LEU  56  -0.558  -2.360  -6.026
  434   HD12  LEU  56          HD12      LEU  56  -2.142  -3.069  -5.712
  435   HD13  LEU  56          HD13      LEU  56  -0.847  -4.062  -6.379
  436   HD21  LEU  56          HD21      LEU  56  -2.526  -4.551  -3.938
  437   HD22  LEU  56          HD22      LEU  56  -1.327  -4.831  -2.677
  438   HD23  LEU  56          HD23      LEU  56  -1.200  -5.681  -4.216
  439    H    ARG  57           HN       ARG  57   3.209  -2.761  -3.011
  440    HA   ARG  57           HA       ARG  57   5.354  -4.258  -4.092
  441    HB2  ARG  57           HB2      ARG  57   5.377  -1.814  -2.320
  442    HB3  ARG  57           HB1      ARG  57   6.796  -2.441  -3.145
  443    HG2  ARG  57           HG2      ARG  57   4.283  -1.512  -4.520
  444    HG3  ARG  57           HG1      ARG  57   5.738  -0.538  -4.306
  445    HD2  ARG  57           HD2      ARG  57   7.008  -2.292  -5.542
  446    HD3  ARG  57           HD1      ARG  57   5.479  -3.104  -5.868
  447    HE   ARG  57           HE       ARG  57   5.178  -0.450  -6.729
  448   HH11  ARG  57          HH11      ARG  57   7.161  -3.271  -7.535
  449   HH12  ARG  57          HH12      ARG  57   7.360  -2.808  -9.191
  450   HH21  ARG  57          HH21      ARG  57   5.468   0.124  -8.914
  451   HH22  ARG  57          HH22      ARG  57   6.403  -0.877  -9.974
  452    H    TYR  58           HN       TYR  58   4.325  -3.769  -0.730
  453    HA   TYR  58           HA       TYR  58   6.613  -4.941   0.508
  454    HB2  TYR  58           HB2      TYR  58   4.929  -3.604   1.720
  455    HB3  TYR  58           HB1      TYR  58   3.741  -4.875   1.464
  456    HD1  TYR  58           HD2      TYR  58   6.763  -3.921   3.311
  457    HD2  TYR  58           HD1      TYR  58   3.785  -6.907   2.768
  458    HE1  TYR  58           HE2      TYR  58   7.479  -5.003   5.398
  459    HE2  TYR  58           HE1      TYR  58   4.487  -7.997   4.857
  460    HH   TYR  58           HH       TYR  58   6.543  -8.113   6.282
  461    H    LYS  59           HN       LYS  59   3.453  -6.299  -0.420
  462    HA   LYS  59           HA       LYS  59   4.155  -8.996   0.344
  463    HB2  LYS  59           HB2      LYS  59   1.901  -7.911  -1.328
  464    HB3  LYS  59           HB1      LYS  59   2.023  -9.572  -0.769
  465    HG2  LYS  59           HG2      LYS  59   1.814  -7.135   0.985
  466    HG3  LYS  59           HG1      LYS  59   0.512  -8.268   0.624
  467    HD2  LYS  59           HD2      LYS  59   1.698 -10.055   1.731
  468    HD3  LYS  59           HD1      LYS  59   3.103  -9.016   1.979
  469    HE2  LYS  59           HE2      LYS  59   1.714  -7.535   3.385
  470    HE3  LYS  59           HE1      LYS  59   0.363  -8.650   3.185
  471    HZ1  LYS  59           HZ1      LYS  59   2.973  -9.336   4.428
  472    HZ2  LYS  59           HZ2      LYS  59   1.638 -10.364   4.284
  473    HZ3  LYS  59           HZ3      LYS  59   1.548  -8.998   5.276
  474    H    LYS  60           HN       LYS  60   5.021  -7.101  -2.331
  475    HA   LYS  60           HA       LYS  60   6.106  -7.613  -4.269
  476    HB2  LYS  60           HB2      LYS  60   6.208 -10.486  -3.335
  477    HB3  LYS  60           HB1      LYS  60   7.239  -9.724  -4.535
  478    HG2  LYS  60           HG2      LYS  60   7.174  -9.070  -1.596
  479    HG3  LYS  60           HG1      LYS  60   8.404 -10.026  -2.422
  480    HD2  LYS  60           HD2      LYS  60   9.033  -8.094  -3.762
  481    HD3  LYS  60           HD1      LYS  60   7.764  -7.134  -3.001
  482    HE2  LYS  60           HE2      LYS  60   8.862  -7.439  -0.823
  483    HE3  LYS  60           HE1      LYS  60  10.143  -8.361  -1.609
  484    HZ1  LYS  60           HZ1      LYS  60  10.812  -6.076  -1.251
  485    HZ2  LYS  60           HZ2      LYS  60   9.483  -5.511  -2.132
  486    HZ3  LYS  60           HZ3      LYS  60  10.699  -6.393  -2.909
  487    H    LEU  61           HN       LEU  61   3.807  -7.111  -4.937
  488    HA   LEU  61           HA       LEU  61   3.119  -8.922  -7.046
  489    HB2  LEU  61           HB2      LEU  61   0.715  -9.311  -6.145
  490    HB3  LEU  61           HB1      LEU  61   2.019 -10.349  -5.611
  491    HG   LEU  61           HG       LEU  61   2.195  -9.030  -3.523
  492   HD11  LEU  61          HD11      LEU  61  -0.243  -7.608  -4.576
  493   HD12  LEU  61          HD12      LEU  61   1.352  -6.902  -4.328
  494   HD13  LEU  61          HD13      LEU  61   0.411  -7.458  -2.945
  495   HD21  LEU  61          HD21      LEU  61  -0.552 -10.122  -4.114
  496   HD22  LEU  61          HD22      LEU  61   0.125  -9.848  -2.509
  497   HD23  LEU  61          HD23      LEU  61   0.846 -11.053  -3.576
  498    H    TYR  62           HN       TYR  62   3.624  -6.035  -6.566
  499    HA   TYR  62           HA       TYR  62   1.172  -4.594  -6.817
  500    HB2  TYR  62           HB2      TYR  62   3.135  -3.414  -6.150
  501    HB3  TYR  62           HB1      TYR  62   4.013  -3.926  -7.586
  502    HD1  TYR  62           HD1      TYR  62   1.293  -1.734  -6.367
  503    HD2  TYR  62           HD2      TYR  62   3.869  -2.699  -9.613
  504    HE1  TYR  62           HE1      TYR  62   0.608   0.327  -7.519
  505    HE2  TYR  62           HE2      TYR  62   3.195  -0.638 -10.770
  506    HH   TYR  62           HH       TYR  62   1.562   1.871  -9.267
  507    H    ASN  63           HN       ASN  63   2.977  -6.476  -9.112
  508    HA   ASN  63           HA       ASN  63   2.185  -5.148 -11.498
  509    HB2  ASN  63           HB2      ASN  63   4.010  -6.793 -11.379
  510    HB3  ASN  63           HB1      ASN  63   2.836  -8.072 -11.089
  511   HD21  ASN  63          HD21      ASN  63   4.158  -5.814 -13.410
  512   HD22  ASN  63          HD22      ASN  63   3.459  -6.610 -14.863
  513    H    GLN  64           HN       GLN  64   0.839  -8.231 -10.164
  514    HA   GLN  64           HA       GLN  64  -1.508  -7.795 -11.890
  515    HB2  GLN  64           HB2      GLN  64  -0.309  -9.999 -11.814
  516    HB3  GLN  64           HB1      GLN  64  -0.898 -10.194 -10.169
  517    HG2  GLN  64           HG2      GLN  64  -3.170 -10.240 -10.923
  518    HG3  GLN  64           HG1      GLN  64  -2.680  -9.834 -12.566
  519   HE21  GLN  64          HE21      GLN  64  -3.643 -11.651 -13.453
  520   HE22  GLN  64          HE22      GLN  64  -2.947 -13.291 -13.213
  521    H    ALA  65           HN       ALA  65  -0.662  -7.156  -8.633
  522    HA   ALA  65           HA       ALA  65  -3.194  -7.785  -7.420
  523    HB1  ALA  65           HB1      ALA  65  -1.062  -5.830  -6.587
  524    HB2  ALA  65           HB2      ALA  65  -1.233  -7.504  -6.061
  525    HB3  ALA  65           HB3      ALA  65  -2.440  -6.307  -5.596
  526    H    ARG  66           HN       ARG  66  -1.883  -4.863  -8.962
  527    HA   ARG  66           HA       ARG  66  -4.092  -3.172  -8.261
  528    HB2  ARG  66           HB2      ARG  66  -1.939  -2.251  -8.879
  529    HB3  ARG  66           HB1      ARG  66  -2.047  -2.975 -10.476
  530    HG2  ARG  66           HG2      ARG  66  -3.830  -1.510 -11.095
  531    HG3  ARG  66           HG1      ARG  66  -3.959  -0.891  -9.447
  532    HD2  ARG  66           HD2      ARG  66  -1.890   0.225  -9.596
  533    HD3  ARG  66           HD1      ARG  66  -1.431  -0.652 -11.055
  534    HE   ARG  66           HE       ARG  66  -3.735   0.719 -11.755
  535   HH11  ARG  66          HH11      ARG  66  -0.548   1.601 -10.491
  536   HH12  ARG  66          HH12      ARG  66  -0.550   3.162 -11.240
  537   HH21  ARG  66          HH21      ARG  66  -3.697   2.780 -12.723
  538   HH22  ARG  66          HH22      ARG  66  -2.338   3.831 -12.509
  539    H    VAL  67           HN       VAL  67  -3.529  -5.432 -10.915
  540    HA   VAL  67           HA       VAL  67  -5.885  -4.419 -12.368
  541    HB   VAL  67           HB       VAL  67  -5.357  -6.109 -14.063
  542   HG11  VAL  67          HG11      VAL  67  -3.179  -5.192 -14.769
  543   HG12  VAL  67          HG12      VAL  67  -2.999  -4.452 -13.179
  544   HG13  VAL  67          HG13      VAL  67  -4.308  -3.944 -14.245
  545   HG21  VAL  67          HG21      VAL  67  -4.488  -7.893 -12.695
  546   HG22  VAL  67          HG22      VAL  67  -3.125  -6.895 -12.192
  547   HG23  VAL  67          HG23      VAL  67  -3.260  -7.420 -13.870
  548    H    LYS  68           HN       LYS  68  -4.885  -7.327 -10.558
  549    HA   LYS  68           HA       LYS  68  -7.205  -8.872 -11.101
  550    HB2  LYS  68           HB2      LYS  68  -5.223  -9.885 -10.169
  551    HB3  LYS  68           HB1      LYS  68  -5.336  -8.886  -8.727
  552    HG2  LYS  68           HG2      LYS  68  -7.293 -10.036  -7.998
  553    HG3  LYS  68           HG1      LYS  68  -7.414 -10.907  -9.527
  554    HD2  LYS  68           HD2      LYS  68  -4.854 -11.211  -8.107
  555    HD3  LYS  68           HD1      LYS  68  -6.254 -11.902  -7.288
  556    HE2  LYS  68           HE2      LYS  68  -5.259 -13.589  -8.682
  557    HE3  LYS  68           HE1      LYS  68  -6.812 -13.123  -9.372
  558    HZ1  LYS  68           HZ1      LYS  68  -5.699 -11.796 -11.006
  559    HZ2  LYS  68           HZ2      LYS  68  -5.019 -13.343 -11.030
  560    HZ3  LYS  68           HZ3      LYS  68  -4.193 -12.070 -10.287
  561    H    TYR  69           HN       TYR  69  -6.539  -6.447  -8.587
  562    HA   TYR  69           HA       TYR  69  -9.381  -6.724  -7.722
  563    HB2  TYR  69           HB2      TYR  69  -6.946  -5.788  -6.200
  564    HB3  TYR  69           HB1      TYR  69  -8.592  -5.618  -5.599
  565    HD1  TYR  69           HD1      TYR  69  -5.949  -8.035  -6.470
  566    HD2  TYR  69           HD2      TYR  69  -9.785  -7.495  -4.715
  567    HE1  TYR  69           HE1      TYR  69  -5.846 -10.314  -5.552
  568    HE2  TYR  69           HE2      TYR  69  -9.690  -9.770  -3.793
  569    HH   TYR  69           HH       TYR  69  -8.474 -11.952  -4.377
  570    H    SER  70           HN       SER  70 -10.452  -4.723  -6.975
  571    HA   SER  70           HA       SER  70  -9.951  -2.613  -8.944
  572    HB2  SER  70           HB2      SER  70 -12.252  -3.414  -8.401
  573    HB3  SER  70           HB1      SER  70 -12.068  -2.737  -6.783
  574    HG   SER  70           HG       SER  70 -12.303  -0.774  -7.564
  575    H    LEU  71           HN       LEU  71  -7.953  -1.766  -8.284
  576    HA   LEU  71           HA       LEU  71  -8.043  -0.271  -5.704
  577    HB2  LEU  71           HB2      LEU  71  -5.771  -1.389  -7.330
  578    HB3  LEU  71           HB1      LEU  71  -5.497  -0.119  -6.152
  579    HG   LEU  71           HG       LEU  71  -6.342  -1.578  -4.367
  580   HD11  LEU  71          HD11      LEU  71  -6.664  -3.998  -4.880
  581   HD12  LEU  71          HD12      LEU  71  -6.669  -3.578  -6.593
  582   HD13  LEU  71          HD13      LEU  71  -7.918  -2.940  -5.524
  583   HD21  LEU  71          HD21      LEU  71  -4.489  -3.208  -4.386
  584   HD22  LEU  71          HD22      LEU  71  -3.970  -1.577  -4.808
  585   HD23  LEU  71          HD23      LEU  71  -4.171  -2.792  -6.071
  586    H    LEU  72           HN       LEU  72  -6.233   0.115  -8.778
  587    HA   LEU  72           HA       LEU  72  -6.892   3.007  -8.674
  588    HB2  LEU  72           HB2      LEU  72  -4.786   1.414 -10.111
  589    HB3  LEU  72           HB1      LEU  72  -5.141   3.070 -10.558
  590    HG   LEU  72           HG       LEU  72  -3.184   2.904  -9.084
  591   HD11  LEU  72          HD11      LEU  72  -3.908   4.567  -7.402
  592   HD12  LEU  72          HD12      LEU  72  -5.580   4.276  -7.882
  593   HD13  LEU  72          HD13      LEU  72  -4.436   4.952  -9.040
  594   HD21  LEU  72          HD21      LEU  72  -3.899   0.914  -7.821
  595   HD22  LEU  72          HD22      LEU  72  -5.119   1.892  -7.005
  596   HD23  LEU  72          HD23      LEU  72  -3.408   2.241  -6.769
  597    H    GLU  73           HN       GLU  73  -8.716   3.540  -9.678
  598    HA   GLU  73           HA       GLU  73  -9.452   2.038 -12.127
  599    HB2  GLU  73           HB2      GLU  73 -11.107   4.049 -10.593
  600    HB3  GLU  73           HB1      GLU  73 -11.669   2.951 -11.844
  601    HG2  GLU  73           HG2      GLU  73 -10.715   2.231  -9.084
  602    HG3  GLU  73           HG1      GLU  73 -12.355   2.110  -9.718
  Start of MODEL   20
    1    H1   SER   1           HT1      SER   1   1.499  16.939   9.473
    2    H2   SER   1           HT2      SER   1   1.614  15.577  10.469
    3    H3   SER   1           HT3      SER   1   0.224  16.538  10.510
    4    HA   SER   1           HA       SER   1  -0.190  14.512   9.295
    5    HB2  SER   1           HB2      SER   1  -1.399  16.535   8.619
    6    HB3  SER   1           HB1      SER   1  -0.078  16.983   7.541
    7    HG   SER   1           HG       SER   1  -1.939  15.860   6.572
    8    H    ASP   2           HN       ASP   2   0.863  12.841   8.485
    9    HA   ASP   2           HA       ASP   2   2.544  13.171   6.128
   10    HB2  ASP   2           HB2      ASP   2   4.047  13.742   8.114
   11    HB3  ASP   2           HB1      ASP   2   3.888  12.058   8.597
   12    H    VAL   3           HN       VAL   3   3.203  11.147   5.181
   13    HA   VAL   3           HA       VAL   3   1.194   9.132   5.437
   14    HB   VAL   3           HB       VAL   3   2.513   9.602   3.365
   15   HG11  VAL   3          HG11      VAL   3   4.734   9.713   4.474
   16   HG12  VAL   3          HG12      VAL   3   4.699   8.660   3.060
   17   HG13  VAL   3          HG13      VAL   3   4.673   7.962   4.678
   18   HG21  VAL   3          HG21      VAL   3   2.505   6.739   4.313
   19   HG22  VAL   3          HG22      VAL   3   2.620   7.266   2.635
   20   HG23  VAL   3          HG23      VAL   3   1.157   7.593   3.563
   21    H    TRP   4           HN       TRP   4   4.458   9.457   6.785
   22    HA   TRP   4           HA       TRP   4   4.465   6.731   7.809
   23    HB2  TRP   4           HB2      TRP   4   6.451   8.463   7.222
   24    HB3  TRP   4           HB1      TRP   4   6.315   8.748   8.953
   25    HD1  TRP   4           HD1      TRP   4   5.910   5.877  10.076
   26    HE1  TRP   4           HE1      TRP   4   7.771   4.075   9.914
   27    HE3  TRP   4           HE3      TRP   4   8.561   7.882   6.190
   28    HZ2  TRP   4           HZ2      TRP   4  10.057   3.626   8.313
   29    HZ3  TRP   4           HZ3      TRP   4  10.575   6.704   5.405
   30    HH2  TRP   4           HH2      TRP   4  11.306   4.620   6.446
   31    H    SER   5           HN       SER   5   3.923  10.011   9.094
   32    HA   SER   5           HA       SER   5   3.633   9.270  11.824
   33    HB2  SER   5           HB2      SER   5   2.370  11.530  10.249
   34    HB3  SER   5           HB1      SER   5   2.294  11.388  12.004
   35    HG   SER   5           HG       SER   5   4.544  11.840  10.361
   36    H    LEU   6           HN       LEU   6   1.193   9.714   9.240
   37    HA   LEU   6           HA       LEU   6  -0.817   8.361  10.944
   38    HB2  LEU   6           HB2      LEU   6  -1.130   9.685   8.244
   39    HB3  LEU   6           HB1      LEU   6  -2.432   9.086   9.254
   40    HG   LEU   6           HG       LEU   6  -0.593  11.378   9.955
   41   HD11  LEU   6          HD11      LEU   6  -2.532  12.794   9.595
   42   HD12  LEU   6          HD12      LEU   6  -3.492  11.390   9.125
   43   HD13  LEU   6          HD13      LEU   6  -2.135  11.906   8.124
   44   HD21  LEU   6          HD21      LEU   6  -2.100  11.749  11.831
   45   HD22  LEU   6          HD22      LEU   6  -1.378  10.143  11.920
   46   HD23  LEU   6          HD23      LEU   6  -3.043  10.331  11.371
   47    H    SER   7           HN       SER   7  -0.026   6.244  10.886
   48    HA   SER   7           HA       SER   7  -0.293   4.936   8.210
   49    HB2  SER   7           HB2      SER   7   1.626   4.315  10.462
   50    HB3  SER   7           HB1      SER   7   1.369   3.257   9.074
   51    HG   SER   7           HG       SER   7   2.309   4.708   7.770
   52    H    LYS   8           HN       LYS   8  -2.062   5.350  10.820
   53    HA   LYS   8           HA       LYS   8  -2.728   2.484  11.201
   54    HB2  LYS   8           HB2      LYS   8  -3.745   4.898  12.708
   55    HB3  LYS   8           HB1      LYS   8  -3.983   3.213  13.143
   56    HG2  LYS   8           HG2      LYS   8  -1.372   4.711  13.117
   57    HG3  LYS   8           HG1      LYS   8  -2.278   4.184  14.537
   58    HD2  LYS   8           HD2      LYS   8  -1.923   1.860  13.938
   59    HD3  LYS   8           HD1      LYS   8  -1.105   2.344  12.452
   60    HE2  LYS   8           HE2      LYS   8  -0.167   2.989  15.246
   61    HE3  LYS   8           HE1      LYS   8   0.463   1.687  14.240
   62    HZ1  LYS   8           HZ1      LYS   8   1.099   3.405  12.593
   63    HZ2  LYS   8           HZ2      LYS   8   1.912   3.558  14.068
   64    HZ3  LYS   8           HZ3      LYS   8   0.634   4.601  13.696
   65    H    THR   9           HN       THR   9  -3.404   4.044   8.734
   66    HA   THR   9           HA       THR   9  -6.377   3.869   8.938
   67    HB   THR   9           HB       THR   9  -6.424   5.370   6.937
   68    HG1  THR   9           HG1      THR   9  -4.461   5.324   6.018
   69   HG21  THR   9          HG21      THR   9  -5.888   7.428   8.171
   70   HG22  THR   9          HG22      THR   9  -5.041   6.469   9.386
   71   HG23  THR   9          HG23      THR   9  -6.780   6.279   9.170
   72    H    SER  10           HN       SER  10  -7.144   2.048   8.108
   73    HA   SER  10           HA       SER  10  -5.627   0.731   5.933
   74    HB2  SER  10           HB2      SER  10  -7.120  -1.196   6.368
   75    HB3  SER  10           HB1      SER  10  -6.278  -0.673   7.823
   76    HG   SER  10           HG       SER  10  -8.140  -0.290   8.701
   77    H    MET  11           HN       MET  11  -6.901  -0.340   4.177
   78    HA   MET  11           HA       MET  11  -9.272   1.279   3.399
   79    HB2  MET  11           HB2      MET  11  -7.333   2.224   2.236
   80    HB3  MET  11           HB1      MET  11  -6.916   0.633   1.616
   81    HG2  MET  11           HG2      MET  11  -7.992   1.927  -0.101
   82    HG3  MET  11           HG1      MET  11  -9.027   0.580   0.365
   83    HE1  MET  11           HE1      MET  11 -11.103   1.719  -0.841
   84    HE2  MET  11           HE2      MET  11 -10.063   3.055  -1.334
   85    HE3  MET  11           HE3      MET  11 -11.607   3.383  -0.548
   86    H    THR  12           HN       THR  12 -10.924   0.130   2.588
   87    HA   THR  12           HA       THR  12 -10.551  -2.785   2.457
   88    HB   THR  12           HB       THR  12 -13.075  -1.144   2.148
   89    HG1  THR  12           HG1      THR  12 -12.690  -0.956   4.246
   90   HG21  THR  12          HG21      THR  12 -14.215  -3.306   2.605
   91   HG22  THR  12          HG22      THR  12 -12.654  -4.118   2.489
   92   HG23  THR  12          HG23      THR  12 -13.328  -3.300   1.080
   93    H    PHE  13           HN       PHE  13 -10.178  -3.885   0.687
   94    HA   PHE  13           HA       PHE  13 -10.740  -2.581  -1.926
   95    HB2  PHE  13           HB2      PHE  13  -8.846  -4.789  -1.116
   96    HB3  PHE  13           HB1      PHE  13  -9.186  -4.397  -2.797
   97    HD1  PHE  13           HD2      PHE  13  -9.373  -1.372  -2.401
   98    HD2  PHE  13           HD1      PHE  13  -6.544  -4.277  -1.113
   99    HE1  PHE  13           HE2      PHE  13  -7.629   0.359  -2.346
  100    HE2  PHE  13           HE1      PHE  13  -4.797  -2.552  -1.056
  101    HZ   PHE  13           HZ       PHE  13  -5.336  -0.231  -1.673
  102    H    GLN  14           HN       GLN  14 -11.823  -3.669  -3.573
  103    HA   GLN  14           HA       GLN  14 -13.313  -6.074  -2.634
  104    HB2  GLN  14           HB2      GLN  14 -14.819  -4.191  -2.697
  105    HB3  GLN  14           HB1      GLN  14 -14.308  -3.779  -4.328
  106    HG2  GLN  14           HG2      GLN  14 -15.337  -5.736  -5.221
  107    HG3  GLN  14           HG1      GLN  14 -15.664  -6.366  -3.607
  108   HE21  GLN  14          HE21      GLN  14 -17.324  -5.497  -2.359
  109   HE22  GLN  14          HE22      GLN  14 -18.601  -4.470  -3.100
  110    HA   PRO  15           HA       PRO  15 -11.370  -7.996  -6.148
  111    HB2  PRO  15           HB2      PRO  15 -12.872 -10.276  -6.114
  112    HB3  PRO  15           HB1      PRO  15 -11.507  -9.985  -5.033
  113    HG2  PRO  15           HG2      PRO  15 -14.432  -9.704  -4.511
  114    HG3  PRO  15           HG1      PRO  15 -13.161 -10.351  -3.458
  115    HD2  PRO  15           HD2      PRO  15 -14.171  -7.860  -3.163
  116    HD3  PRO  15           HD1      PRO  15 -12.486  -8.255  -2.779
  117    H    LYS  16           HN       LYS  16 -11.741  -8.192  -8.313
  118    HA   LYS  16           HA       LYS  16 -14.132  -6.948  -9.330
  119    HB2  LYS  16           HB2      LYS  16 -11.990  -8.507 -10.797
  120    HB3  LYS  16           HB1      LYS  16 -13.196  -7.472 -11.546
  121    HG2  LYS  16           HG2      LYS  16 -11.008  -6.600  -9.674
  122    HG3  LYS  16           HG1      LYS  16 -11.073  -6.330 -11.414
  123    HD2  LYS  16           HD2      LYS  16 -13.008  -4.906 -11.159
  124    HD3  LYS  16           HD1      LYS  16 -13.082  -5.262  -9.431
  125    HE2  LYS  16           HE2      LYS  16 -10.857  -4.233  -9.155
  126    HE3  LYS  16           HE1      LYS  16 -10.854  -3.823 -10.869
  127    HZ1  LYS  16           HZ1      LYS  16 -12.848  -2.854  -8.892
  128    HZ2  LYS  16           HZ2      LYS  16 -12.769  -2.418 -10.524
  129    HZ3  LYS  16           HZ3      LYS  16 -11.532  -1.958  -9.464
  130    H    LYS  17           HN       LYS  17 -12.979 -10.287  -9.023
  131    HA   LYS  17           HA       LYS  17 -15.649 -11.209  -9.986
  132    HB2  LYS  17           HB2      LYS  17 -14.508 -13.315 -10.672
  133    HB3  LYS  17           HB1      LYS  17 -13.983 -11.903 -11.574
  134    HG2  LYS  17           HG2      LYS  17 -12.012 -11.774 -10.013
  135    HG3  LYS  17           HG1      LYS  17 -12.508 -13.350  -9.393
  136    HD2  LYS  17           HD2      LYS  17 -12.202 -14.371 -11.531
  137    HD3  LYS  17           HD1      LYS  17 -11.964 -12.804 -12.306
  138    HE2  LYS  17           HE2      LYS  17  -9.812 -13.727 -12.080
  139    HE3  LYS  17           HE1      LYS  17  -9.945 -12.522 -10.799
  140    HZ1  LYS  17           HZ1      LYS  17 -10.269 -15.459 -10.480
  141    HZ2  LYS  17           HZ2      LYS  17 -10.464 -14.321  -9.244
  142    HZ3  LYS  17           HZ3      LYS  17  -8.948 -14.535  -9.962
  143    H    ALA  18           HN       ALA  18 -16.381 -13.299  -9.090
  144    HA   ALA  18           HA       ALA  18 -16.445 -13.220  -6.270
  145    HB1  ALA  18           HB1      ALA  18 -18.163 -14.306  -7.596
  146    HB2  ALA  18           HB2      ALA  18 -17.502 -15.430  -6.408
  147    HB3  ALA  18           HB3      ALA  18 -17.016 -15.548  -8.099
  148    H    SER  19           HN       SER  19 -14.343 -15.051  -8.469
  149    HA   SER  19           HA       SER  19 -13.217 -16.829  -6.595
  150    HB2  SER  19           HB2      SER  19 -12.836 -17.066  -8.980
  151    HB3  SER  19           HB1      SER  19 -11.951 -15.542  -9.024
  152    HG   SER  19           HG       SER  19 -10.731 -17.639  -8.868
  153    H    LEU  20           HN       LEU  20 -12.316 -13.468  -7.381
  154    HA   LEU  20           HA       LEU  20  -9.999 -13.494  -5.648
  155    HB2  LEU  20           HB2      LEU  20 -11.567 -11.244  -6.896
  156    HB3  LEU  20           HB1      LEU  20 -10.098 -11.009  -5.978
  157    HG   LEU  20           HG       LEU  20 -10.316 -12.588  -8.539
  158   HD11  LEU  20          HD11      LEU  20 -10.608 -10.162  -8.841
  159   HD12  LEU  20          HD12      LEU  20  -9.118 -10.764  -9.570
  160   HD13  LEU  20          HD13      LEU  20  -9.062  -9.897  -8.036
  161   HD21  LEU  20          HD21      LEU  20  -8.573 -13.473  -7.118
  162   HD22  LEU  20          HD22      LEU  20  -7.927 -11.854  -6.852
  163   HD23  LEU  20          HD23      LEU  20  -7.851 -12.582  -8.457
  164    H    GLN  21           HN       GLN  21  -9.697 -12.169  -3.746
  165    HA   GLN  21           HA       GLN  21 -12.206 -11.959  -2.149
  166    HB2  GLN  21           HB2      GLN  21 -10.919 -12.564  -0.171
  167    HB3  GLN  21           HB1      GLN  21 -10.801 -13.822  -1.390
  168    HG2  GLN  21           HG2      GLN  21  -8.681 -11.744  -1.318
  169    HG3  GLN  21           HG1      GLN  21  -8.700 -12.958  -0.043
  170   HE21  GLN  21          HE21      GLN  21  -6.729 -13.811  -0.718
  171   HE22  GLN  21          HE22      GLN  21  -6.614 -14.815  -2.204
  172    HA   PRO  22           HA       PRO  22 -11.273  -7.699  -1.386
  173    HB2  PRO  22           HB2      PRO  22 -12.300  -8.078   1.357
  174    HB3  PRO  22           HB1      PRO  22 -12.907  -7.039   0.066
  175    HG2  PRO  22           HG2      PRO  22 -14.233  -9.237   0.793
  176    HG3  PRO  22           HG1      PRO  22 -14.143  -8.739  -0.905
  177    HD2  PRO  22           HD2      PRO  22 -12.574 -10.856   0.532
  178    HD3  PRO  22           HD1      PRO  22 -13.338 -10.916  -1.073
  179    H    LEU  23           HN       LEU  23 -10.111  -6.212   0.118
  180    HA   LEU  23           HA       LEU  23  -8.275  -7.576   1.983
  181    HB2  LEU  23           HB2      LEU  23  -7.308  -7.471  -0.404
  182    HB3  LEU  23           HB1      LEU  23  -7.123  -5.757  -0.106
  183    HG   LEU  23           HG       LEU  23  -5.876  -7.915   1.603
  184   HD11  LEU  23          HD11      LEU  23  -3.784  -7.377   0.497
  185   HD12  LEU  23          HD12      LEU  23  -4.611  -6.223  -0.548
  186   HD13  LEU  23          HD13      LEU  23  -4.973  -7.943  -0.676
  187   HD21  LEU  23          HD21      LEU  23  -5.548  -4.921   1.515
  188   HD22  LEU  23          HD22      LEU  23  -4.460  -6.009   2.376
  189   HD23  LEU  23          HD23      LEU  23  -6.153  -5.898   2.853
  190    H    THR  24           HN       THR  24  -8.315  -6.485   3.812
  191    HA   THR  24           HA       THR  24  -8.512  -3.513   3.636
  192    HB   THR  24           HB       THR  24  -9.732  -5.223   5.812
  193    HG1  THR  24           HG1      THR  24 -11.516  -5.218   4.656
  194   HG21  THR  24          HG21      THR  24 -10.819  -3.138   6.504
  195   HG22  THR  24          HG22      THR  24  -9.973  -2.268   5.225
  196   HG23  THR  24          HG23      THR  24  -9.063  -2.982   6.557
  197    H    ILE  25           HN       ILE  25  -6.287  -3.199   3.787
  198    HA   ILE  25           HA       ILE  25  -5.181  -3.844   6.480
  199    HB   ILE  25           HB       ILE  25  -4.284  -5.385   4.717
  200   HG12  ILE  25          HG12      ILE  25  -1.872  -5.014   5.343
  201   HG13  ILE  25          HG11      ILE  25  -2.363  -3.514   6.115
  202   HG21  ILE  25          HG21      ILE  25  -2.821  -2.974   3.670
  203   HG22  ILE  25          HG22      ILE  25  -4.282  -3.618   2.924
  204   HG23  ILE  25          HG23      ILE  25  -2.829  -4.613   3.017
  205   HD11  ILE  25          HD11      ILE  25  -3.378  -6.247   6.855
  206   HD12  ILE  25          HD12      ILE  25  -3.746  -4.728   7.673
  207   HD13  ILE  25          HD13      ILE  25  -2.103  -5.369   7.697
  208    H    SER  26           HN       SER  26  -3.521  -2.445   7.268
  209    HA   SER  26           HA       SER  26  -3.657   0.259   6.015
  210    HB2  SER  26           HB2      SER  26  -4.656   0.097   8.267
  211    HB3  SER  26           HB1      SER  26  -3.120  -0.490   8.901
  212    HG   SER  26           HG       SER  26  -2.423   1.486   8.963
  213    H    LEU  27           HN       LEU  27  -1.759   1.685   6.582
  214    HA   LEU  27           HA       LEU  27   0.619   0.728   5.416
  215    HB2  LEU  27           HB2      LEU  27   0.344   2.973   7.397
  216    HB3  LEU  27           HB1      LEU  27   1.657   2.746   6.260
  217    HG   LEU  27           HG       LEU  27  -1.206   3.432   5.604
  218   HD11  LEU  27          HD11      LEU  27   1.375   4.954   5.280
  219   HD12  LEU  27          HD12      LEU  27   0.081   5.309   6.424
  220   HD13  LEU  27          HD13      LEU  27  -0.202   5.480   4.692
  221   HD21  LEU  27          HD21      LEU  27  -0.291   1.871   3.950
  222   HD22  LEU  27          HD22      LEU  27   1.096   2.935   3.720
  223   HD23  LEU  27          HD23      LEU  27  -0.520   3.483   3.275
  224    H    ASP  28           HN       ASP  28   0.224   1.570   8.869
  225    HA   ASP  28           HA       ASP  28   2.691   0.412   9.668
  226    HB2  ASP  28           HB2      ASP  28   1.374   2.100  10.953
  227    HB3  ASP  28           HB1      ASP  28   0.225   0.834  11.368
  228    H    GLU  29           HN       GLU  29  -0.546  -0.954   9.333
  229    HA   GLU  29           HA       GLU  29   0.142  -3.388  10.765
  230    HB2  GLU  29           HB2      GLU  29  -2.156  -2.363  10.616
  231    HB3  GLU  29           HB1      GLU  29  -2.215  -2.905   8.946
  232    HG2  GLU  29           HG2      GLU  29  -3.400  -4.424  10.433
  233    HG3  GLU  29           HG1      GLU  29  -2.029  -5.214   9.659
  234    H    LEU  30           HN       LEU  30   1.074  -2.303   7.718
  235    HA   LEU  30           HA       LEU  30   1.278  -5.134   6.826
  236    HB2  LEU  30           HB2      LEU  30  -0.429  -3.782   5.560
  237    HB3  LEU  30           HB1      LEU  30   0.885  -2.781   4.978
  238    HG   LEU  30           HG       LEU  30   1.871  -4.717   3.838
  239   HD11  LEU  30          HD11      LEU  30  -0.532  -6.188   4.908
  240   HD12  LEU  30          HD12      LEU  30   1.163  -6.505   5.284
  241   HD13  LEU  30          HD13      LEU  30   0.548  -6.802   3.658
  242   HD21  LEU  30          HD21      LEU  30  -1.045  -4.363   3.173
  243   HD22  LEU  30          HD22      LEU  30   0.223  -4.929   2.086
  244   HD23  LEU  30          HD23      LEU  30   0.248  -3.270   2.684
  245    H    PHE  31           HN       PHE  31   3.129  -2.823   8.037
  246    HA   PHE  31           HA       PHE  31   5.355  -3.703   6.323
  247    HB2  PHE  31           HB2      PHE  31   5.125  -0.819   7.219
  248    HB3  PHE  31           HB1      PHE  31   6.407  -1.499   6.224
  249    HD1  PHE  31           HD1      PHE  31   5.264  -2.905   4.118
  250    HD2  PHE  31           HD2      PHE  31   3.707   0.541   6.065
  251    HE1  PHE  31           HE1      PHE  31   3.972  -2.350   2.099
  252    HE2  PHE  31           HE2      PHE  31   2.410   1.099   4.052
  253    HZ   PHE  31           HZ       PHE  31   2.540  -0.350   2.067
  254    H    SER  32           HN       SER  32   7.345  -4.046   7.316
  255    HA   SER  32           HA       SER  32   7.414  -3.511  10.235
  256    HB2  SER  32           HB2      SER  32   8.107  -6.109   8.874
  257    HB3  SER  32           HB1      SER  32   8.402  -5.759  10.578
  258    HG   SER  32           HG       SER  32   6.320  -6.865   9.799
  259    H    SER  33           HN       SER  33   8.706  -2.052   8.043
  260    HA   SER  33           HA       SER  33  11.421  -2.101   9.035
  261    HB2  SER  33           HB2      SER  33  11.689  -3.993   7.566
  262    HB3  SER  33           HB1      SER  33  10.901  -3.137   6.242
  263    HG   SER  33           HG       SER  33  13.317  -3.222   6.317
  264    H    ARG  34           HN       ARG  34  12.424  -0.173   8.780
  265    HA   ARG  34           HA       ARG  34  10.890   1.995   7.715
  266    HB2  ARG  34           HB2      ARG  34  12.906   3.363   8.107
  267    HB3  ARG  34           HB1      ARG  34  12.489   2.373   9.498
  268    HG2  ARG  34           HG2      ARG  34  14.246   0.788   8.907
  269    HG3  ARG  34           HG1      ARG  34  14.654   1.762   7.493
  270    HD2  ARG  34           HD2      ARG  34  15.260   3.629   8.920
  271    HD3  ARG  34           HD1      ARG  34  14.777   2.718  10.351
  272    HE   ARG  34           HE       ARG  34  16.704   1.172   9.009
  273   HH11  ARG  34          HH11      ARG  34  16.507   4.310  10.640
  274   HH12  ARG  34          HH12      ARG  34  18.168   4.295  11.129
  275   HH21  ARG  34          HH21      ARG  34  18.881   1.192   9.675
  276   HH22  ARG  34          HH22      ARG  34  19.517   2.523  10.581
  277    H    GLY  35           HN       GLY  35  13.669   0.140   6.448
  278    HA2  GLY  35           HA2      GLY  35  13.964   1.718   4.064
  279    HA3  GLY  35           HA1      GLY  35  14.558   0.083   4.305
  280    H    GLU  36           HN       GLU  36  12.072  -1.191   4.858
  281    HA   GLU  36           HA       GLU  36  11.179  -1.770   2.233
  282    HB2  GLU  36           HB2      GLU  36  10.845  -3.317   4.084
  283    HB3  GLU  36           HB1      GLU  36   9.790  -2.167   4.893
  284    HG2  GLU  36           HG2      GLU  36   8.454  -3.869   3.886
  285    HG3  GLU  36           HG1      GLU  36   8.202  -2.361   3.010
  286    H    PHE  37           HN       PHE  37   9.925   0.424   4.737
  287    HA   PHE  37           HA       PHE  37   7.556   1.235   3.436
  288    HB2  PHE  37           HB2      PHE  37   8.402   1.785   5.805
  289    HB3  PHE  37           HB1      PHE  37   9.300   3.098   5.052
  290    HD1  PHE  37           HD2      PHE  37   5.912   1.762   5.667
  291    HD2  PHE  37           HD1      PHE  37   8.235   5.118   4.454
  292    HE1  PHE  37           HE2      PHE  37   3.916   3.193   5.816
  293    HE2  PHE  37           HE1      PHE  37   6.241   6.555   4.605
  294    HZ   PHE  37           HZ       PHE  37   4.079   5.592   5.286
  295    H    ILE  38           HN       ILE  38  10.891   2.510   3.204
  296    HA   ILE  38           HA       ILE  38  10.418   4.637   1.455
  297    HB   ILE  38           HB       ILE  38  12.811   2.792   1.504
  298   HG12  ILE  38          HG12      ILE  38  12.437   3.771   3.680
  299   HG13  ILE  38          HG11      ILE  38  13.798   4.592   2.927
  300   HG21  ILE  38          HG21      ILE  38  14.018   4.762   0.566
  301   HG22  ILE  38          HG22      ILE  38  12.454   5.537   0.311
  302   HG23  ILE  38          HG23      ILE  38  12.846   4.041  -0.538
  303   HD11  ILE  38          HD11      ILE  38  10.978   5.623   3.150
  304   HD12  ILE  38          HD12      ILE  38  12.293   6.440   2.303
  305   HD13  ILE  38          HD13      ILE  38  12.389   6.188   4.046
  306    H    SER  39           HN       SER  39  11.252   1.230   0.578
  307    HA   SER  39           HA       SER  39  11.117   1.677  -2.229
  308    HB2  SER  39           HB2      SER  39  10.603  -0.874  -0.649
  309    HB3  SER  39           HB1      SER  39  10.837  -0.808  -2.395
  310    HG   SER  39           HG       SER  39  12.907  -0.658  -2.085
  311    H    VAL  40           HN       VAL  40   8.673  -0.138  -0.259
  312    HA   VAL  40           HA       VAL  40   6.656  -0.420  -1.940
  313    HB   VAL  40           HB       VAL  40   5.000  -0.038  -0.146
  314   HG11  VAL  40          HG11      VAL  40   6.186  -2.152  -0.304
  315   HG12  VAL  40          HG12      VAL  40   5.888  -1.733   1.381
  316   HG13  VAL  40          HG13      VAL  40   7.494  -1.511   0.689
  317   HG21  VAL  40          HG21      VAL  40   7.371   0.956   1.425
  318   HG22  VAL  40          HG22      VAL  40   5.773   0.614   2.086
  319   HG23  VAL  40          HG23      VAL  40   5.983   1.915   0.915
  320    H    GLY  41           HN       GLY  41   7.383   2.861  -0.587
  321    HA2  GLY  41           HA2      GLY  41   6.843   4.530  -2.449
  322    HA3  GLY  41           HA1      GLY  41   5.219   3.865  -2.367
  323    H    GLY  42           HN       GLY  42   7.494   4.568   0.312
  324    HA2  GLY  42           HA2      GLY  42   5.444   6.504   1.309
  325    HA3  GLY  42           HA1      GLY  42   6.342   5.428   2.356
  326    H    ASP  43           HN       ASP  43   6.354   8.365   0.517
  327    HA   ASP  43           HA       ASP  43   9.099   9.002   1.395
  328    HB2  ASP  43           HB2      ASP  43   7.110  10.507  -0.317
  329    HB3  ASP  43           HB1      ASP  43   8.697  11.140   0.113
  330    H    GLY  44           HN       GLY  44   6.246  11.174   1.301
  331    HA2  GLY  44           HA2      GLY  44   6.256  11.354   4.238
  332    HA3  GLY  44           HA1      GLY  44   6.813  12.789   3.396
  333    H    ARG  45           HN       ARG  45   5.318  13.679   1.692
  334    HA   ARG  45           HA       ARG  45   2.637  13.778   2.892
  335    HB2  ARG  45           HB2      ARG  45   3.907  15.342   0.639
  336    HB3  ARG  45           HB1      ARG  45   2.260  15.590   1.197
  337    HG2  ARG  45           HG2      ARG  45   3.565  17.262   2.221
  338    HG3  ARG  45           HG1      ARG  45   3.222  16.070   3.476
  339    HD2  ARG  45           HD2      ARG  45   5.559  16.850   3.521
  340    HD3  ARG  45           HD1      ARG  45   5.429  15.118   3.229
  341    HE   ARG  45           HE       ARG  45   5.641  16.808   0.836
  342   HH11  ARG  45          HH11      ARG  45   7.333  14.810   3.223
  343   HH12  ARG  45          HH12      ARG  45   8.707  14.548   2.206
  344   HH21  ARG  45          HH21      ARG  45   7.472  16.437  -0.467
  345   HH22  ARG  45          HH22      ARG  45   8.788  15.472   0.112
  346    H    MET  46           HN       MET  46   1.623  11.872   2.424
  347    HA   MET  46           HA       MET  46   1.506  10.990  -0.382
  348    HB2  MET  46           HB2      MET  46   1.658   9.518   1.789
  349    HB3  MET  46           HB1      MET  46  -0.088   9.726   1.814
  350    HG2  MET  46           HG2      MET  46  -0.268   8.049   0.390
  351    HG3  MET  46           HG1      MET  46   0.572   9.018  -0.816
  352    HE1  MET  46           HE1      MET  46   4.307   7.978  -0.216
  353    HE2  MET  46           HE2      MET  46   3.444   9.328   0.518
  354    HE3  MET  46           HE3      MET  46   3.214   8.959  -1.190
  355    H    SER  47           HN       SER  47  -0.721  10.241  -1.207
  356    HA   SER  47           HA       SER  47  -2.486  12.588  -0.951
  357    HB2  SER  47           HB2      SER  47  -2.321  10.330  -2.938
  358    HB3  SER  47           HB1      SER  47  -3.659  11.478  -2.928
  359    HG   SER  47           HG       SER  47  -2.301  13.088  -3.479
  360    H    HIS  48           HN       HIS  48  -3.376   9.194  -1.585
  361    HA   HIS  48           HA       HIS  48  -4.882   8.737   0.831
  362    HB2  HIS  48           HB2      HIS  48  -7.138   8.894  -0.150
  363    HB3  HIS  48           HB1      HIS  48  -6.367  10.463   0.030
  364    HD1  HIS  48           HD1      HIS  48  -5.660  11.731  -2.135
  365    HD2  HIS  48           HD2      HIS  48  -7.694   8.119  -2.774
  366    HE1  HIS  48           HE1      HIS  48  -6.348  11.716  -4.577
  367    HE2  HIS  48           HE2      HIS  48  -7.563   9.519  -4.971
  368    H    LYS  49           HN       LYS  49  -4.922   8.101  -2.716
  369    HA   LYS  49           HA       LYS  49  -5.511   5.268  -2.185
  370    HB2  LYS  49           HB2      LYS  49  -6.520   6.534  -4.066
  371    HB3  LYS  49           HB1      LYS  49  -4.919   6.757  -4.755
  372    HG2  LYS  49           HG2      LYS  49  -4.695   4.472  -5.240
  373    HG3  LYS  49           HG1      LYS  49  -6.066   4.037  -4.218
  374    HD2  LYS  49           HD2      LYS  49  -6.686   3.935  -6.569
  375    HD3  LYS  49           HD1      LYS  49  -7.574   5.220  -5.753
  376    HE2  LYS  49           HE2      LYS  49  -5.994   6.868  -6.642
  377    HE3  LYS  49           HE1      LYS  49  -5.108   5.579  -7.457
  378    HZ1  LYS  49           HZ1      LYS  49  -7.952   6.269  -7.975
  379    HZ2  LYS  49           HZ2      LYS  49  -7.029   5.120  -8.806
  380    HZ3  LYS  49           HZ3      LYS  49  -6.647   6.762  -8.935
  381    H    GLU  50           HN       GLU  50  -2.765   7.361  -2.722
  382    HA   GLU  50           HA       GLU  50  -0.965   5.436  -3.811
  383    HB2  GLU  50           HB2      GLU  50  -0.454   7.942  -2.201
  384    HB3  GLU  50           HB1      GLU  50   0.784   7.044  -3.059
  385    HG2  GLU  50           HG2      GLU  50  -0.424   7.477  -5.173
  386    HG3  GLU  50           HG1      GLU  50  -1.571   8.467  -4.271
  387    H    ALA  51           HN       ALA  51  -1.461   6.593  -0.452
  388    HA   ALA  51           HA       ALA  51   0.600   5.155   0.768
  389    HB1  ALA  51           HB1      ALA  51  -2.115   5.727   1.953
  390    HB2  ALA  51           HB2      ALA  51  -0.774   6.870   1.882
  391    HB3  ALA  51           HB3      ALA  51  -0.629   5.399   2.844
  392    H    ILE  52           HN       ILE  52  -2.827   4.014   0.421
  393    HA   ILE  52           HA       ILE  52  -2.257   1.547   1.674
  394    HB   ILE  52           HB       ILE  52  -4.361   2.065  -0.455
  395   HG12  ILE  52          HG12      ILE  52  -4.452   3.593   1.518
  396   HG13  ILE  52          HG11      ILE  52  -5.868   2.571   1.362
  397   HG21  ILE  52          HG21      ILE  52  -5.550   0.167   0.527
  398   HG22  ILE  52          HG22      ILE  52  -4.204  -0.108   1.631
  399   HG23  ILE  52          HG23      ILE  52  -3.977  -0.315  -0.105
  400   HD11  ILE  52          HD11      ILE  52  -4.959   1.084   3.091
  401   HD12  ILE  52          HD12      ILE  52  -5.192   2.734   3.671
  402   HD13  ILE  52          HD13      ILE  52  -3.574   2.162   3.263
  403    H    LEU  53           HN       LEU  53  -2.155   2.454  -1.793
  404    HA   LEU  53           HA       LEU  53  -1.863  -0.121  -2.858
  405    HB2  LEU  53           HB2      LEU  53  -2.112   2.022  -4.140
  406    HB3  LEU  53           HB1      LEU  53  -0.441   2.432  -3.827
  407    HG   LEU  53           HG       LEU  53   0.256   0.417  -5.103
  408   HD11  LEU  53          HD11      LEU  53  -1.438  -0.650  -6.562
  409   HD12  LEU  53          HD12      LEU  53  -2.695   0.213  -5.674
  410   HD13  LEU  53          HD13      LEU  53  -1.686  -0.972  -4.846
  411   HD21  LEU  53          HD21      LEU  53  -1.462   2.477  -6.468
  412   HD22  LEU  53          HD22      LEU  53  -0.440   1.333  -7.335
  413   HD23  LEU  53          HD23      LEU  53   0.287   2.506  -6.237
  414    H    LEU  54           HN       LEU  54   0.600   1.788  -1.117
  415    HA   LEU  54           HA       LEU  54   3.032   0.735  -1.861
  416    HB2  LEU  54           HB2      LEU  54   1.789   1.431   0.795
  417    HB3  LEU  54           HB1      LEU  54   3.335   0.617   0.803
  418    HG   LEU  54           HG       LEU  54   4.332   2.406  -0.506
  419   HD11  LEU  54          HD11      LEU  54   1.599   3.664  -0.421
  420   HD12  LEU  54          HD12      LEU  54   2.424   3.051  -1.853
  421   HD13  LEU  54          HD13      LEU  54   3.068   4.450  -0.994
  422   HD21  LEU  54          HD21      LEU  54   2.767   3.456   1.846
  423   HD22  LEU  54          HD22      LEU  54   4.223   4.177   1.160
  424   HD23  LEU  54          HD23      LEU  54   4.303   2.594   1.932
  425    H    GLY  55           HN       GLY  55   0.452  -0.942   0.024
  426    HA2  GLY  55           HA2      GLY  55   1.791  -3.120   1.081
  427    HA3  GLY  55           HA1      GLY  55   0.145  -3.177   0.494
  428    H    LEU  56           HN       LEU  56   0.486  -2.952  -2.270
  429    HA   LEU  56           HA       LEU  56   0.993  -5.585  -3.020
  430    HB2  LEU  56           HB2      LEU  56   1.527  -3.209  -4.795
  431    HB3  LEU  56           HB1      LEU  56   1.136  -4.842  -5.302
  432    HG   LEU  56           HG       LEU  56  -0.694  -2.832  -4.003
  433   HD11  LEU  56          HD11      LEU  56  -0.449  -2.542  -6.372
  434   HD12  LEU  56          HD12      LEU  56  -2.028  -3.257  -6.049
  435   HD13  LEU  56          HD13      LEU  56  -0.712  -4.263  -6.654
  436   HD21  LEU  56          HD21      LEU  56  -1.270  -4.846  -2.923
  437   HD22  LEU  56          HD22      LEU  56  -1.057  -5.790  -4.395
  438   HD23  LEU  56          HD23      LEU  56  -2.419  -4.679  -4.250
  439    H    ARG  57           HN       ARG  57   3.309  -2.868  -2.989
  440    HA   ARG  57           HA       ARG  57   5.486  -4.310  -4.135
  441    HB2  ARG  57           HB2      ARG  57   5.551  -2.011  -2.169
  442    HB3  ARG  57           HB1      ARG  57   6.904  -2.550  -3.152
  443    HG2  ARG  57           HG2      ARG  57   4.311  -1.493  -4.257
  444    HG3  ARG  57           HG1      ARG  57   5.770  -0.531  -4.021
  445    HD2  ARG  57           HD2      ARG  57   6.984  -2.050  -5.536
  446    HD3  ARG  57           HD1      ARG  57   5.489  -2.946  -5.808
  447    HE   ARG  57           HE       ARG  57   4.758  -0.414  -6.472
  448   HH11  ARG  57          HH11      ARG  57   7.499  -2.444  -7.430
  449   HH12  ARG  57          HH12      ARG  57   7.661  -1.697  -8.983
  450   HH21  ARG  57          HH21      ARG  57   5.008   0.540  -8.522
  451   HH22  ARG  57          HH22      ARG  57   6.246  -0.002  -9.604
  452    H    TYR  58           HN       TYR  58   4.304  -4.005  -0.817
  453    HA   TYR  58           HA       TYR  58   6.544  -5.236   0.467
  454    HB2  TYR  58           HB2      TYR  58   4.844  -3.878   1.637
  455    HB3  TYR  58           HB1      TYR  58   3.645  -5.126   1.334
  456    HD1  TYR  58           HD2      TYR  58   6.835  -4.450   3.104
  457    HD2  TYR  58           HD1      TYR  58   3.410  -6.952   2.797
  458    HE1  TYR  58           HE2      TYR  58   7.462  -5.555   5.208
  459    HE2  TYR  58           HE1      TYR  58   4.026  -8.064   4.902
  460    HH   TYR  58           HH       TYR  58   6.144  -8.447   6.236
  461    H    LYS  59           HN       LYS  59   3.402  -6.516  -0.631
  462    HA   LYS  59           HA       LYS  59   4.065  -9.239   0.127
  463    HB2  LYS  59           HB2      LYS  59   1.800  -8.060  -1.465
  464    HB3  LYS  59           HB1      LYS  59   1.919  -9.761  -1.039
  465    HG2  LYS  59           HG2      LYS  59   1.775  -7.478   0.918
  466    HG3  LYS  59           HG1      LYS  59   0.439  -8.541   0.471
  467    HD2  LYS  59           HD2      LYS  59   1.587 -10.450   1.393
  468    HD3  LYS  59           HD1      LYS  59   3.024  -9.478   1.711
  469    HE2  LYS  59           HE2      LYS  59   1.723  -8.104   3.280
  470    HE3  LYS  59           HE1      LYS  59   0.315  -9.124   2.988
  471    HZ1  LYS  59           HZ1      LYS  59   2.896 -10.044   4.137
  472    HZ2  LYS  59           HZ2      LYS  59   1.529 -11.006   3.880
  473    HZ3  LYS  59           HZ3      LYS  59   1.479  -9.752   5.014
  474    H    LYS  60           HN       LYS  60   4.907  -7.309  -2.540
  475    HA   LYS  60           HA       LYS  60   5.961  -7.811  -4.501
  476    HB2  LYS  60           HB2      LYS  60   6.094 -10.664  -3.500
  477    HB3  LYS  60           HB1      LYS  60   7.052  -9.971  -4.799
  478    HG2  LYS  60           HG2      LYS  60   7.164  -9.086  -1.922
  479    HG3  LYS  60           HG1      LYS  60   8.297 -10.205  -2.684
  480    HD2  LYS  60           HD2      LYS  60   7.800  -7.385  -3.636
  481    HD3  LYS  60           HD1      LYS  60   9.108  -7.844  -2.544
  482    HE2  LYS  60           HE2      LYS  60   9.997  -9.360  -4.245
  483    HE3  LYS  60           HE1      LYS  60   8.687  -8.910  -5.335
  484    HZ1  LYS  60           HZ1      LYS  60   9.514  -6.620  -5.287
  485    HZ2  LYS  60           HZ2      LYS  60  10.680  -7.695  -5.876
  486    HZ3  LYS  60           HZ3      LYS  60  10.802  -7.099  -4.298
  487    H    LEU  61           HN       LEU  61   3.647  -7.320  -5.123
  488    HA   LEU  61           HA       LEU  61   2.932  -9.152  -7.216
  489    HB2  LEU  61           HB2      LEU  61   0.504  -9.424  -6.291
  490    HB3  LEU  61           HB1      LEU  61   1.769 -10.523  -5.788
  491    HG   LEU  61           HG       LEU  61   2.038  -9.264  -3.690
  492   HD11  LEU  61          HD11      LEU  61   0.456  -7.542  -3.061
  493   HD12  LEU  61          HD12      LEU  61  -0.328  -7.657  -4.636
  494   HD13  LEU  61          HD13      LEU  61   1.330  -7.066  -4.517
  495   HD21  LEU  61          HD21      LEU  61  -0.815 -10.080  -4.226
  496   HD22  LEU  61          HD22      LEU  61  -0.033  -9.971  -2.648
  497   HD23  LEU  61          HD23      LEU  61   0.503 -11.177  -3.817
  498    H    TYR  62           HN       TYR  62   3.554  -6.312  -6.837
  499    HA   TYR  62           HA       TYR  62   1.219  -4.721  -7.089
  500    HB2  TYR  62           HB2      TYR  62   3.398  -3.779  -6.566
  501    HB3  TYR  62           HB1      TYR  62   4.023  -4.274  -8.135
  502    HD1  TYR  62           HD1      TYR  62   1.398  -2.125  -6.590
  503    HD2  TYR  62           HD2      TYR  62   3.972  -2.776  -9.914
  504    HE1  TYR  62           HE1      TYR  62   0.725   0.041  -7.528
  505    HE2  TYR  62           HE2      TYR  62   3.306  -0.608 -10.862
  506    HH   TYR  62           HH       TYR  62   1.698   1.750  -9.118
  507    H    ASN  63           HN       ASN  63   2.581  -6.960  -9.316
  508    HA   ASN  63           HA       ASN  63   1.835  -5.635 -11.751
  509    HB2  ASN  63           HB2      ASN  63   2.369  -8.547 -11.151
  510    HB3  ASN  63           HB1      ASN  63   2.136  -7.898 -12.771
  511   HD21  ASN  63          HD21      ASN  63   4.248  -8.138 -10.014
  512   HD22  ASN  63          HD22      ASN  63   5.694  -7.434 -10.817
  513    H    GLN  64           HN       GLN  64   0.350  -8.566 -10.241
  514    HA   GLN  64           HA       GLN  64  -2.072  -7.978 -11.820
  515    HB2  GLN  64           HB2      GLN  64  -1.197 -10.416 -10.292
  516    HB3  GLN  64           HB1      GLN  64  -2.784 -10.268 -11.032
  517    HG2  GLN  64           HG2      GLN  64  -0.169 -10.091 -12.510
  518    HG3  GLN  64           HG1      GLN  64  -1.179 -11.529 -12.406
  519   HE21  GLN  64          HE21      GLN  64  -0.823  -8.318 -13.743
  520   HE22  GLN  64          HE22      GLN  64  -2.130  -8.477 -14.967
  521    H    ALA  65           HN       ALA  65  -0.994  -7.477  -8.577
  522    HA   ALA  65           HA       ALA  65  -3.521  -7.983  -7.278
  523    HB1  ALA  65           HB1      ALA  65  -1.400  -7.908  -6.070
  524    HB2  ALA  65           HB2      ALA  65  -2.575  -6.776  -5.404
  525    HB3  ALA  65           HB3      ALA  65  -1.260  -6.186  -6.421
  526    H    ARG  66           HN       ARG  66  -1.971  -5.058  -8.612
  527    HA   ARG  66           HA       ARG  66  -3.975  -3.220  -7.781
  528    HB2  ARG  66           HB2      ARG  66  -1.701  -2.633  -8.599
  529    HB3  ARG  66           HB1      ARG  66  -2.208  -3.060 -10.227
  530    HG2  ARG  66           HG2      ARG  66  -3.985  -1.304 -10.035
  531    HG3  ARG  66           HG1      ARG  66  -3.233  -0.808  -8.517
  532    HD2  ARG  66           HD2      ARG  66  -2.398   0.606 -10.253
  533    HD3  ARG  66           HD1      ARG  66  -1.099  -0.480  -9.768
  534    HE   ARG  66           HE       ARG  66  -2.629  -0.549 -12.307
  535   HH11  ARG  66          HH11      ARG  66  -0.026  -1.868 -10.291
  536   HH12  ARG  66          HH12      ARG  66   0.728  -2.699 -11.608
  537   HH21  ARG  66          HH21      ARG  66  -1.602  -1.667 -14.002
  538   HH22  ARG  66          HH22      ARG  66  -0.163  -2.587 -13.711
  539    H    VAL  67           HN       VAL  67  -3.754  -5.349 -10.601
  540    HA   VAL  67           HA       VAL  67  -6.108  -4.098 -11.839
  541    HB   VAL  67           HB       VAL  67  -5.823  -5.784 -13.619
  542   HG11  VAL  67          HG11      VAL  67  -3.712  -4.914 -14.493
  543   HG12  VAL  67          HG12      VAL  67  -3.303  -4.294 -12.893
  544   HG13  VAL  67          HG13      VAL  67  -4.687  -3.636 -13.767
  545   HG21  VAL  67          HG21      VAL  67  -3.854  -7.234 -13.632
  546   HG22  VAL  67          HG22      VAL  67  -4.913  -7.610 -12.273
  547   HG23  VAL  67          HG23      VAL  67  -3.435  -6.687 -12.010
  548    H    LYS  68           HN       LYS  68  -5.281  -7.105 -10.132
  549    HA   LYS  68           HA       LYS  68  -7.797  -8.399 -10.638
  550    HB2  LYS  68           HB2      LYS  68  -5.610  -8.810  -8.618
  551    HB3  LYS  68           HB1      LYS  68  -7.092  -9.752  -8.553
  552    HG2  LYS  68           HG2      LYS  68  -6.675 -10.620 -10.774
  553    HG3  LYS  68           HG1      LYS  68  -5.231  -9.618 -10.918
  554    HD2  LYS  68           HD2      LYS  68  -4.154 -10.817  -9.132
  555    HD3  LYS  68           HD1      LYS  68  -5.627 -11.729  -8.801
  556    HE2  LYS  68           HE2      LYS  68  -4.153 -11.826 -11.427
  557    HE3  LYS  68           HE1      LYS  68  -3.872 -12.962 -10.110
  558    HZ1  LYS  68           HZ1      LYS  68  -6.442 -12.549 -11.543
  559    HZ2  LYS  68           HZ2      LYS  68  -6.218 -13.600 -10.237
  560    HZ3  LYS  68           HZ3      LYS  68  -5.414 -13.883 -11.699
  561    H    TYR  69           HN       TYR  69  -6.526  -6.593  -7.826
  562    HA   TYR  69           HA       TYR  69  -9.250  -6.598  -6.662
  563    HB2  TYR  69           HB2      TYR  69  -6.679  -5.544  -5.466
  564    HB3  TYR  69           HB1      TYR  69  -8.200  -5.825  -4.625
  565    HD1  TYR  69           HD1      TYR  69  -9.090  -8.344  -4.879
  566    HD2  TYR  69           HD2      TYR  69  -5.026  -7.131  -5.215
  567    HE1  TYR  69           HE1      TYR  69  -8.367 -10.633  -4.349
  568    HE2  TYR  69           HE2      TYR  69  -4.294  -9.416  -4.685
  569    HH   TYR  69           HH       TYR  69  -6.316 -12.066  -4.774
  570    H    SER  70           HN       SER  70 -10.203  -4.614  -5.838
  571    HA   SER  70           HA       SER  70 -10.019  -2.512  -7.813
  572    HB2  SER  70           HB2      SER  70 -12.147  -3.101  -6.732
  573    HB3  SER  70           HB1      SER  70 -11.507  -2.575  -5.176
  574    HG   SER  70           HG       SER  70 -12.496  -0.797  -5.841
  575    H    LEU  71           HN       LEU  71  -7.884  -1.749  -7.740
  576    HA   LEU  71           HA       LEU  71  -7.324  -0.057  -5.345
  577    HB2  LEU  71           HB2      LEU  71  -5.475  -1.729  -7.020
  578    HB3  LEU  71           HB1      LEU  71  -4.871  -0.354  -6.115
  579    HG   LEU  71           HG       LEU  71  -5.787  -1.418  -4.035
  580   HD11  LEU  71          HD11      LEU  71  -6.145  -3.913  -4.220
  581   HD12  LEU  71          HD12      LEU  71  -6.321  -3.662  -5.958
  582   HD13  LEU  71          HD13      LEU  71  -7.441  -2.890  -4.835
  583   HD21  LEU  71          HD21      LEU  71  -3.430  -1.565  -4.597
  584   HD22  LEU  71          HD22      LEU  71  -3.741  -2.990  -5.589
  585   HD23  LEU  71          HD23      LEU  71  -3.982  -3.060  -3.844
  586    H    LEU  72           HN       LEU  72  -5.766  -0.326  -8.548
  587    HA   LEU  72           HA       LEU  72  -6.542   2.516  -9.031
  588    HB2  LEU  72           HB2      LEU  72  -3.914   1.126  -9.364
  589    HB3  LEU  72           HB1      LEU  72  -4.320   2.455 -10.429
  590    HG   LEU  72           HG       LEU  72  -4.564   3.940  -8.478
  591   HD11  LEU  72          HD11      LEU  72  -3.742   1.489  -6.935
  592   HD12  LEU  72          HD12      LEU  72  -5.217   2.437  -6.750
  593   HD13  LEU  72          HD13      LEU  72  -3.663   3.128  -6.290
  594   HD21  LEU  72          HD21      LEU  72  -2.432   3.787  -9.649
  595   HD22  LEU  72          HD22      LEU  72  -1.940   2.464  -8.591
  596   HD23  LEU  72          HD23      LEU  72  -2.193   4.079  -7.925
  597    H    GLU  73           HN       GLU  73  -8.401   1.660 -10.143
  598    HA   GLU  73           HA       GLU  73  -7.707   0.428 -12.768
  599    HB2  GLU  73           HB2      GLU  73 -10.350   0.397 -11.294
  600    HB3  GLU  73           HB1      GLU  73 -10.019  -0.393 -12.829
  601    HG2  GLU  73           HG2      GLU  73  -8.662  -1.046 -10.223
  602    HG3  GLU  73           HG1      GLU  73 -10.010  -1.941 -10.918